A0A5K4F9T4_SCHMA Loading...

TRIM2_3

AlphaFold DB , UniProt , Accession A0A5K4F9T4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 960 aa.

						>A0A5K4F9T4_SCHMA|A0A5K4F9T4
MLNFEENVIINDENDIGSDQETNCSYSEHSNQTASIEIASMSSTISTLNTLDHALISTKVIDNSCNKQQQLMNLLNSDFLSCSFCHANDNVIKLLPCLHTVCRSCAISLNNHSMNQDNSAIKCKACHIAGLKLQKQYDPHNNNSFVNETLENNYNDEKYSTVQPEINSTTGSNCILEKEETSTVDELQFPNAIFIEKLRDLANLLQKETIRKCDYCMFENQNSEAQCRCIECGDNLCEPCAQAHKRTRITRLHTLLSYEDILVNGFLLRMREAPPTQCTDHEFSELNTISSNEIISNNQNVADNTVRNGSTIVDHHNNKSKTIIGHRCNWPSPSACFYCKSCNKLFKEHENHVVLSLEKAVHDAKIEINKQIDRVKRNSSQFENYLNNIVKYGHELSETELKITNQIQDRAEQLKKEIDQIANKLLNQLDKEIENEMKSIDHCAGSLPEEVLSCFDQVNKQLSYLGQKKIEYLKARIKTYFKSGGYSYCEDGIETKSKTFNSSYLFGSIESEKIVEEFSKNEIVNRSTIHQQNELKLELSNIYLNPDQISVGVNTSPRELETLTNYHEDNRYNNNDNELHLLNSDNRFKTNESFLTSGNGYTSDNAKHKSMVKEQYNQFKCQVTNELEFDARVSTDLRDVWPTGLAVNQSNGDIYVVDRDNSRIKLFTHDGTFISSLGDTGEMTDRLISPFDITLSSSRGIIFVSDYQRDEIRLFSFDGRSQGILTKNKLKHPRGVCYGIGLLAVVESRRHHISLYDIRCDTNSPVHQIPVDKGLAGEENNSNKFIFNSRTALTEPYYVEFVDDGGGCLGVTDWAAPSVKLYSLKTGSFLSSIGGYGTTNDNILQPYGICYAPWMKSFLIADHVNHRIQSCQIKHINENDTTILTNDFNRSIKQTNGLNQINVNGHKITSINLSSLKLIAEKGTHSIWHPMAITTDVQRKRIIVTEALGNVKVLKSMEAI
					

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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	26.2	Very low	27.8	Very low	98 Å²	98	127 Å²	127	48%	0.483	65%	0.652	S	S	.	*				0	-17.4	0	-75	-139.1	79.3	0	0	115.1	N3 F4 L198 L201	M1-N3 VanDerWaalsContact C-N 3.31Å; M1-N3 PolarHBondContact O-N 3.17Å; M1-F4 HydrophobicContact CE-CD2 4.26Å; M1-F4 HydrophobicContact CE-CE2 4.48Å; M1-L198 HydrophobicContact SD-CD2 4.28Å; M1-L201 HydrophobicContact SD-CD2 4.49Å
2	L	27.6	Very low	28	Very low	102 Å²	102	129.6 Å²	129.6	53%	0.534	67%	0.668	S	S	.	*	T	Hydrogen-bonded Turn	trans	-80.4	-4.3	175	-74	162.9	0	0	0	114.8	K365	L2-K365 PolarHBondContact O-NZ 3.33Å; L2-K365 VanDerWaalsContact O-NZ 3.16Å
3	N	29.3	Very low	27.8	Very low	95 Å²	95	131.9 Å²	131.9	51%	0.508	67%	0.674	S	S	.	*	T	Hydrogen-bonded Turn	trans	-91.7	5.1	170.7	-72.1	-2.2	0	0	0	113.4	M1 E5	M1-N3 VanDerWaalsContact C-N 3.31Å; M1-N3 PolarHBondContact O-N 3.17Å; N3-E5 VanDerWaalsContact C-N 3.33Å
4	F	29.8	Very low	28	Very low	112 Å²	112	132.1 Å²	132.1	49%	0.491	68%	0.677	S	S	.	*	S	Bend	trans	-82.1	-5.7	179.5	-94.3	-92.6	0	0	0	113.9	M1 K67	M1-F4 HydrophobicContact CE-CD2 4.26Å; M1-F4 HydrophobicContact CE-CE2 4.48Å; F4-K67 HydrophobicContact CE1-CD 4.37Å
5	E	30.6	Very low	28	Very low	118 Å²	118	131.9 Å²	131.9	55%	0.551	68%	0.678	S	S	*	*	S	Bend	trans	-102.4	-12.4	-170.8	-75	-177.1	147.3	0	0	116	N3 R271	N3-E5 VanDerWaalsContact C-N 3.33Å; E5-R271 IonicContact OE1-CZ 3.18Å; E5-R271 IonicContact OE1-NH1 3.88Å; E5-R271 PolarHBondContact OE1-NH1 2.96Å; E5-R271 IonicContact OE1-NH2 2.68Å
6	E	30	Very low	27.9	Very low	127 Å²	127	133.8 Å²	133.8	59%	0.593	69%	0.687	S	S	*	*	S	Bend	trans	-107.9	-2.4	-163.8	-83.4	163.3	-171.8	0	0	116.6	K365	E6-K365 IonicContact OE1-NZ 2.89Å; E6-K365 PolarHBondContact OE1-NZ 3.34Å; E6-K365 IonicContact OE2-NZ 2.63Å; E6-K365 PolarHBondContact OE2-NZ 3.42Å
7	N	28.8	Very low	27.9	Very low	159 Å²	159	130.4 Å²	130.4	85%	0.85	69%	0.694	S	S	*	*			trans	-116	27.8	-174.1	-72.3	-14.4	0	0	0	115.6
8	V	26.4	Very low	27.8	Very low	128 Å²	128	128.7 Å²	128.7	78%	0.776	69%	0.694	S	S	*	*			trans	-106.1	98.3	165.5	-177.3	0	0	0	0	106.3
9	I	25.8	Very low	27.8	Very low	154 Å²	154	129.7 Å²	129.7	79%	0.79	70%	0.699	S	S	*	*	S	Bend	trans	149.2	124.8	157.8	-73.9	152.5	0	0	0	108.1
10	I	27.8	Very low	27.8	Very low	155 Å²	155	132.8 Å²	132.8	80%	0.795	71%	0.709	S	S	*	*			trans	96.5	88.7	174.9	-43.8	173.9	0	0	0	115.3
11	N	23.7	Very low	27.6	Very low	149 Å²	149	136.1 Å²	136.1	80%	0.797	72%	0.72	S	S	*	*			trans	-67.9	141	151.7	-64.2	-30.5	0	0	0	108.9
12	D	29.4	Very low	27.6	Very low	158 Å²	158	138.2 Å²	138.2	85%	0.845	74%	0.738	S	S	*	*			trans	-166.2	144.8	133.2	-91	-20.9	0	0	0	110
13	E	26.4	Very low	27.4	Very low	160 Å²	160	141.2 Å²	141.2	75%	0.748	76%	0.755	S	S	*	*			trans	-87.6	171.1	-152.1	-56.9	170.2	143.2	0	0	115.7
14	N	29.9	Very low	27.1	Very low	134 Å²	134	142.6 Å²	142.6	72%	0.717	77%	0.771	S	S	*	*			trans	86.3	136.5	160.7	-44.1	-43.8	0	0	0	116.6
15	D	28.9	Very low	26.8	Very low	129 Å²	129	142 Å²	142	69%	0.69	78%	0.78	S	S	*	*			cis	-163.9	136.2	2.1	-119.6	-27.9	0	0	0	110.6
16	I	25.5	Very low	26.5	Very low	162 Å²	162	146.6 Å²	146.6	83%	0.831	79%	0.794	S	S	*	*			trans	26.7	132.1	135.8	-53.2	171.3	0	0	0	121.5
17	G	28.3	Very low	26.4	Very low	77 Å²	77	145.6 Å²	145.6	79%	0.794	80%	0.801	S	S	*	*			trans	171.4	99.7	149.8	0	0	0	0	0	115.6
18	S	25.1	Very low	26.1	Very low	99 Å²	99	146.6 Å²	146.6	69%	0.692	80%	0.801	S	S	*	*			trans	-86.8	164.3	179.7	53.9	0	0	0	0	115
19	D	29	Very low	26.1	Very low	148 Å²	148	149.3 Å²	149.3	79%	0.791	81%	0.805	S	S	*	*			trans	171.1	100.7	134.2	-80	-12.5	0	0	0	109.9
20	Q	27.4	Very low	26.1	Very low	192 Å²	192	146.5 Å²	146.5	90%	0.897	80%	0.799	S	S	*	*				63.9	104.4	97	-75	-163.7	-8.6	0	0	117.4
21	E	23.5	Very low	26	Very low	202 Å²	202	146.9 Å²	146.9	94%	0.944	80%	0.802	S	S	*	*			trans	-94.6	139	166	-77.4	-178.6	156.4	0	0	111.9
22	T	26.4	Very low	26	Very low	142 Å²	142	148.3 Å²	148.3	87%	0.871	80%	0.804	S	S	*	*			trans	-106.1	134.6	174.8	43.3	0	0	0	0	112.2
23	N	23.5	Very low	25.9	Very low	166 Å²	166	147.8 Å²	147.8	89%	0.888	81%	0.807	S	S	*	*			trans	-54.2	149.4	169.9	-75.7	-32.2	0	0	0	114.8
24	C	22.4	Very low	26	Very low	124 Å²	124	143.8 Å²	143.8	84%	0.838	80%	0.801	S	S	*	*			trans	-156.2	137.2	139.5	-147.1	0	0	0	0	112.6
25	S	22.9	Very low	26	Very low	99 Å²	99	141.4 Å²	141.4	69%	0.692	80%	0.795	S	S	*	*			trans	-120.6	132.1	-176.9	52.4	0	0	0	0	110.3
26	Y	26.1	Very low	25.9	Very low	214 Å²	214	142.8 Å²	142.8	84%	0.839	80%	0.801	S	S	*	*			trans	-159.9	106.6	161.2	-90.6	-78.5	0	0	0	107.5
27	S	26.3	Very low	26.2	Very low	106 Å²	106	142.8 Å²	142.8	74%	0.741	80%	0.797	S	S	*	*				90.2	123	82.2	74.9	0	0	0	0	113.9
28	E	22.8	Very low	26.3	Very low	181 Å²	181	144.9 Å²	144.9	85%	0.846	79%	0.789	S	S	*	*			trans	-65.5	140.2	-173	-59.2	166.9	145.4	0	0	114.3
29	H	27.6	Very low	26.4	Very low	185 Å²	185	143.1 Å²	143.1	86%	0.856	78%	0.78	S	S	*	*			trans	-151.2	107	143.3	-94.3	-60.2	0	0	0	111
30	S	24.7	Very low	26.4	Very low	94 Å²	94	139.3 Å²	139.3	66%	0.657	77%	0.765	S	S	*	*			trans	13.8	111.9	143.4	57.5	0	0	0	0	118.5
31	N	25.6	Very low	26.4	Very low	163 Å²	163	135.1 Å²	135.1	87%	0.872	75%	0.747	S	S	*	*			trans	-152.1	102.9	132.4	-96.2	-23.1	0	0	0	109.1	T33	N31-T33 PolarHBondContact O-N 3.06Å
32	Q	24.8	Very low	26.7	Very low	179 Å²	179	129 Å²	129	84%	0.836	73%	0.726	S	S	*	*			trans	-68	116.6	173.5	-71.8	169	-32.1	0	0	108.4
33	T	26.7	Very low	26.7	Very low	148 Å²	148	125.3 Å²	125.3	91%	0.908	71%	0.706	S	S	*	*	S	Bend	trans	178.1	-4.5	148.4	24	0	0	0	0	114.7	N31	N31-T33 PolarHBondContact O-N 3.06Å
34	A	29	Very low	26.9	Very low	76 Å²	76	121.1 Å²	121.1	63%	0.628	69%	0.687	S	S	*	*	S	Bend	trans	-114.6	16.3	-179.2	0	0	0	0	0	115.5
35	S	28.5	Very low	27.3	Very low	83 Å²	83	118.7 Å²	118.7	58%	0.58	67%	0.665	S	S	*	*			trans	-95.9	-2.5	-162.7	-43.1	0	0	0	0	116.1
36	I	28	Very low	27.5	Very low	158 Å²	158	117.1 Å²	117.1	81%	0.81	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.9	-27	-172.2	-62.8	176.3	0	0	0	112.5
37	E	31.4	Very low	27.6	Very low	163 Å²	163	111.1 Å²	111.1	76%	0.762	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.3	-23.1	178.9	-69.8	-177.6	164	0	0	113.4	A39 S40	E37-A39 VanDerWaalsContact C-N 3.33Å; E37-S40 PolarHBondContact O-OG 3.28Å
38	I	30.1	Very low	27.7	Very low	121 Å²	121	109.4 Å²	109.4	62%	0.621	62%	0.622	S	S	*	*	H	α-helix	trans	-74.4	-25.2	175	-61.2	175.2	0	0	0	111.4	M41 S42	I38-M41 PolarHBondContact O-N 3.32Å; I38-S42 WeakPolarHBondContact O-CB 3.39Å; I38-S42 PolarHBondContact O-N 3.24Å
39	A	27.6	Very low	28	Very low	61 Å²	61	105 Å²	105	50%	0.504	60%	0.604	S	S	.	*	H	α-helix	trans	-71.1	-29.5	178.3	0	0	0	0	0	113.6	E37 S42 S43	E37-A39 VanDerWaalsContact C-N 3.33Å; A39-S42 PolarHBondContact O-N 3.19Å; A39-S43 PolarHBondContact O-N 3.07Å
40	S	28.2	Very low	28.1	Very low	68 Å²	68	100.6 Å²	100.6	48%	0.476	59%	0.59	S	S	.	*	H	α-helix	trans	-78.3	-30.1	175.8	77.1	0	0	0	0	112.3	E37 S43 T44	E37-S40 PolarHBondContact O-OG 3.28Å; S40-S43 PolarHBondContact O-OG 3.13Å; S40-T44 PolarHBondContact O-N 3.1Å; S40-T44 PolarHBondContact O-OG1 3.42Å
41	M	29.1	Very low	28.3	Very low	105 Å²	105	100.7 Å²	100.7	52%	0.517	58%	0.583	S	S	.	*	H	α-helix	trans	-71.4	-33.9	169.9	-69	-179.2	69.4	0	0	111.3	I38 T44 I45	I38-M41 PolarHBondContact O-N 3.32Å; M41-T44 CarbonylContact O-C 3.54Å; M41-T44 PolarHBondContact O-N 2.96Å; M41-I45 WeakPolarHBondContact O-CB 3.32Å; M41-I45 WeakPolarHBondContact O-CD1 3.44Å; M41-I45 WeakPolarHBondContact O-CG1 3.47Å; M41-I45 PolarHBondContact O-N 3.38Å
42	S	28.3	Very low	28.6	Very low	72 Å²	72	97 Å²	97	50%	0.503	56%	0.563	S	S	.	*	H	α-helix	trans	-69.1	-33.2	176.1	-155.1	0	0	0	0	113.3	I38 A39 I45 S46	I38-S42 WeakPolarHBondContact O-CB 3.39Å; I38-S42 PolarHBondContact O-N 3.24Å; A39-S42 PolarHBondContact O-N 3.19Å; S42-I45 PolarHBondContact O-N 3.34Å; S42-S46 PolarHBondContact O-N 3.12Å
43	S	27.3	Very low	28.9	Very low	65 Å²	65	93.3 Å²	93.3	46%	0.455	55%	0.545	S	S	.	.	H	α-helix	trans	-73.8	-27.1	171.1	66.8	0	0	0	0	113.1	A39 S40 S46 T47	A39-S43 PolarHBondContact O-N 3.07Å; S40-S43 PolarHBondContact O-OG 3.13Å; S43-S46 PolarHBondContact O-OG 3.5Å; S43-T47 PolarHBondContact O-N 2.94Å; S43-T47 PolarHBondContact O-OG1 3.24Å
44	T	28.5	Very low	29	Very low	78 Å²	78	90 Å²	90	48%	0.479	53%	0.534	S	S	.	.	H	α-helix	trans	-75.1	-33.7	171.7	-45.2	0	0	0	0	111.1	S40 M41 T47 L48	S40-T44 PolarHBondContact O-N 3.1Å; S40-T44 PolarHBondContact O-OG1 3.42Å; M41-T44 CarbonylContact O-C 3.54Å; M41-T44 PolarHBondContact O-N 2.96Å; T44-T47 VanDerWaalsContact CA-OG1 3.31Å; T44-T47 WeakPolarHBondContact CA-OG1 3.47Å; T44-T47 PolarHBondContact O-N 3.37Å; T44-T47 PolarHBondContact O-OG1 3.47Å; T44-L48 WeakPolarHBondContact O-CG 3.36Å; T44-L48 PolarHBondContact O-N 3.32Å
45	I	30	Very low	29	Very low	73 Å²	73	89.1 Å²	89.1	37%	0.374	52%	0.518	S	S	.	.	H	α-helix	trans	-70.8	-34.6	171.9	-69.3	162.6	0	0	0	110.7	M41 S42 T47 L48 N49	M41-I45 WeakPolarHBondContact O-CB 3.32Å; M41-I45 WeakPolarHBondContact O-CD1 3.44Å; M41-I45 WeakPolarHBondContact O-CG1 3.47Å; M41-I45 PolarHBondContact O-N 3.38Å; S42-I45 PolarHBondContact O-N 3.34Å; I45-T47 VanDerWaalsContact C-N 3.33Å; I45-T47 PolarHBondContact O-N 3.07Å; I45-L48 PolarHBondContact O-N 2.93Å; I45-N49 WeakPolarHBondContact O-CB 3.47Å; I45-N49 PolarHBondContact O-N 3.47Å; I45-N49 PolarHBondContact O-ND2 3.33Å; I45-N49 PolarHBondContact O-OD1 2.83Å
46	S	27.8	Very low	29	Very low	66 Å²	66	91.1 Å²	91.1	46%	0.462	52%	0.521	S	S	.	.	H	α-helix	trans	-70.3	-28.3	173.4	81.9	0	0	0	0	113.3	S42 S43	S42-S46 PolarHBondContact O-N 3.12Å; S43-S46 PolarHBondContact O-OG 3.5Å
47	T	28.1	Very low	29	Very low	88 Å²	88	87.2 Å²	87.2	54%	0.54	51%	0.507	S	S	.	.	H	α-helix	trans	-82.5	-14.9	171.2	26.4	0	0	0	0	113.7	S43 T44 I45 T50	S43-T47 PolarHBondContact O-N 2.94Å; S43-T47 PolarHBondContact O-OG1 3.24Å; T44-T47 VanDerWaalsContact CA-OG1 3.31Å; T44-T47 WeakPolarHBondContact CA-OG1 3.47Å; T44-T47 PolarHBondContact O-N 3.37Å; T44-T47 PolarHBondContact O-OG1 3.47Å; I45-T47 VanDerWaalsContact C-N 3.33Å; I45-T47 PolarHBondContact O-N 3.07Å; T47-T50 PolarHBondContact O-OG1 3.01Å
48	L	28	Very low	28.9	Very low	71 Å²	71	83.8 Å²	83.8	37%	0.372	50%	0.498	S	S	.	.	H	α-helix	trans	-84.3	-29.7	165.7	-80.1	157.1	0	0	0	111.4	T44 I45 T50 L51 F382	T44-L48 WeakPolarHBondContact O-CG 3.36Å; T44-L48 PolarHBondContact O-N 3.32Å; I45-L48 PolarHBondContact O-N 2.93Å; L48-T50 PolarHBondContact O-N 3.35Å; L48-L51 HydrophobicContact CD2-CD1 4.27Å; L48-L51 WeakPolarHBondContact O-CB 3.31Å; L48-L51 PolarHBondContact O-N 2.93Å; L48-L51 VanDerWaalsContact O-N 3.12Å; L48-F382 HydrophobicContact CD1-CE1 4.22Å
49	N	28.5	Very low	28.8	Very low	89 Å²	89	86.7 Å²	86.7	48%	0.476	51%	0.506	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-9.3	172.2	-70.3	-11.7	0	0	0	113.6	I45 L51 D52	I45-N49 WeakPolarHBondContact O-CB 3.47Å; I45-N49 PolarHBondContact O-N 3.47Å; I45-N49 PolarHBondContact O-ND2 3.33Å; I45-N49 PolarHBondContact O-OD1 2.83Å; N49-L51 VanDerWaalsContact C-N 3.28Å; N49-D52 WeakPolarHBondContact O-CB 3.44Å; N49-D52 PolarHBondContact O-N 3.09Å
50	T	29.3	Very low	28.8	Very low	91 Å²	91	90.9 Å²	90.9	56%	0.558	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.3	-13.8	169.9	55.8	0	0	0	0	112.8	T47 L48 D52	T47-T50 PolarHBondContact O-OG1 3.01Å; L48-T50 PolarHBondContact O-N 3.35Å; T50-D52 VanDerWaalsContact C-N 3.3Å
51	L	30.3	Very low	29.1	Very low	96 Å²	96	91 Å²	91	50%	0.503	52%	0.519	S	S	.	.	S	Bend	trans	-72.7	-22.6	167.8	-83	148.1	0	0	0	112.5	L48 N49 H53 A54	L48-L51 HydrophobicContact CD2-CD1 4.27Å; L48-L51 WeakPolarHBondContact O-CB 3.31Å; L48-L51 PolarHBondContact O-N 2.93Å; L48-L51 VanDerWaalsContact O-N 3.12Å; N49-L51 VanDerWaalsContact C-N 3.28Å; L51-H53 PolarHBondContact O-N 3.45Å; L51-A54 PolarHBondContact O-N 3.21Å
52	D	30.2	Very low	29	Very low	86 Å²	86	92.6 Å²	92.6	46%	0.46	53%	0.53	S	S	.	.	G	3₁₀ helix	trans	-66.5	-26.4	175.3	-85.6	-30.2	0	0	0	112.7	N49 T50 A54 L55 I56	N49-D52 WeakPolarHBondContact O-CB 3.44Å; N49-D52 PolarHBondContact O-N 3.09Å; T50-D52 VanDerWaalsContact C-N 3.3Å; D52-A54 PolarHBondContact O-N 3.34Å; D52-L55 PolarHBondContact O-N 3Å; D52-I56 WeakPolarHBondContact O-CG1 3.37Å
53	H	31.1	Very low	29	Very low	101 Å²	101	96 Å²	96	47%	0.468	54%	0.542	S	S	.	.	G	3₁₀ helix	trans	-73.4	-14.5	176.1	-83.5	-78.7	0	0	0	114	L51	L51-H53 PolarHBondContact O-N 3.45Å
54	A	30	Very low	29.3	Very low	80 Å²	80	97.1 Å²	97.1	66%	0.661	55%	0.551	S	S	*	*	G	3₁₀ helix	trans	-97	-5.3	173.4	0	0	0	0	0	113.5	L51 D52	L51-A54 PolarHBondContact O-N 3.21Å; D52-A54 PolarHBondContact O-N 3.34Å
55	L	28.5	Very low	29.8	Very low	56 Å²	56	99.5 Å²	99.5	29%	0.293	57%	0.569	S	S	.	*	T	Hydrogen-bonded Turn	trans	-118.7	5.6	-166.1	-94.8	151.6	0	0	0	115.9	D52 S57 K376	D52-L55 PolarHBondContact O-N 3Å; L55-S57 PolarHBondContact O-N 3.45Å; L55-S57 VanDerWaalsContact O-N 3.12Å; L55-K376 HydrophobicContact CD2-CD 4.09Å; L55-K376 HydrophobicContact CD2-CG 3.65Å
56	I	27.9	Very low	30.7	Very low	126 Å²	126	100.2 Å²	100.2	65%	0.646	57%	0.574	S	S	*	*			trans	-82.7	90.4	176.6	-58.1	167	0	0	0	111.2	D52	D52-I56 WeakPolarHBondContact O-CG1 3.37Å
57	S	29.8	Very low	31.7	Very low	75 Å²	75	101.5 Å²	101.5	52%	0.524	57%	0.571	S	S	.	*				157.1	75.8	122.2	87.3	0	0	0	0	111.8	L55	L55-S57 PolarHBondContact O-N 3.45Å; L55-S57 VanDerWaalsContact O-N 3.12Å
58	T	27.5	Very low	32.7	Very low	92 Å²	92	102.5 Å²	102.5	56%	0.564	57%	0.569	S	S	*	*			trans	-111.3	26.3	152.2	50	0	0	0	0	111.5	K376	T58-K376 PolarHBondContact OG1-NZ 3.49Å
59	K	29.3	Very low	33.9	Very low	182 Å²	182	105 Å²	105	79%	0.791	58%	0.579	S	S	*	*	S	Bend	trans	-102.5	129.9	165.1	-74.3	-176.1	176.1	178.9	0	108.1	I61	K59-I61 VanDerWaalsContact O-CG1 3.31Å; K59-I61 WeakPolarHBondContact O-CG1 3.33Å; K59-I61 PolarHBondContact O-N 2.92Å
60	V	28.1	Very low	35.1	Very low	148 Å²	148	104.2 Å²	104.2	90%	0.897	57%	0.573	S	S	*	*			trans	-31.8	116	171.5	-178.4	0	0	0	0	111.6
61	I	32.5	Very low	36.4	Very low	71 Å²	71	101.9 Å²	101.9	36%	0.364	56%	0.557	S	S	.	*			trans	-136	111	177.4	-65	161.4	0	0	0	110.7	K59	K59-I61 VanDerWaalsContact O-CG1 3.31Å; K59-I61 WeakPolarHBondContact O-CG1 3.33Å; K59-I61 PolarHBondContact O-N 2.92Å
62	D	27.6	Very low	37.6	Very low	138 Å²	138	99.5 Å²	99.5	74%	0.738	54%	0.543	S	S	*	.			trans	-53.5	154.3	175.3	-92.8	-44.8	0	0	0	115.7	S64	D62-S64 PolarHBondContact O-N 2.95Å; D62-S64 VanDerWaalsContact O-N 3.14Å
63	N	29.3	Very low	39.1	Very low	143 Å²	143	100 Å²	100	77%	0.765	55%	0.546	S	S	*	.	S	Bend	trans	-77.9	81.3	178.3	-79	-32.6	0	0	0	112.7	K67	N63-K67 PolarHBondContact OD1-NZ 3.4Å
64	S	33.9	Very low	40.5	Very low	90 Å²	90	98 Å²	98	63%	0.629	54%	0.538	S	S	*	.	S	Bend	trans	-168.2	122.6	163.2	56.4	0	0	0	0	113	D62 N66	D62-S64 PolarHBondContact O-N 2.95Å; D62-S64 VanDerWaalsContact O-N 3.14Å; S64-N66 PolarHBondContact O-N 2.94Å
65	C	38.5	Very low	41.8	Very low	127 Å²	127	94.9 Å²	94.9	86%	0.858	51%	0.511	S	S	*	.	S	Bend	trans	56.7	-27.5	163.8	-153.8	0	0	0	0	119.7	K67	C65-K67 PolarHBondContact O-N 2.99Å
66	N	49.1	Very low	43.2	Very low	89 Å²	89	97.5 Å²	97.5	48%	0.476	53%	0.525	S	S	.	.	H	α-helix	trans	-80.6	-21.3	-167.1	-136.5	-14.7	0	0	0	114.1	S64 Q69 Q70	S64-N66 PolarHBondContact O-N 2.94Å; N66-Q69 PolarHBondContact O-N 3.33Å; N66-Q70 WeakPolarHBondContact O-CG 3.27Å; N66-Q70 PolarHBondContact O-N 2.79Å
67	K	47.6	Very low	44.9	Very low	92 Å²	92	92.3 Å²	92.3	40%	0.4	50%	0.5	S	S	.	.	H	α-helix	trans	-66.5	-39.3	-176.2	-74.1	178.4	179.6	168.1	0	113.4	F4 N63 C65 L71	F4-K67 HydrophobicContact CE1-CD 4.37Å; N63-K67 PolarHBondContact OD1-NZ 3.4Å; C65-K67 PolarHBondContact O-N 2.99Å; K67-L71 VanDerWaalsContact O-CB 3.27Å; K67-L71 WeakPolarHBondContact O-CB 3.47Å; K67-L71 PolarHBondContact O-N 2.92Å
68	Q	50.1	Low	46.5	Very low	109 Å²	109	94.4 Å²	94.4	51%	0.509	51%	0.505	S	S	.	.	H	α-helix	trans	-66.5	-43	175.8	-91.8	-180	-24.2	0	0	110.7	L71 M72	Q68-L71 PolarHBondContact O-N 3.29Å; Q68-M72 WeakPolarHBondContact O-CB 3.41Å; Q68-M72 WeakPolarHBondContact O-CG 3.33Å; Q68-M72 PolarHBondContact O-N 3.39Å
69	Q	52.3	Low	48.3	Very low	124 Å²	124	94.1 Å²	94.1	58%	0.579	50%	0.496	S	S	*	.	H	α-helix	trans	-63.2	-45.1	178.1	-158.9	91.4	26.1	0	0	111.8	N66 M72 N73	N66-Q69 PolarHBondContact O-N 3.33Å; Q69-M72 PolarHBondContact O-N 3.23Å; Q69-N73 WeakPolarHBondContact O-CB 3.43Å; Q69-N73 PolarHBondContact O-N 3.48Å; Q69-N73 PolarHBondContact O-OD1 2.98Å
70	Q	54.5	Low	50	Low	73 Å²	73	85.7 Å²	85.7	34%	0.341	46%	0.46	S	S	.	.	H	α-helix	trans	-64.6	-41.8	177.5	-74.1	176.6	-8.4	0	0	112.2	N66 N73 L74	N66-Q70 WeakPolarHBondContact O-CG 3.27Å; N66-Q70 PolarHBondContact O-N 2.79Å; Q70-N73 PolarHBondContact O-N 3.29Å; Q70-L74 WeakPolarHBondContact O-CB 3.35Å; Q70-L74 PolarHBondContact O-N 2.85Å
71	L	56	Low	52.1	Low	42 Å²	42	79 Å²	79	22%	0.22	42%	0.419	C	S	.	.	H	α-helix	trans	-62.4	-47.2	173.2	-176.2	60.6	0	0	0	109.9	K67 Q68 N73 L74 L75 L201 L205	K67-L71 VanDerWaalsContact O-CB 3.27Å; K67-L71 WeakPolarHBondContact O-CB 3.47Å; K67-L71 PolarHBondContact O-N 2.92Å; Q68-L71 PolarHBondContact O-N 3.29Å; L71-N73 VanDerWaalsContact C-N 3.32Å; L71-N73 PolarHBondContact O-N 3.12Å; L71-L74 WeakPolarHBondContact O-CB 3.35Å; L71-L74 PolarHBondContact O-N 3.34Å; L71-L75 HydrophobicContact CD1-CD1 4.21Å; L71-L75 HydrophobicContact CD1-CD2 4.49Å; L71-L75 HydrophobicContact CD1-CG 4.19Å; L71-L75 HydrophobicContact CG-CD1 3.75Å; L71-L75 HydrophobicContact CG-CG 4.21Å; L71-L75 WeakPolarHBondContact O-CB 3.41Å; L71-L75 WeakPolarHBondContact O-CD1 3.47Å; L71-L75 WeakPolarHBondContact O-CG 3.48Å; L71-L75 PolarHBondContact O-N 3.14Å; L71-L201 HydrophobicContact CD2-CD2 4.19Å; L71-L205 HydrophobicContact CD2-CD1 3.34Å; L71-L205 HydrophobicContact CG-CD1 4.27Å
72	M	55.6	Low	54.2	Low	45 Å²	45	75.6 Å²	75.6	22%	0.222	40%	0.402	C	S	.	.	H	α-helix	trans	-60.7	-38.1	176.7	-71.2	-57.3	-64.9	0	0	112.8	Q68 Q69 L75 N76 L205 Q206	Q68-M72 WeakPolarHBondContact O-CB 3.41Å; Q68-M72 WeakPolarHBondContact O-CG 3.33Å; Q68-M72 PolarHBondContact O-N 3.39Å; Q69-M72 PolarHBondContact O-N 3.23Å; M72-L75 PolarHBondContact O-N 3.03Å; M72-L75 HydrophobicContact SD-CD1 3.98Å; M72-N76 VanDerWaalsContact O-CB 3.3Å; M72-N76 WeakPolarHBondContact O-CB 3.31Å; M72-N76 PolarHBondContact O-N 3.12Å; M72-N76 PolarHBondContact O-ND2 3.42Å; M72-L205 HydrophobicContact SD-CB 4.32Å; M72-Q206 HydrophobicContact CE-CG 3.86Å
73	N	62.1	Low	56.6	Low	96 Å²	96	70.5 Å²	70.5	51%	0.513	38%	0.377	S	S	.	.	H	α-helix	trans	-67.3	-40.9	174.9	-70.9	-7.6	0	0	0	111.9	Q69 Q70 L71 L75 N76 S77	Q69-N73 WeakPolarHBondContact O-CB 3.43Å; Q69-N73 PolarHBondContact O-N 3.48Å; Q69-N73 PolarHBondContact O-OD1 2.98Å; Q70-N73 PolarHBondContact O-N 3.29Å; L71-N73 VanDerWaalsContact C-N 3.32Å; L71-N73 PolarHBondContact O-N 3.12Å; N73-L75 VanDerWaalsContact C-N 3.31Å; N73-N76 CarbonylContact O-C 3.1Å; N73-N76 PolarHBondContact O-N 3.32Å; N73-S77 PolarHBondContact O-N 3.15Å
74	L	60.4	Low	59.1	Low	60 Å²	60	65.7 Å²	65.7	31%	0.314	35%	0.349	S	S	.	.	H	α-helix	trans	-63.6	-41	173.4	-170.5	77.7	0	0	0	110.7	Q70 L71 N76 S77	Q70-L74 WeakPolarHBondContact O-CB 3.35Å; Q70-L74 PolarHBondContact O-N 2.85Å; L71-L74 WeakPolarHBondContact O-CB 3.35Å; L71-L74 PolarHBondContact O-N 3.34Å; L74-N76 VanDerWaalsContact C-N 3.27Å; L74-N76 PolarHBondContact O-N 3.47Å; L74-S77 WeakPolarHBondContact O-CB 3.41Å; L74-S77 PolarHBondContact O-N 2.97Å; L74-S77 PolarHBondContact O-OG 3.26Å
75	L	56.6	Low	61.3	Low	15 Å²	15	64 Å²	64	8%	0.079	34%	0.337	C	S	.	.	H	α-helix	trans	-68.4	-28.2	179	-67.4	167.3	0	0	0	112.5	L71 M72 N73 L80 L198 A202	L71-L75 HydrophobicContact CD1-CD1 4.21Å; L71-L75 HydrophobicContact CD1-CD2 4.49Å; L71-L75 HydrophobicContact CD1-CG 4.19Å; L71-L75 HydrophobicContact CG-CD1 3.75Å; L71-L75 HydrophobicContact CG-CG 4.21Å; L71-L75 WeakPolarHBondContact O-CB 3.41Å; L71-L75 WeakPolarHBondContact O-CD1 3.47Å; L71-L75 WeakPolarHBondContact O-CG 3.48Å; L71-L75 PolarHBondContact O-N 3.14Å; M72-L75 PolarHBondContact O-N 3.03Å; M72-L75 HydrophobicContact SD-CD1 3.98Å; N73-L75 VanDerWaalsContact C-N 3.31Å; L75-L80 HydrophobicContact CB-CD1 4.15Å; L75-L80 HydrophobicContact CD2-CD1 3.44Å; L75-L80 VanDerWaalsContact CD2-CD1 3.44Å; L75-L80 HydrophobicContact CG-CD1 4.35Å; L75-L198 HydrophobicContact CD2-CB 4.38Å; L75-L198 WeakPolarHBondContact CD2-O 3.41Å; L75-A202 HydrophobicContact CB-CB 4.17Å; L75-A202 HydrophobicContact CD1-CB 3.36Å; L75-A202 HydrophobicContact CD2-CB 3.53Å; L75-A202 HydrophobicContact CG-CB 3.82Å
76	N	58.5	Low	63.1	Low	111 Å²	111	63.7 Å²	63.7	59%	0.594	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.9	-2	175	-67.6	-20.7	0	0	0	113.2	M72 N73 L74	M72-N76 VanDerWaalsContact O-CB 3.3Å; M72-N76 WeakPolarHBondContact O-CB 3.31Å; M72-N76 PolarHBondContact O-N 3.12Å; M72-N76 PolarHBondContact O-ND2 3.42Å; N73-N76 CarbonylContact O-C 3.1Å; N73-N76 PolarHBondContact O-N 3.32Å; L74-N76 VanDerWaalsContact C-N 3.27Å; L74-N76 PolarHBondContact O-N 3.47Å
77	S	63.6	Low	64.2	Low	17 Å²	17	61.5 Å²	61.5	12%	0.119	32%	0.317	C	S	.	.	S	Bend	trans	-78.2	154.6	177.3	73.8	0	0	0	0	111.5	N73 L74 F79 L80	N73-S77 PolarHBondContact O-N 3.15Å; L74-S77 WeakPolarHBondContact O-CB 3.41Å; L74-S77 PolarHBondContact O-N 2.97Å; L74-S77 PolarHBondContact O-OG 3.26Å; S77-F79 PolarHBondContact O-N 3.23Å; S77-F79 WeakPolarHBondContact OG-CB 3.5Å; S77-L80 PolarHBondContact O-N 3.1Å
78	D	63.7	Low	65	Low	119 Å²	119	62.6 Å²	62.6	64%	0.636	33%	0.328	S	S	*	.	G	3₁₀ helix	trans	-58.1	-15	178.6	-65.8	-22	0	0	0	113.2	L80 S81	D78-L80 PolarHBondContact O-N 2.98Å; D78-S81 WeakPolarHBondContact O-CB 3.46Å; D78-S81 PolarHBondContact O-N 3.46Å; D78-S81 PolarHBondContact O-OG 2.98Å
79	F	65.1	Low	65.7	Low	86 Å²	86	60.3 Å²	60.3	38%	0.377	32%	0.319	S	S	.	.	G	3₁₀ helix	trans	-55.9	-34.6	175.5	-175.6	-102.1	0	0	0	113.4	S77 I195	S77-F79 PolarHBondContact O-N 3.23Å; S77-F79 WeakPolarHBondContact OG-CB 3.5Å; F79-I195 HydrophobicContact CE1-CD1 4.3Å; F79-I195 HydrophobicContact CE1-CG1 4.46Å; F79-I195 HydrophobicContact CZ-CD1 4.46Å
80	L	64.4	Low	66	Low	4 Å²	4	60.3 Å²	60.3	2%	0.021	32%	0.323	C	S	.	.	G	3₁₀ helix	trans	-92	2.4	176.6	-59.5	-171.4	0	0	0	113.2	L75 S77 D78 I92 I195 L198 R199	L75-L80 HydrophobicContact CB-CD1 4.15Å; L75-L80 HydrophobicContact CD2-CD1 3.44Å; L75-L80 VanDerWaalsContact CD2-CD1 3.44Å; L75-L80 HydrophobicContact CG-CD1 4.35Å; S77-L80 PolarHBondContact O-N 3.1Å; D78-L80 PolarHBondContact O-N 2.98Å; L80-I92 WeakPolarHBondContact O-CD1 3.48Å; L80-I195 HydrophobicContact CD2-CB 4.5Å; L80-I195 HydrophobicContact CD2-CG1 4.41Å; L80-I195 HydrophobicContact CD2-CG2 3.82Å; L80-L198 HydrophobicContact CD2-CD1 4.5Å; L80-R199 HydrophobicContact CD1-CG 4.13Å; L80-R199 PolarHBondContact O-NE 2.81Å; L80-R199 PolarHBondContact O-NH2 3.24Å
81	S	72.1	Confident	66.6	Low	7 Å²	7	59 Å²	59	5%	0.049	32%	0.32	C	S	.	.	S	Bend	trans	-96.1	161.3	178.1	78.5	0	0	0	0	111	D78 S83 T100	D78-S81 WeakPolarHBondContact O-CB 3.46Å; D78-S81 PolarHBondContact O-N 3.46Å; D78-S81 PolarHBondContact O-OG 2.98Å; S81-S83 PolarHBondContact O-N 2.93Å; S81-T100 PolarHBondContact O-OG1 3.42Å; S81-T100 VanDerWaalsContact O-OG1 3.05Å
82	C	77.5	Confident	67.5	Low	0 Å²	0	57.1 Å²	57.1	0%	0	31%	0.31	C	S	.	.			trans	-63.7	124.1	167.8	175	0	0	0	0	110	F84 C85 H86 A87 C102 C105	C82-F84 PolarHBondContact O-N 3.03Å; C82-F84 PolarHBondContact SG-N 2.95Å; C82-F84 VanDerWaalsContact SG-N 3.41Å; C82-C85 VanDerWaalsContact CB-SG 3.52Å; C82-C85 PolarHBondContact O-N 3.05Å; C82-C85 PolarHBondContact SG-SG 2.93Å; C82-H86 WeakPolarHBondContact O-CA 3.28Å; C82-H86 PolarHBondContact O-N 2.74Å; C82-A87 PolarHBondContact N-O 3.49Å; C82-C102 HydrophobicContact CB-CB 3.94Å; C82-C102 PolarHBondContact SG-N 3.2Å; C82-C105 VanDerWaalsContact SG-SG 3.69Å
83	S	77.4	Confident	68.4	Low	31 Å²	31	56.3 Å²	56.3	22%	0.217	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-10.4	178	-50.1	0	0	0	0	114.2	S81 T100	S81-S83 PolarHBondContact O-N 2.93Å; S83-T100 WeakPolarHBondContact CB-O 3.31Å; S83-T100 PolarHBondContact N-O 3.01Å; S83-T100 PolarHBondContact OG-N 3.04Å; S83-T100 PolarHBondContact OG-O 3.32Å; S83-T100 VanDerWaalsContact OG-O 3.04Å
84	F	81.2	Confident	68.8	Low	42 Å²	42	54.4 Å²	54.4	18%	0.184	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.6	-36.1	-178.3	-66.3	4	0	0	0	113.5	C82 L95 V101 C105 L109 K124 A125	C82-F84 PolarHBondContact O-N 3.03Å; C82-F84 PolarHBondContact SG-N 2.95Å; C82-F84 VanDerWaalsContact SG-N 3.41Å; F84-L95 HydrophobicContact CE1-CD1 4.29Å; F84-L95 HydrophobicContact CZ-CD1 3.96Å; F84-V101 HydrophobicContact CD1-CG1 3.83Å; F84-V101 HydrophobicContact CD2-CG1 3.85Å; F84-V101 HydrophobicContact CE1-CG1 3.66Å; F84-V101 HydrophobicContact CE2-CG1 3.71Å; F84-V101 HydrophobicContact CG-CG1 3.9Å; F84-V101 HydrophobicContact CZ-CG1 3.6Å; F84-C105 HydrophobicContact CB-CB 4.15Å; F84-C105 HydrophobicContact CD2-CB 3.85Å; F84-C105 HydrophobicContact CG-CB 4.4Å; F84-L109 HydrophobicContact CE2-CB 4.48Å; F84-L109 HydrophobicContact CE2-CD1 4.1Å; F84-L109 HydrophobicContact CE2-CD2 4.11Å; F84-L109 HydrophobicContact CE2-CG 4.47Å; F84-L109 HydrophobicContact CZ-CD2 4.32Å; F84-K124 HydrophobicContact CD1-CB 3.88Å; F84-K124 HydrophobicContact CD2-CB 4.44Å; F84-K124 HydrophobicContact CD2-CD 4.11Å; F84-K124 HydrophobicContact CD2-CG 4.4Å; F84-K124 HydrophobicContact CE1-CB 3.69Å; F84-K124 HydrophobicContact CE1-CG 4.42Å; F84-K124 HydrophobicContact CE2-CB 4.26Å; F84-K124 HydrophobicContact CE2-CD 4.26Å; F84-K124 HydrophobicContact CE2-CG 4.12Å; F84-K124 HydrophobicContact CG-CB 4.29Å; F84-K124 HydrophobicContact CG-CD 4.43Å; F84-K124 HydrophobicContact CZ-CB 3.9Å; F84-K124 HydrophobicContact CZ-CG 4.14Å; F84-A125 HydrophobicContact CE1-CB 4.45Å
85	C	81.4	Confident	69.4	Low	56 Å²	56	51.9 Å²	51.9	38%	0.378	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-125.3	-0.6	-176.1	68.4	0	0	0	0	113.5	C82 A87 C105	C82-C85 VanDerWaalsContact CB-SG 3.52Å; C82-C85 PolarHBondContact O-N 3.05Å; C82-C85 PolarHBondContact SG-SG 2.93Å; C85-A87 PolarHBondContact O-N 3.49Å; C85-A87 WeakPolarHBondContact SG-CB 3.5Å; C85-C105 VanDerWaalsContact SG-SG 3.64Å
86	H	75.7	Confident	69.9	Low	120 Å²	120	55.1 Å²	55.1	56%	0.556	30%	0.303	S	S	*	.			trans	55.4	13.9	-175.8	-56.1	-80.7	0	0	0	114.3	C82	C82-H86 WeakPolarHBondContact O-CA 3.28Å; C82-H86 PolarHBondContact O-N 2.74Å
87	A	71.5	Confident	70.4	Confident	43 Å²	43	51.4 Å²	51.4	36%	0.355	29%	0.286	S	S	.	.			trans	-76.2	142.4	177.9	0	0	0	0	0	111.3	C82 C85 D89	C82-A87 PolarHBondContact N-O 3.49Å; C85-A87 PolarHBondContact O-N 3.49Å; C85-A87 WeakPolarHBondContact SG-CB 3.5Å; A87-D89 VanDerWaalsContact C-N 3.3Å; A87-D89 PolarHBondContact O-N 2.78Å
88	N	65	Low	70.9	Confident	115 Å²	115	57 Å²	57	62%	0.615	31%	0.314	S	S	*	.			trans	-89.2	65.2	172.2	-72.1	-22.7	0	0	0	110.7	R199	N88-R199 VanDerWaalsContact CA-NH2 3.33Å
89	D	64.6	Low	71.5	Confident	60 Å²	60	54.1 Å²	54.1	32%	0.321	30%	0.296	S	S	.	.			trans	-81.4	134.1	179.4	-167.2	7.1	0	0	0	111.1	A87 V91 C102 R199	A87-D89 VanDerWaalsContact C-N 3.3Å; A87-D89 PolarHBondContact O-N 2.78Å; D89-V91 PolarHBondContact O-N 3.27Å; D89-C102 HydrophobicContact CB-CB 3.4Å; D89-C102 WeakPolarHBondContact OD2-CB 3.46Å; D89-R199 PolarHBondContact O-NH1 2.71Å
90	N	60	Low	72.1	Confident	124 Å²	124	50.4 Å²	50.4	66%	0.663	28%	0.28	S	S	*	.	S	Bend	trans	-58.2	-27.6	-169.3	-75.4	-16.7	0	0	0	114.4
91	V	67.1	Low	72.8	Confident	47 Å²	47	50.2 Å²	50.2	29%	0.285	28%	0.279	S	S	.	.			trans	-106.4	111.9	177.7	-177.3	0	0	0	0	109.5	D89 R103	D89-V91 PolarHBondContact O-N 3.27Å; V91-R103 HydrophobicContact CB-CB 4.47Å; V91-R103 PolarHBondContact O-N 3.04Å
92	I	74	Confident	73.2	Confident	1 Å²	1	49.9 Å²	49.9	1%	0.005	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	133.1	174.4	-72.1	-179.4	0	0	0	109.6	L80 T100 V101 A192 I195 R199	L80-I92 WeakPolarHBondContact O-CD1 3.48Å; I92-T100 HydrophobicContact CG2-CG2 3.72Å; I92-V101 WeakPolarHBondContact CA-O 3.43Å; I92-A192 HydrophobicContact CB-CB 4.23Å; I92-A192 HydrophobicContact CG2-CB 3.75Å; I92-A192 PolarHBondContact O-N 2.82Å; I92-I195 HydrophobicContact CD1-CG2 3.59Å; I92-R199 VanDerWaalsContact CD1-NH1 3.3Å
93	K	73.5	Confident	73.3	Confident	28 Å²	28	54.1 Å²	54.1	12%	0.122	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	142.9	169.6	-61.7	-59.7	-160.9	163.6	0	110.2	T100 V101 A106 F189 N191	K93-T100 WeakPolarHBondContact O-CA 3.4Å; K93-V101 HydrophobicContact CB-CG2 4.02Å; K93-V101 PolarHBondContact N-O 3.26Å; K93-V101 PolarHBondContact O-N 2.83Å; K93-A106 HydrophobicContact CB-CB 4.43Å; K93-A106 HydrophobicContact CG-CB 4.14Å; K93-F189 HydrophobicContact CB-CB 3.88Å; K93-F189 HydrophobicContact CD-CB 4.2Å; K93-F189 WeakPolarHBondContact CD-O 3.39Å; K93-F189 HydrophobicContact CG-CB 4.25Å; K93-F189 PolarHBondContact NZ-O 3.09Å; K93-N191 WeakPolarHBondContact CD-OD1 3.28Å; K93-N191 WeakPolarHBondContact CE-OD1 3.14Å; K93-N191 PolarHBondContact NZ-OD1 2.96Å
94	L	72.3	Confident	73.4	Confident	56 Å²	56	53.8 Å²	53.8	29%	0.293	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	125.1	175.9	-169.9	69.8	0	0	0	110.3	L98 T100 P190 A192	L94-L98 WeakPolarHBondContact CD1-O 3.48Å; L94-L98 HydrophobicContact CD2-CD2 4.36Å; L94-T100 HydrophobicContact CD1-CG2 4.31Å; L94-P190 PolarHBondContact N-O 3.37Å; L94-A192 HydrophobicContact CB-CB 4.38Å
95	L	72.7	Confident	73.4	Confident	7 Å²	7	52.6 Å²	52.6	4%	0.037	29%	0.287	C	S	.	.	P	Polyproline II helix	trans	-82	157.3	172.2	-66.6	169	0	0	0	110.7	F84 C97 L98 H99 V101 L109 C123 F189	F84-L95 HydrophobicContact CE1-CD1 4.29Å; F84-L95 HydrophobicContact CZ-CD1 3.96Å; L95-C97 PolarHBondContact O-N 2.88Å; L95-C97 VanDerWaalsContact O-N 3.16Å; L95-L98 WeakPolarHBondContact O-CA 3.27Å; L95-L98 PolarHBondContact O-N 3.23Å; L95-H99 WeakPolarHBondContact CB-O 3.36Å; L95-H99 HydrophobicContact CD1-CB 4.08Å; L95-H99 PolarHBondContact N-O 3.04Å; L95-V101 HydrophobicContact CD1-CG1 3.76Å; L95-V101 HydrophobicContact CD1-CG2 4.48Å; L95-V101 HydrophobicContact CG-CG1 4.41Å; L95-V101 HydrophobicContact CG-CG2 4.28Å; L95-L109 HydrophobicContact CD2-CD2 4Å; L95-C123 HydrophobicContact CD1-CB 4.17Å; L95-F189 HydrophobicContact CD2-CD1 3.93Å; L95-F189 HydrophobicContact CD2-CE1 3.38Å; L95-F189 HydrophobicContact CD2-CZ 3.78Å
96	P	66.8	Low	73.2	Confident	84 Å²	84	49.9 Å²	49.9	55%	0.545	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-28.3	175.5	-26	34.4	0	0	0	114.2	L98 L131	P96-L98 PolarHBondContact O-N 3.5Å; P96-L131 HydrophobicContact CG-CD1 3.75Å; P96-L131 HydrophobicContact CG-CD2 4.26Å; P96-L131 HydrophobicContact CG-CG 3.93Å
97	C	69.5	Low	73.2	Confident	33 Å²	33	46.7 Å²	46.7	22%	0.223	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.6	12.8	173	63	0	0	0	0	113.8	L95 H99 C123 C126 I128	L95-C97 PolarHBondContact O-N 2.88Å; L95-C97 VanDerWaalsContact O-N 3.16Å; C97-H99 PolarHBondContact O-N 3.48Å; C97-H99 VanDerWaalsContact O-N 3.12Å; C97-H99 PolarHBondContact O-ND1 3.43Å; C97-H99 PolarHBondContact SG-ND1 2.86Å; C97-H99 VanDerWaalsContact SG-ND1 3.42Å; C97-C123 VanDerWaalsContact SG-CB 3.56Å; C97-C126 VanDerWaalsContact CB-SG 3.55Å; C97-I128 HydrophobicContact CB-CD1 4.26Å
98	L	74.4	Confident	73.5	Confident	134 Å²	134	46.5 Å²	46.5	70%	0.702	25%	0.252	S	S	*	.	S	Bend	trans	65.1	4.1	-179.9	-54.3	175.5	0	0	0	116.2	L94 L95 P96	L94-L98 WeakPolarHBondContact CD1-O 3.48Å; L94-L98 HydrophobicContact CD2-CD2 4.36Å; L95-L98 WeakPolarHBondContact O-CA 3.27Å; L95-L98 PolarHBondContact O-N 3.23Å; P96-L98 PolarHBondContact O-N 3.5Å
99	H	75.4	Confident	74	Confident	59 Å²	59	41.7 Å²	41.7	27%	0.273	23%	0.226	S	C	.	.			trans	-71.4	146.8	170	-73.5	92.5	0	0	0	111.6	L95 C97	L95-H99 WeakPolarHBondContact CB-O 3.36Å; L95-H99 HydrophobicContact CD1-CB 4.08Å; L95-H99 PolarHBondContact N-O 3.04Å; C97-H99 PolarHBondContact O-N 3.48Å; C97-H99 VanDerWaalsContact O-N 3.12Å; C97-H99 PolarHBondContact O-ND1 3.43Å; C97-H99 PolarHBondContact SG-ND1 2.86Å; C97-H99 VanDerWaalsContact SG-ND1 3.42Å
100	T	77.3	Confident	74.2	Confident	7 Å²	7	40.4 Å²	40.4	4%	0.043	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	133.8	-178.5	46.3	0	0	0	0	110.2	S81 S83 I92 K93 L94 I195	S81-T100 PolarHBondContact O-OG1 3.42Å; S81-T100 VanDerWaalsContact O-OG1 3.05Å; S83-T100 WeakPolarHBondContact CB-O 3.31Å; S83-T100 PolarHBondContact N-O 3.01Å; S83-T100 PolarHBondContact OG-N 3.04Å; S83-T100 PolarHBondContact OG-O 3.32Å; S83-T100 VanDerWaalsContact OG-O 3.04Å; I92-T100 HydrophobicContact CG2-CG2 3.72Å; K93-T100 WeakPolarHBondContact O-CA 3.4Å; L94-T100 HydrophobicContact CD1-CG2 4.31Å; T100-I195 HydrophobicContact CG2-CD1 3.34Å
101	V	79.1	Confident	74.6	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	142.2	175.9	-65.2	0	0	0	0	110.7	F84 I92 K93 L95 C105 A106	F84-V101 HydrophobicContact CD1-CG1 3.83Å; F84-V101 HydrophobicContact CD2-CG1 3.85Å; F84-V101 HydrophobicContact CE1-CG1 3.66Å; F84-V101 HydrophobicContact CE2-CG1 3.71Å; F84-V101 HydrophobicContact CG-CG1 3.9Å; F84-V101 HydrophobicContact CZ-CG1 3.6Å; I92-V101 WeakPolarHBondContact CA-O 3.43Å; K93-V101 HydrophobicContact CB-CG2 4.02Å; K93-V101 PolarHBondContact N-O 3.26Å; K93-V101 PolarHBondContact O-N 2.83Å; L95-V101 HydrophobicContact CD1-CG1 3.76Å; L95-V101 HydrophobicContact CD1-CG2 4.48Å; L95-V101 HydrophobicContact CG-CG1 4.41Å; L95-V101 HydrophobicContact CG-CG2 4.28Å; V101-C105 HydrophobicContact CB-CB 4.26Å; V101-A106 HydrophobicContact CG2-CB 3.99Å
102	C	81.6	Confident	74.6	Confident	1 Å²	1	41 Å²	41	1%	0.007	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	162.4	171.9	64.2	0	0	0	0	110.9	C82 D89 S104 C105 A106	C82-C102 HydrophobicContact CB-CB 3.94Å; C82-C102 PolarHBondContact SG-N 3.2Å; D89-C102 HydrophobicContact CB-CB 3.4Å; D89-C102 WeakPolarHBondContact OD2-CB 3.46Å; C102-S104 VanDerWaalsContact C-N 3.29Å; C102-S104 PolarHBondContact O-N 2.92Å; C102-S104 PolarHBondContact SG-OG 3.5Å; C102-C105 PolarHBondContact O-N 2.93Å; C102-C105 VanDerWaalsContact SG-CB 3.51Å; C102-C105 PolarHBondContact SG-N 3.25Å; C102-C105 VanDerWaalsContact SG-N 3.41Å; C102-C105 PolarHBondContact SG-SG 3.43Å; C102-A106 PolarHBondContact O-N 3.14Å
103	R	78.1	Confident	73.9	Confident	88 Å²	88	41.6 Å²	41.6	33%	0.332	22%	0.221	S	C	.	.	H	α-helix	trans	-54.7	-44.7	179.6	-170.5	-173.4	-165.9	155.1	21.6	112.2	V91 A106 I107 V184 D185	V91-R103 HydrophobicContact CB-CB 4.47Å; V91-R103 PolarHBondContact O-N 3.04Å; R103-A106 PolarHBondContact O-N 3.39Å; R103-I107 HydrophobicContact CG-CD1 4.12Å; R103-I107 VanDerWaalsContact O-CG1 3.32Å; R103-I107 WeakPolarHBondContact O-CG1 3.3Å; R103-I107 PolarHBondContact O-N 3Å; R103-V184 PolarHBondContact NH2-O 3.32Å; R103-D185 IonicContact NH2-OD1 3.7Å
104	S	79.2	Confident	73	Confident	24 Å²	24	45.4 Å²	45.4	17%	0.168	24%	0.241	C	C	.	.	H	α-helix	trans	-63	-45	179.8	56.4	0	0	0	0	112.2	C102 A106 I107 S108	C102-S104 VanDerWaalsContact C-N 3.29Å; C102-S104 PolarHBondContact O-N 2.92Å; C102-S104 PolarHBondContact SG-OG 3.5Å; S104-A106 VanDerWaalsContact C-N 3.33Å; S104-A106 PolarHBondContact O-N 3.35Å; S104-I107 PolarHBondContact O-N 3.16Å; S104-S108 PolarHBondContact O-N 3.02Å; S104-S108 PolarHBondContact O-OG 3.49Å; S104-S108 VanDerWaalsContact O-OG 3.13Å
105	C	82	Confident	72.2	Confident	17 Å²	17	49.4 Å²	49.4	12%	0.115	26%	0.263	C	S	.	.	H	α-helix	trans	-65.1	-34.9	175.8	-75.7	0	0	0	0	112.8	C82 F84 C85 V101 C102 S108 L109	C82-C105 VanDerWaalsContact SG-SG 3.69Å; F84-C105 HydrophobicContact CB-CB 4.15Å; F84-C105 HydrophobicContact CD2-CB 3.85Å; F84-C105 HydrophobicContact CG-CB 4.4Å; C85-C105 VanDerWaalsContact SG-SG 3.64Å; V101-C105 HydrophobicContact CB-CB 4.26Å; C102-C105 PolarHBondContact O-N 2.93Å; C102-C105 VanDerWaalsContact SG-CB 3.51Å; C102-C105 PolarHBondContact SG-N 3.25Å; C102-C105 VanDerWaalsContact SG-N 3.41Å; C102-C105 PolarHBondContact SG-SG 3.43Å; C105-S108 PolarHBondContact O-N 2.98Å; C105-L109 VanDerWaalsContact O-CB 3.28Å; C105-L109 WeakPolarHBondContact O-CB 3.39Å; C105-L109 PolarHBondContact O-N 3.05Å
106	A	77.1	Confident	71.1	Confident	0 Å²	0	55 Å²	55	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-65.2	-42.2	173.7	0	0	0	0	0	111.7	K93 V101 C102 R103 S104 L109 N110 L187	K93-A106 HydrophobicContact CB-CB 4.43Å; K93-A106 HydrophobicContact CG-CB 4.14Å; V101-A106 HydrophobicContact CG2-CB 3.99Å; C102-A106 PolarHBondContact O-N 3.14Å; R103-A106 PolarHBondContact O-N 3.39Å; S104-A106 VanDerWaalsContact C-N 3.33Å; S104-A106 PolarHBondContact O-N 3.35Å; A106-L109 WeakPolarHBondContact O-CB 3.27Å; A106-L109 PolarHBondContact O-N 2.91Å; A106-N110 PolarHBondContact O-N 3.24Å; A106-L187 HydrophobicContact CB-CD2 4.13Å; A106-L187 WeakPolarHBondContact O-CD2 3.26Å
107	I	77	Confident	70.3	Confident	52 Å²	52	58.9 Å²	58.9	27%	0.267	31%	0.305	S	S	.	.	H	α-helix	trans	-61	-49.6	174	-67.2	162	0	0	0	110.4	R103 S104 L109 N110 N111 L187	R103-I107 HydrophobicContact CG-CD1 4.12Å; R103-I107 VanDerWaalsContact O-CG1 3.32Å; R103-I107 WeakPolarHBondContact O-CG1 3.3Å; R103-I107 PolarHBondContact O-N 3Å; S104-I107 PolarHBondContact O-N 3.16Å; I107-L109 PolarHBondContact O-N 3.45Å; I107-N110 PolarHBondContact O-N 3.46Å; I107-N110 VanDerWaalsContact O-N 3.16Å; I107-N111 PolarHBondContact O-N 2.94Å; I107-L187 HydrophobicContact CB-CD1 4.38Å; I107-L187 HydrophobicContact CG1-CD1 3.41Å; I107-L187 VanDerWaalsContact CG1-CD1 3.41Å
108	S	76.6	Confident	69.4	Low	39 Å²	39	63.9 Å²	63.9	27%	0.273	33%	0.329	S	S	.	.	H	α-helix	trans	-58.7	-38.7	177.8	-58.7	0	0	0	0	112.1	S104 C105 H112	S104-S108 PolarHBondContact O-N 3.02Å; S104-S108 PolarHBondContact O-OG 3.49Å; S104-S108 VanDerWaalsContact O-OG 3.13Å; C105-S108 PolarHBondContact O-N 2.98Å; S108-H112 PolarHBondContact O-CD2 2.9Å; S108-H112 VanDerWaalsContact O-CD2 3.25Å; S108-H112 PolarHBondContact O-N 3.37Å
109	L	75.1	Confident	68.5	Low	14 Å²	14	59.9 Å²	59.9	7%	0.073	31%	0.312	C	S	.	.	H	α-helix	trans	-65.4	-41.4	177.8	-171.3	68.5	0	0	0	112	F84 L95 C105 A106 I107 S113 I121 K122 F189	F84-L109 HydrophobicContact CE2-CB 4.48Å; F84-L109 HydrophobicContact CE2-CD1 4.1Å; F84-L109 HydrophobicContact CE2-CD2 4.11Å; F84-L109 HydrophobicContact CE2-CG 4.47Å; F84-L109 HydrophobicContact CZ-CD2 4.32Å; L95-L109 HydrophobicContact CD2-CD2 4Å; C105-L109 VanDerWaalsContact O-CB 3.28Å; C105-L109 WeakPolarHBondContact O-CB 3.39Å; C105-L109 PolarHBondContact O-N 3.05Å; A106-L109 WeakPolarHBondContact O-CB 3.27Å; A106-L109 PolarHBondContact O-N 2.91Å; I107-L109 PolarHBondContact O-N 3.45Å; L109-S113 PolarHBondContact O-N 2.84Å; L109-I121 HydrophobicContact CD1-CG2 3.89Å; L109-I121 HydrophobicContact CD2-CG2 3.38Å; L109-I121 HydrophobicContact CG-CG2 3.43Å; L109-I121 VanDerWaalsContact CG-CG2 3.43Å; L109-K122 WeakPolarHBondContact CD1-O 3.37Å; L109-F189 HydrophobicContact CD2-CZ 4.44Å
110	N	70.2	Confident	67.9	Low	34 Å²	34	59 Å²	59	18%	0.182	32%	0.315	C	S	.	.	H	α-helix	trans	-68.6	-43.1	177.7	-168.5	55.2	0	0	0	112.3	A106 I107 H112 S113 M114 L187	A106-N110 PolarHBondContact O-N 3.24Å; I107-N110 PolarHBondContact O-N 3.46Å; I107-N110 VanDerWaalsContact O-N 3.16Å; N110-H112 VanDerWaalsContact C-N 3.28Å; N110-H112 PolarHBondContact O-N 3.02Å; N110-S113 PolarHBondContact O-N 2.76Å; N110-S113 VanDerWaalsContact O-N 3.11Å; N110-M114 PolarHBondContact O-N 3.29Å; N110-M114 VanDerWaalsContact O-N 3.14Å; N110-L187 HydrophobicContact CB-CD2 3.81Å
111	N	68.6	Low	67.3	Low	75 Å²	75	59.1 Å²	59.1	40%	0.401	32%	0.316	S	S	.	.	H	α-helix	trans	-62.5	-34.9	179.1	-69.9	-5.9	0	0	0	112.3	I107 N115	I107-N111 PolarHBondContact O-N 2.94Å; N111-N115 PolarHBondContact O-N 3.45Å
112	H	65.2	Low	66.9	Low	109 Å²	109	65.1 Å²	65.1	51%	0.505	34%	0.342	S	S	.	.	H	α-helix	trans	-66.9	-34.5	174.4	-88.3	-65.2	0	0	0	113.5	S108 N110	S108-H112 PolarHBondContact O-CD2 2.9Å; S108-H112 VanDerWaalsContact O-CD2 3.25Å; S108-H112 PolarHBondContact O-N 3.37Å; N110-H112 VanDerWaalsContact C-N 3.28Å; N110-H112 PolarHBondContact O-N 3.02Å
113	S	60.1	Low	66.4	Low	12 Å²	12	65.3 Å²	65.3	8%	0.084	34%	0.343	C	S	.	.	H	α-helix	trans	-71.2	-38.8	177.4	177.4	0	0	0	0	112	L109 N110 N115 Q116 S119	L109-S113 PolarHBondContact O-N 2.84Å; N110-S113 PolarHBondContact O-N 2.76Å; N110-S113 VanDerWaalsContact O-N 3.11Å; S113-N115 PolarHBondContact O-N 2.83Å; S113-Q116 CarbonylContact O-C 3.57Å; S113-Q116 PolarHBondContact O-N 2.95Å; S113-Q116 VanDerWaalsContact O-N 3.16Å; S113-S119 PolarHBondContact OG-O 2.86Å; S113-S119 VanDerWaalsContact OG-O 3.12Å
114	M	55.8	Low	66.4	Low	108 Å²	108	67 Å²	67	53%	0.532	35%	0.353	S	S	.	.	H	α-helix	trans	-64.3	-27.2	177.1	-68.3	-66.5	140	0	0	113.1	N110 L133	N110-M114 PolarHBondContact O-N 3.29Å; N110-M114 VanDerWaalsContact O-N 3.14Å; M114-L133 HydrophobicContact CE-CD1 3.76Å
115	N	53.6	Low	66	Low	141 Å²	141	68 Å²	68	75%	0.754	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.5	-7.3	177.6	-72.8	-16.1	0	0	0	114.1	N111 S113	N111-N115 PolarHBondContact O-N 3.45Å; S113-N115 PolarHBondContact O-N 2.83Å
116	Q	49.7	Very low	65.5	Low	124 Å²	124	68.1 Å²	68.1	58%	0.579	36%	0.363	S	S	*	.	S	Bend	trans	-128.5	85.3	-178.6	-70.5	-173.2	-7.7	0	0	111	S113 N118 S119	S113-Q116 CarbonylContact O-C 3.57Å; S113-Q116 PolarHBondContact O-N 2.95Å; S113-Q116 VanDerWaalsContact O-N 3.16Å; Q116-N118 PolarHBondContact O-N 3.02Å; Q116-S119 WeakPolarHBondContact O-CB 3.48Å; Q116-S119 PolarHBondContact O-N 3.47Å; Q116-S119 PolarHBondContact O-OG 3.38Å
117	D	49.9	Very low	65.2	Low	166 Å²	166	74.2 Å²	74.2	89%	0.888	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	36	50.3	160.7	-77.2	-20.1	0	0	0	117	S119	D117-S119 PolarHBondContact O-N 3.4Å
118	N	52.3	Low	64.5	Low	138 Å²	138	74.5 Å²	74.5	74%	0.738	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.7	28.1	179	-86.4	-23.6	0	0	0	113.6	Q116	Q116-N118 PolarHBondContact O-N 3.02Å
119	S	55.3	Low	63.5	Low	49 Å²	49	75.3 Å²	75.3	34%	0.343	40%	0.402	S	S	.	.	P	Polyproline II helix	trans	-70.9	143.7	-178.5	60.2	0	0	0	0	110.4	S113 Q116 D117 I121	S113-S119 PolarHBondContact OG-O 2.86Å; S113-S119 VanDerWaalsContact OG-O 3.12Å; Q116-S119 WeakPolarHBondContact O-CB 3.48Å; Q116-S119 PolarHBondContact O-N 3.47Å; Q116-S119 PolarHBondContact O-OG 3.38Å; D117-S119 PolarHBondContact O-N 3.4Å; S119-I121 PolarHBondContact O-N 3.39Å
120	A	62.7	Low	62.4	Low	41 Å²	41	76.9 Å²	76.9	34%	0.339	42%	0.421	S	S	.	.	P	Polyproline II helix	trans	-58.1	130.8	-177.5	0	0	0	0	0	110.9	K122 A129 L131	A120-K122 PolarHBondContact O-N 2.92Å; A120-A129 HydrophobicContact CB-CB 4.18Å; A120-L131 WeakPolarHBondContact CA-O 3.38Å
121	I	64.9	Low	61.5	Low	10 Å²	10	77.2 Å²	77.2	5%	0.051	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.6	124.5	176.9	-63.2	168.7	0	0	0	109	L109 S119 G130 L131 L133 F189	L109-I121 HydrophobicContact CD1-CG2 3.89Å; L109-I121 HydrophobicContact CD2-CG2 3.38Å; L109-I121 HydrophobicContact CG-CG2 3.43Å; L109-I121 VanDerWaalsContact CG-CG2 3.43Å; S119-I121 PolarHBondContact O-N 3.39Å; I121-G130 PolarHBondContact O-N 3.2Å; I121-L131 HydrophobicContact CB-CB 4.26Å; I121-L131 HydrophobicContact CD1-CB 4.44Å; I121-L131 PolarHBondContact N-O 3.47Å; I121-L133 HydrophobicContact CD1-CD1 4.16Å; I121-L133 HydrophobicContact CD1-CD2 4.4Å; I121-L133 HydrophobicContact CD1-CG 4.2Å; I121-F189 HydrophobicContact CD1-CZ 4.19Å
122	K	69.5	Low	60.4	Low	126 Å²	126	82 Å²	82	55%	0.548	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	130.3	177.1	-66.5	-175.5	-179.5	-177.2	0	110.8	L109 A120 K124 A129	L109-K122 WeakPolarHBondContact CD1-O 3.37Å; A120-K122 PolarHBondContact O-N 2.92Å; K122-K124 PolarHBondContact O-N 3.02Å; K122-A129 HydrophobicContact CG-CB 3.82Å
123	C	72.5	Confident	59.3	Low	5 Å²	5	79.3 Å²	79.3	3%	0.034	43%	0.429	C	S	.	.	P	Polyproline II helix	trans	-65	131.5	171.6	178.3	0	0	0	0	110.3	L95 C97 A125 C126 H127 I128	L95-C123 HydrophobicContact CD1-CB 4.17Å; C97-C123 VanDerWaalsContact SG-CB 3.56Å; C123-A125 VanDerWaalsContact C-N 3.27Å; C123-A125 PolarHBondContact O-N 3.26Å; C123-A125 PolarHBondContact SG-N 2.92Å; C123-A125 VanDerWaalsContact SG-N 3.36Å; C123-C126 VanDerWaalsContact CB-SG 3.58Å; C123-H127 WeakPolarHBondContact O-CA 3.44Å; C123-H127 PolarHBondContact O-N 3.25Å; C123-I128 PolarHBondContact N-O 3.41Å
124	K	76.3	Confident	58	Low	122 Å²	122	86.5 Å²	86.5	53%	0.53	46%	0.461	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-20.4	176.7	-66.1	-174.6	177.1	-176.2	0	113.7	F84 K122	F84-K124 HydrophobicContact CD1-CB 3.88Å; F84-K124 HydrophobicContact CD2-CB 4.44Å; F84-K124 HydrophobicContact CD2-CD 4.11Å; F84-K124 HydrophobicContact CD2-CG 4.4Å; F84-K124 HydrophobicContact CE1-CB 3.69Å; F84-K124 HydrophobicContact CE1-CG 4.42Å; F84-K124 HydrophobicContact CE2-CB 4.26Å; F84-K124 HydrophobicContact CE2-CD 4.26Å; F84-K124 HydrophobicContact CE2-CG 4.12Å; F84-K124 HydrophobicContact CG-CB 4.29Å; F84-K124 HydrophobicContact CG-CD 4.43Å; F84-K124 HydrophobicContact CZ-CB 3.9Å; F84-K124 HydrophobicContact CZ-CG 4.14Å; K122-K124 PolarHBondContact O-N 3.02Å
125	A	71.1	Confident	56.8	Low	45 Å²	45	90.6 Å²	90.6	37%	0.372	48%	0.476	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.5	-39.9	-178.8	0	0	0	0	0	112.9	F84 C123	F84-A125 HydrophobicContact CE1-CB 4.45Å; C123-A125 VanDerWaalsContact C-N 3.27Å; C123-A125 PolarHBondContact O-N 3.26Å; C123-A125 PolarHBondContact SG-N 2.92Å; C123-A125 VanDerWaalsContact SG-N 3.36Å
126	C	73.1	Confident	55.7	Low	20 Å²	20	92.3 Å²	92.3	14%	0.135	48%	0.48	C	S	.	.	T	Hydrogen-bonded Turn	trans	-119.5	-4.8	-178.3	66	0	0	0	0	115.1	C97 C123 I128 Y154	C97-C126 VanDerWaalsContact CB-SG 3.55Å; C123-C126 VanDerWaalsContact CB-SG 3.58Å; C126-I128 HydrophobicContact CB-CD1 4.28Å; C126-I128 HydrophobicContact CB-CG1 4.2Å; C126-I128 PolarHBondContact O-N 3.45Å; C126-I128 VanDerWaalsContact SG-CG1 3.59Å; C126-Y154 PolarHBondContact O-OH 3.18Å
127	H	69.3	Low	54.7	Low	128 Å²	128	96.5 Å²	96.5	59%	0.593	49%	0.492	S	S	*	.			trans	60.8	4.2	-177.3	-57.3	-67.2	0	0	0	116.6	C123 A129	C123-H127 WeakPolarHBondContact O-CA 3.44Å; C123-H127 PolarHBondContact O-N 3.25Å; H127-A129 PolarHBondContact O-N 2.82Å
128	I	62.1	Low	53.7	Low	59 Å²	59	94 Å²	94	30%	0.303	48%	0.479	S	S	.	.			trans	-62.7	121.2	174.7	-60.2	175.5	0	0	0	109.2	C97 C123 C126	C97-I128 HydrophobicContact CB-CD1 4.26Å; C123-I128 PolarHBondContact N-O 3.41Å; C126-I128 HydrophobicContact CB-CD1 4.28Å; C126-I128 HydrophobicContact CB-CG1 4.2Å; C126-I128 PolarHBondContact O-N 3.45Å; C126-I128 VanDerWaalsContact SG-CG1 3.59Å
129	A	56	Low	52.9	Low	55 Å²	55	90.5 Å²	90.5	46%	0.455	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	118.3	172.3	0	0	0	0	0	108.6	A120 K122 H127	A120-A129 HydrophobicContact CB-CB 4.18Å; K122-A129 HydrophobicContact CG-CB 3.82Å; H127-A129 PolarHBondContact O-N 2.82Å
130	G	52.9	Low	51.8	Low	47 Å²	47	95.7 Å²	95.7	49%	0.485	48%	0.482	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	-5.8	-167.9	0	0	0	0	0	117.4	I121	I121-G130 PolarHBondContact O-N 3.2Å
131	L	50.9	Low	50.2	Low	42 Å²	42	100 Å²	100	22%	0.22	50%	0.499	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	108.5	-174.6	-76	155.9	0	0	0	112.4	P96 A120 I121 F189	P96-L131 HydrophobicContact CG-CD1 3.75Å; P96-L131 HydrophobicContact CG-CD2 4.26Å; P96-L131 HydrophobicContact CG-CG 3.93Å; A120-L131 WeakPolarHBondContact CA-O 3.38Å; I121-L131 HydrophobicContact CB-CB 4.26Å; I121-L131 HydrophobicContact CD1-CB 4.44Å; I121-L131 PolarHBondContact N-O 3.47Å; L131-F189 HydrophobicContact CD1-CD1 4.1Å; L131-F189 HydrophobicContact CD1-CE1 3.11Å; L131-F189 HydrophobicContact CD1-CZ 3.6Å
132	K	46.1	Very low	48.3	Very low	176 Å²	176	106.5 Å²	106.5	77%	0.765	53%	0.534	S	S	*	.			trans	-77	119.3	136.9	-79.8	-179.3	176.8	174.2	0	106	Q134	K132-Q134 VanDerWaalsContact C-N 3.25Å; K132-Q134 PolarHBondContact O-N 2.77Å
133	L	40.5	Very low	46.3	Very low	51 Å²	51	108 Å²	108	27%	0.267	55%	0.548	S	S	.	.			trans	-62.7	90.9	167.4	-68.1	162.4	0	0	0	107.3	M114 I121 K135 Q188	M114-L133 HydrophobicContact CE-CD1 3.76Å; I121-L133 HydrophobicContact CD1-CD1 4.16Å; I121-L133 HydrophobicContact CD1-CD2 4.4Å; I121-L133 HydrophobicContact CD1-CG 4.2Å; L133-K135 PolarHBondContact O-N 3.32Å; L133-Q188 HydrophobicContact CD2-CB 3.94Å; L133-Q188 HydrophobicContact CD2-CG 4.09Å
134	Q	34.4	Very low	44.1	Very low	163 Å²	163	112.2 Å²	112.2	76%	0.762	58%	0.578	S	S	*	*			trans	-67.1	120.1	170.9	-86.9	-174.9	-7.8	0	0	107.5	K132 Q136 Q188	K132-Q134 VanDerWaalsContact C-N 3.25Å; K132-Q134 PolarHBondContact O-N 2.77Å; Q134-Q136 PolarHBondContact O-N 2.87Å; Q134-Q188 PolarHBondContact O-NE2 3.08Å
135	K	30	Very low	41.6	Very low	194 Å²	194	115.8 Å²	115.8	84%	0.843	59%	0.594	S	S	*	*			trans	-57.8	126.2	166.7	-71	-179.4	175.5	-177.9	0	107.8	L133	L133-K135 PolarHBondContact O-N 3.32Å
136	Q	30.2	Very low	39.6	Very low	178 Å²	178	118.4 Å²	118.4	83%	0.832	60%	0.604	S	S	*	*			trans	30.5	114.3	161.9	-75.3	173.6	-27.2	0	0	117.3	Q134 D138	Q134-Q136 PolarHBondContact O-N 2.87Å; Q136-D138 PolarHBondContact O-N 3.36Å; Q136-D138 VanDerWaalsContact O-N 3.07Å
137	Y	29.3	Very low	37.3	Very low	211 Å²	211	123.8 Å²	123.8	83%	0.827	63%	0.632	S	S	*	*			trans	-35.1	112.4	155.3	-114.1	-103.1	0	0	0	110.8
138	D	27.9	Very low	35.4	Very low	115 Å²	115	125.9 Å²	125.9	62%	0.615	64%	0.642	S	S	*	*			trans	-102.9	106.4	167.5	-167.2	-7.9	0	0	0	107.6	Q136 H140	Q136-D138 PolarHBondContact O-N 3.36Å; Q136-D138 VanDerWaalsContact O-N 3.07Å; D138-H140 PolarHBondContact O-N 2.74Å; D138-H140 IonicContact OD1-CD2 3.41Å; D138-H140 PolarHBondContact OD1-N 3.47Å
139	P	35.3	Very low	33.7	Very low	63 Å²	63	128.4 Å²	128.4	41%	0.409	66%	0.66	S	S	.	*	T	Hydrogen-bonded Turn	trans	-70.6	2.8	-176	26.9	-31	0	0	0	113.6	E348	P139-E348 VanDerWaalsContact CB-CD 3.44Å; P139-E348 HydrophobicContact CB-CG 4.3Å; P139-E348 WeakPolarHBondContact CB-OE2 3.3Å; P139-E348 VanDerWaalsContact CG-CD 3.46Å; P139-E348 WeakPolarHBondContact CG-OE1 3.22Å
140	H	32.7	Very low	32.4	Very low	158 Å²	158	133 Å²	133	73%	0.731	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.1	-1.8	-177.5	-74.5	-56.1	0	0	0	116.4	D138	D138-H140 PolarHBondContact O-N 2.74Å; D138-H140 IonicContact OD1-CD2 3.41Å; D138-H140 PolarHBondContact OD1-N 3.47Å
141	N	29	Very low	31.1	Very low	131 Å²	131	136.2 Å²	136.2	70%	0.701	68%	0.679	S	S	*	*			trans	-105.4	80.5	179.8	-147	5.9	0	0	0	112.7	N143	N141-N143 VanDerWaalsContact C-N 3.34Å; N141-N143 PolarHBondContact O-N 3.46Å
142	N	25.7	Very low	30.1	Very low	148 Å²	148	139.9 Å²	139.9	79%	0.791	70%	0.699	S	S	*	*			trans	-63.9	90.4	165.1	-80.9	-32.4	0	0	0	109.5
143	N	26.3	Very low	29.3	Very low	158 Å²	158	138.9 Å²	138.9	85%	0.845	70%	0.702	S	S	*	*			trans	159.7	66.2	153.1	-81.5	-22.9	0	0	0	111.8	N141	N141-N143 VanDerWaalsContact C-N 3.34Å; N141-N143 PolarHBondContact O-N 3.46Å
144	S	27.1	Very low	28.8	Very low	93 Å²	93	143.4 Å²	143.4	65%	0.65	72%	0.716	S	S	*	*			trans	-162.2	77.3	158.2	72.7	0	0	0	0	112.6	V146	S144-V146 PolarHBondContact O-N 2.75Å; S144-V146 VanDerWaalsContact O-N 3.09Å
145	F	24.2	Very low	28.4	Very low	197 Å²	197	139.9 Å²	139.9	86%	0.864	70%	0.703	S	S	*	*			trans	-73.2	86.8	154.1	-124.2	-94.1	0	0	0	106.2	N147	F145-N147 PolarHBondContact O-N 3.13Å
146	V	28.1	Very low	28.5	Very low	99 Å²	99	137 Å²	137	60%	0.6	70%	0.697	S	S	*	*			trans	-88.3	103.7	170.4	-171.4	0	0	0	0	106.9	S144 E148	S144-V146 PolarHBondContact O-N 2.75Å; S144-V146 VanDerWaalsContact O-N 3.09Å; V146-E148 HydrophobicContact CG1-CG 3.79Å; V146-E148 PolarHBondContact O-N 3.18Å
147	N	25.4	Very low	28.4	Very low	133 Å²	133	136.5 Å²	136.5	71%	0.711	69%	0.694	S	S	*	*			trans	-54.8	86.7	154.1	-74.7	-33	0	0	0	108.3	F145 T149	F145-N147 PolarHBondContact O-N 3.13Å; N147-T149 PolarHBondContact O-N 3.07Å; N147-T149 VanDerWaalsContact O-N 3.07Å
148	E	28.4	Very low	28.4	Very low	172 Å²	172	133.6 Å²	133.6	80%	0.804	69%	0.686	S	S	*	*			trans	-80.2	80.3	162.7	-78.5	-171.6	164	0	0	107.9	V146 L150	V146-E148 HydrophobicContact CG1-CG 3.79Å; V146-E148 PolarHBondContact O-N 3.18Å; E148-L150 PolarHBondContact O-N 2.5Å
149	T	26.8	Very low	28.5	Very low	112 Å²	112	138.4 Å²	138.4	69%	0.687	70%	0.697	S	S	*	*			trans	-50.1	120	152	21	0	0	0	0	108.4	N147 E151	N147-T149 PolarHBondContact O-N 3.07Å; N147-T149 VanDerWaalsContact O-N 3.07Å; T149-E151 VanDerWaalsContact C-N 3.33Å; T149-E151 PolarHBondContact O-N 3.45Å
150	L	28	Very low	28	Very low	153 Å²	153	139.4 Å²	139.4	80%	0.801	71%	0.705	S	S	*	*			trans	-53	90.8	168.9	-76.1	147.7	0	0	0	110.1	E148 N152	E148-L150 PolarHBondContact O-N 2.5Å; L150-N152 PolarHBondContact O-N 3.05Å
151	E	26.8	Very low	27.6	Very low	114 Å²	114	138.7 Å²	138.7	53%	0.533	71%	0.712	S	S	.	*			trans	-79.9	102.6	166.1	-76.2	-172.7	167.1	0	0	108.5	T149 N153 N896	T149-E151 VanDerWaalsContact C-N 3.33Å; T149-E151 PolarHBondContact O-N 3.45Å; E151-N153 PolarHBondContact O-N 3.34Å; E151-N896 PolarHBondContact OE1-ND2 2.98Å; E151-N896 PolarHBondContact OE2-ND2 3.35Å
152	N	30.4	Very low	27.4	Very low	119 Å²	119	139 Å²	139	64%	0.636	72%	0.719	S	S	*	*			trans	-60.8	96.6	174.9	-76.5	-36	0	0	0	111.2	L150 Y154	L150-N152 PolarHBondContact O-N 3.05Å; N152-Y154 PolarHBondContact O-N 3.03Å
153	N	28.5	Very low	27.2	Very low	155 Å²	155	139.5 Å²	139.5	83%	0.829	72%	0.716	S	S	*	*			trans	-82.3	82	164.9	-77.2	-47	0	0	0	110.2	E151	E151-N153 PolarHBondContact O-N 3.34Å
154	Y	29.4	Very low	27.1	Very low	146 Å²	146	137.5 Å²	137.5	57%	0.573	71%	0.712	S	S	*	*			trans	-98.7	102.4	158.9	-87	-86.7	0	0	0	107.9	C126 N152	C126-Y154 PolarHBondContact O-OH 3.18Å; N152-Y154 PolarHBondContact O-N 3.03Å
155	N	26.6	Very low	27	Very low	89 Å²	89	140.8 Å²	140.8	48%	0.476	72%	0.717	S	S	.	*			trans	-174.1	84.3	162.7	-94	-21.5	0	0	0	109.1	Q900	N155-Q900 HydrophobicContact CB-CG 4.43Å
156	D	32.6	Very low	26.9	Very low	133 Å²	133	138.5 Å²	138.5	71%	0.711	71%	0.712	S	S	*	*			trans	-160.2	80	154.1	-98.8	-26.9	0	0	0	110.2	K158 K907	D156-K158 PolarHBondContact O-N 3.26Å; D156-K907 IonicContact OD1-NZ 3.67Å
157	E	28.2	Very low	26.7	Very low	167 Å²	167	140.1 Å²	140.1	78%	0.78	72%	0.718	S	S	*	*			trans	-79.3	101.3	158.8	-73.7	-173.8	165.8	0	0	109.1
158	K	29.1	Very low	26.6	Very low	151 Å²	151	138.6 Å²	138.6	66%	0.657	72%	0.718	S	S	*	*			trans	-143.2	141.7	145.3	-92.6	-179.1	-178.2	171.2	0	106.4	D156	D156-K158 PolarHBondContact O-N 3.26Å
159	Y	28.9	Very low	26.4	Very low	215 Å²	215	136.3 Å²	136.3	84%	0.843	72%	0.715	S	S	*	*			trans	100.4	75.8	178.8	-56.9	-72.6	0	0	0	116.7
160	S	26.1	Very low	26.3	Very low	84 Å²	84	138 Å²	138	59%	0.587	73%	0.725	S	S	*	*				34.5	110.8	118.1	57.7	0	0	0	0	118.1	V162	S160-V162 PolarHBondContact O-N 3.44Å
161	T	23.4	Very low	26.2	Very low	143 Å²	143	133.5 Å²	133.5	88%	0.877	72%	0.717	S	S	*	*			trans	20	94.2	131.7	19.1	0	0	0	0	115.8
162	V	24.3	Very low	26.2	Very low	139 Å²	139	133.6 Å²	133.6	84%	0.842	73%	0.73	S	S	*	*			trans	-127.1	109.9	150	-177.1	0	0	0	0	106.2	S160	S160-V162 PolarHBondContact O-N 3.44Å
163	Q	23.2	Very low	26.1	Very low	157 Å²	157	134.1 Å²	134.1	73%	0.734	73%	0.733	S	S	*	*			trans	-57.9	146.3	173	-69.7	-177.1	-35.8	0	0	109.9	E165	Q163-E165 VanDerWaalsContact C-N 3.33Å; Q163-E165 PolarHBondContact O-N 3.06Å
164	P	24	Very low	26	Very low	116 Å²	116	131.5 Å²	131.5	75%	0.753	73%	0.726	S	S	*	*			trans	-73.2	93.9	167.8	30.3	-27.9	0	0	0	107.3	I166	P164-I166 VanDerWaalsContact C-N 3.3Å; P164-I166 PolarHBondContact O-N 3.43Å
165	E	23.7	Very low	25.9	Very low	162 Å²	162	129.8 Å²	129.8	76%	0.757	73%	0.725	S	S	*	*			trans	-65.6	98.8	163.2	-81.2	-169.7	176	0	0	108.2	Q163 N167	Q163-E165 VanDerWaalsContact C-N 3.33Å; Q163-E165 PolarHBondContact O-N 3.06Å; E165-N167 VanDerWaalsContact C-N 3.33Å; E165-N167 PolarHBondContact O-N 2.94Å
166	I	23.2	Very low	26.1	Very low	149 Å²	149	130.6 Å²	130.6	76%	0.764	73%	0.729	S	S	*	*			trans	-63.2	95.7	163.5	-60.9	165.7	0	0	0	106.4	P164	P164-I166 VanDerWaalsContact C-N 3.3Å; P164-I166 PolarHBondContact O-N 3.43Å
167	N	24	Very low	25.9	Very low	134 Å²	134	132.4 Å²	132.4	72%	0.717	73%	0.733	S	S	*	*			trans	-105.2	98	158.8	-86.3	-30.6	0	0	0	109.1	E165 T169	E165-N167 VanDerWaalsContact C-N 3.33Å; E165-N167 PolarHBondContact O-N 2.94Å; N167-T169 PolarHBondContact O-N 3.45Å
168	S	22.4	Very low	25.8	Very low	101 Å²	101	134.6 Å²	134.6	71%	0.706	74%	0.74	S	S	*	*			trans	-54.1	105.8	163.5	52.2	0	0	0	0	111.2
169	T	25.5	Very low	25.8	Very low	124 Å²	124	136.2 Å²	136.2	76%	0.761	75%	0.75	S	S	*	*			trans	-154.5	107.1	150.4	38.7	0	0	0	0	109.7	N167 G171	N167-T169 PolarHBondContact O-N 3.45Å; T169-G171 PolarHBondContact O-N 3.08Å
170	T	24.6	Very low	25.9	Very low	146 Å²	146	134.7 Å²	134.7	90%	0.896	75%	0.751	S	S	*	*			trans	-4.3	116	147.4	52.7	0	0	0	0	115.7
171	G	24.7	Very low	25.9	Very low	60 Å²	60	137.2 Å²	137.2	62%	0.619	76%	0.763	S	S	*	*			trans	156.7	93.2	169.7	0	0	0	0	0	113.6	T169 N173	T169-G171 PolarHBondContact O-N 3.08Å; G171-N173 PolarHBondContact O-N 3.38Å; G171-N173 VanDerWaalsContact O-N 3.12Å
172	S	26.7	Very low	26.2	Very low	116 Å²	116	134.5 Å²	134.5	81%	0.811	75%	0.749	S	S	*	*			trans	-39	111.7	155	47.5	0	0	0	0	111.1
173	N	28.5	Very low	26.7	Very low	129 Å²	129	132.9 Å²	132.9	69%	0.69	74%	0.74	S	S	*	*			trans	-157.2	77.9	167.2	-91.1	-24.7	0	0	0	111.1	G171 I175	G171-N173 PolarHBondContact O-N 3.38Å; G171-N173 VanDerWaalsContact O-N 3.12Å; N173-I175 HydrophobicContact CB-CD1 3.88Å; N173-I175 HydrophobicContact CB-CG1 3.85Å; N173-I175 PolarHBondContact O-N 2.57Å; N173-I175 VanDerWaalsContact O-N 3.09Å; N173-I175 WeakPolarHBondContact OD1-CD1 3.3Å
174	C	26.1	Very low	27.2	Very low	101 Å²	101	129.7 Å²	129.7	68%	0.682	73%	0.731	S	S	*	*			trans	-76.4	75.1	152.1	-161	0	0	0	0	106.7	L176	C174-L176 PolarHBondContact O-N 3.45Å
175	I	29	Very low	28	Very low	110 Å²	110	131.3 Å²	131.3	56%	0.564	73%	0.733	S	S	*	*			trans	-91.5	92.8	173.5	-59.4	173	0	0	0	106.3	N173 E177	N173-I175 HydrophobicContact CB-CD1 3.88Å; N173-I175 HydrophobicContact CB-CG1 3.85Å; N173-I175 PolarHBondContact O-N 2.57Å; N173-I175 VanDerWaalsContact O-N 3.09Å; N173-I175 WeakPolarHBondContact OD1-CD1 3.3Å; I175-E177 HydrophobicContact CG2-CG 3.95Å
176	L	30.5	Very low	29.1	Very low	106 Å²	106	130.7 Å²	130.7	56%	0.555	73%	0.73	S	S	*	*			trans	-80.4	106.1	151.3	-74.6	170.1	0	0	0	105.6	C174 K178	C174-L176 PolarHBondContact O-N 3.45Å; L176-K178 PolarHBondContact O-N 3.06Å
177	E	28.5	Very low	30.5	Very low	171 Å²	171	124.8 Å²	124.8	80%	0.799	70%	0.7	S	S	*	*			trans	-55.1	136.9	168.9	-71.5	-177.1	151.9	0	0	109	I175 E179	I175-E177 HydrophobicContact CG2-CG 3.95Å; E177-E179 PolarHBondContact O-N 2.78Å
178	K	26.4	Very low	32.2	Very low	212 Å²	212	123.6 Å²	123.6	92%	0.922	69%	0.69	S	S	*	*			trans	-61.2	98.3	-178.1	-67.8	171.9	175.7	176.6	0	109.5	L176	L176-K178 PolarHBondContact O-N 3.06Å
179	E	28.6	Very low	34.2	Very low	185 Å²	185	119.2 Å²	119.2	86%	0.864	66%	0.659	S	S	*	*			trans	-124.6	146.3	159.1	-72.6	-169.2	163.1	0	0	109.9	E177	E177-E179 PolarHBondContact O-N 2.78Å
180	E	30.1	Very low	36.1	Very low	184 Å²	184	117.3 Å²	117.3	86%	0.86	65%	0.648	S	S	*	*			trans	-74.8	129.1	-146.1	-65.9	168.3	147.6	0	0	115.1
181	T	26.7	Very low	38	Very low	137 Å²	137	113.7 Å²	113.7	84%	0.84	62%	0.624	S	S	*	*			trans	40.6	87.9	142.8	62	0	0	0	0	119.1
182	S	30.6	Very low	40	Very low	86 Å²	86	111.3 Å²	111.3	60%	0.601	60%	0.598	S	S	*	*			trans	-110.2	134	134.7	60.9	0	0	0	0	108	V184	S182-V184 VanDerWaalsContact C-N 3.32Å; S182-V184 PolarHBondContact O-N 3.01Å
183	T	34.4	Very low	41.8	Very low	105 Å²	105	109.6 Å²	109.6	64%	0.644	58%	0.579	S	S	*	*			trans	-68.4	85.5	-173.4	42.1	0	0	0	0	111.2	D185 E186	T183-D185 PolarHBondContact O-N 3.43Å; T183-E186 PolarHBondContact O-N 3.23Å
184	V	33.9	Very low	43.4	Very low	89 Å²	89	109.3 Å²	109.3	54%	0.539	57%	0.572	S	S	.	*	T	Hydrogen-bonded Turn	trans	38.8	-23.9	130.1	-175.8	0	0	0	0	120.7	R103 S182	R103-V184 PolarHBondContact NH2-O 3.32Å; S182-V184 VanDerWaalsContact C-N 3.32Å; S182-V184 PolarHBondContact O-N 3.01Å
185	D	40.9	Very low	45.3	Very low	150 Å²	150	104.9 Å²	104.9	80%	0.802	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.1	2.9	-179.4	-74.9	-30.9	0	0	0	115	R103 T183	R103-D185 IonicContact NH2-OD1 3.7Å; T183-D185 PolarHBondContact O-N 3.43Å
186	E	45.6	Very low	46.9	Very low	150 Å²	150	101.4 Å²	101.4	70%	0.701	52%	0.522	S	S	*	.			trans	-89	3.5	-177.1	-72.3	-174.2	153.2	0	0	116.1	T183 Q188	T183-E186 PolarHBondContact O-N 3.23Å; E186-Q188 PolarHBondContact O-N 2.95Å; E186-Q188 VanDerWaalsContact O-N 3.14Å
187	L	52.9	Low	48.5	Very low	25 Å²	25	101.3 Å²	101.3	13%	0.131	52%	0.518	C	S	.	.			trans	-75.8	105.3	176.6	-87.2	142.6	0	0	0	110.7	A106 I107 N110 F189	A106-L187 HydrophobicContact CB-CD2 4.13Å; A106-L187 WeakPolarHBondContact O-CD2 3.26Å; I107-L187 HydrophobicContact CB-CD1 4.38Å; I107-L187 HydrophobicContact CG1-CD1 3.41Å; I107-L187 VanDerWaalsContact CG1-CD1 3.41Å; N110-L187 HydrophobicContact CB-CD2 3.81Å; L187-F189 HydrophobicContact CD2-CD2 3.98Å; L187-F189 HydrophobicContact CD2-CE2 4.15Å; L187-F189 PolarHBondContact O-N 2.64Å
188	Q	59.7	Low	50.2	Low	109 Å²	109	93.7 Å²	93.7	51%	0.509	48%	0.482	S	S	.	.			trans	-61.5	5.8	-177.3	-67.5	-172.2	-18.5	0	0	116	L133 Q134 E186	L133-Q188 HydrophobicContact CD2-CB 3.94Å; L133-Q188 HydrophobicContact CD2-CG 4.09Å; Q134-Q188 PolarHBondContact O-NE2 3.08Å; E186-Q188 PolarHBondContact O-N 2.95Å; E186-Q188 VanDerWaalsContact O-N 3.14Å
189	F	64.7	Low	52	Low	9 Å²	9	84.7 Å²	84.7	4%	0.039	44%	0.442	C	S	.	.	S	Bend	trans	-84.1	132	175.9	-60.9	-75	0	0	0	111.2	K93 L95 L109 I121 L131 L187	K93-F189 HydrophobicContact CB-CB 3.88Å; K93-F189 HydrophobicContact CD-CB 4.2Å; K93-F189 WeakPolarHBondContact CD-O 3.39Å; K93-F189 HydrophobicContact CG-CB 4.25Å; K93-F189 PolarHBondContact NZ-O 3.09Å; L95-F189 HydrophobicContact CD2-CD1 3.93Å; L95-F189 HydrophobicContact CD2-CE1 3.38Å; L95-F189 HydrophobicContact CD2-CZ 3.78Å; L109-F189 HydrophobicContact CD2-CZ 4.44Å; I121-F189 HydrophobicContact CD1-CZ 4.19Å; L131-F189 HydrophobicContact CD1-CD1 4.1Å; L131-F189 HydrophobicContact CD1-CE1 3.11Å; L131-F189 HydrophobicContact CD1-CZ 3.6Å; L187-F189 HydrophobicContact CD2-CD2 3.98Å; L187-F189 HydrophobicContact CD2-CE2 4.15Å; L187-F189 PolarHBondContact O-N 2.64Å
190	P	64.2	Low	53.8	Low	84 Å²	84	79 Å²	79	55%	0.545	42%	0.418	S	S	.	.	P	Polyproline II helix	trans	-66	146.8	176	27.7	-33	0	0	0	110.9	L94	L94-P190 PolarHBondContact N-O 3.37Å
191	N	65.3	Low	55.5	Low	70 Å²	70	71.2 Å²	71.2	37%	0.374	38%	0.382	S	S	.	.	B	Isolated β-bridge	trans	-66.2	138.8	169.6	-68.5	-1.6	0	0	0	109.1	K93 I193	K93-N191 WeakPolarHBondContact CD-OD1 3.28Å; K93-N191 WeakPolarHBondContact CE-OD1 3.14Å; K93-N191 PolarHBondContact NZ-OD1 2.96Å; N191-I193 HydrophobicContact CB-CG1 4.07Å; N191-I193 PolarHBondContact O-N 3.01Å
192	A	67	Low	57.2	Low	9 Å²	9	65 Å²	65	7%	0.074	34%	0.344	C	S	.	.			trans	-78.3	65.3	171.5	0	0	0	0	0	109.7	I92 L94 F194 I195 E196	I92-A192 HydrophobicContact CB-CB 4.23Å; I92-A192 HydrophobicContact CG2-CB 3.75Å; I92-A192 PolarHBondContact O-N 2.82Å; L94-A192 HydrophobicContact CB-CB 4.38Å; A192-F194 PolarHBondContact O-N 3.23Å; A192-I195 HydrophobicContact CB-CB 3.99Å; A192-I195 HydrophobicContact CB-CD1 4.05Å; A192-I195 HydrophobicContact CB-CG1 4.22Å; A192-I195 WeakPolarHBondContact O-CA 3.34Å; A192-I195 WeakPolarHBondContact O-CB 3.42Å; A192-I195 PolarHBondContact O-N 2.91Å; A192-E196 PolarHBondContact O-N 2.96Å
193	I	63.7	Low	58.9	Low	80 Å²	80	64.2 Å²	64.2	41%	0.41	33%	0.334	S	S	.	.	H	α-helix	trans	-51.5	-39.3	-172.3	-61.1	169.8	0	0	0	111.5	N191 I195 E196 K197 T276	N191-I193 HydrophobicContact CB-CG1 4.07Å; N191-I193 PolarHBondContact O-N 3.01Å; I193-I195 VanDerWaalsContact C-N 3.34Å; I193-I195 PolarHBondContact O-N 2.84Å; I193-E196 PolarHBondContact O-N 2.88Å; I193-K197 HydrophobicContact CG2-CG 4.4Å; I193-K197 VanDerWaalsContact O-CG 3.29Å; I193-K197 WeakPolarHBondContact O-CG 3.43Å; I193-K197 PolarHBondContact O-N 2.83Å; I193-T276 HydrophobicContact CD1-CG2 3.82Å
194	F	63.2	Low	60.4	Low	124 Å²	124	59.8 Å²	59.8	54%	0.544	31%	0.306	S	S	.	.	H	α-helix	trans	-60	-41.6	176.5	177.6	-106.8	0	0	0	113	A192 K197 L198	A192-F194 PolarHBondContact O-N 3.23Å; F194-K197 PolarHBondContact O-N 2.89Å; F194-L198 HydrophobicContact CD1-CD1 3.88Å; F194-L198 HydrophobicContact CD1-CG 4.5Å; F194-L198 HydrophobicContact CE1-CD1 3.28Å; F194-L198 HydrophobicContact CE1-CG 4.09Å; F194-L198 HydrophobicContact CE2-CD1 4.34Å; F194-L198 HydrophobicContact CE2-CG 4.33Å; F194-L198 HydrophobicContact CZ-CD1 3.54Å; F194-L198 HydrophobicContact CZ-CD2 4.31Å; F194-L198 HydrophobicContact CZ-CG 3.99Å; F194-L198 WeakPolarHBondContact O-CG 3.37Å; F194-L198 PolarHBondContact O-N 2.82Å
195	I	64.7	Low	61.7	Low	8 Å²	8	56.2 Å²	56.2	4%	0.041	28%	0.284	C	S	.	.	H	α-helix	trans	-71.6	-40.5	179.4	-68.2	-177.4	0	0	0	110.8	F79 L80 I92 T100 A192 I193 K197 L198 R199	F79-I195 HydrophobicContact CE1-CD1 4.3Å; F79-I195 HydrophobicContact CE1-CG1 4.46Å; F79-I195 HydrophobicContact CZ-CD1 4.46Å; L80-I195 HydrophobicContact CD2-CB 4.5Å; L80-I195 HydrophobicContact CD2-CG1 4.41Å; L80-I195 HydrophobicContact CD2-CG2 3.82Å; I92-I195 HydrophobicContact CD1-CG2 3.59Å; T100-I195 HydrophobicContact CG2-CD1 3.34Å; A192-I195 HydrophobicContact CB-CB 3.99Å; A192-I195 HydrophobicContact CB-CD1 4.05Å; A192-I195 HydrophobicContact CB-CG1 4.22Å; A192-I195 WeakPolarHBondContact O-CA 3.34Å; A192-I195 WeakPolarHBondContact O-CB 3.42Å; A192-I195 PolarHBondContact O-N 2.91Å; I193-I195 VanDerWaalsContact C-N 3.34Å; I193-I195 PolarHBondContact O-N 2.84Å; I195-K197 VanDerWaalsContact C-N 3.3Å; I195-K197 PolarHBondContact O-N 3.45Å; I195-L198 PolarHBondContact O-N 3.15Å; I195-R199 PolarHBondContact O-N 2.95Å
196	E	63.3	Low	62.8	Low	37 Å²	37	52.4 Å²	52.4	17%	0.173	26%	0.261	C	S	.	.	H	α-helix	trans	-56.6	-46.5	172.3	-65.5	177.3	172.8	0	0	110.4	A192 I193 R199 D200	A192-E196 PolarHBondContact O-N 2.96Å; I193-E196 PolarHBondContact O-N 2.88Å; E196-R199 PolarHBondContact O-N 2.94Å; E196-D200 PolarHBondContact O-N 3.23Å
197	K	63.6	Low	63.3	Low	104 Å²	104	54.5 Å²	54.5	45%	0.452	27%	0.268	S	S	.	.	H	α-helix	trans	-68.5	-34.7	177.8	-64.8	-60.3	169	-157.7	0	114.1	I193 F194 I195 R199 D200 L201	I193-K197 HydrophobicContact CG2-CG 4.4Å; I193-K197 VanDerWaalsContact O-CG 3.29Å; I193-K197 WeakPolarHBondContact O-CG 3.43Å; I193-K197 PolarHBondContact O-N 2.83Å; F194-K197 PolarHBondContact O-N 2.89Å; I195-K197 VanDerWaalsContact C-N 3.3Å; I195-K197 PolarHBondContact O-N 3.45Å; K197-R199 VanDerWaalsContact C-N 3.31Å; K197-D200 IonicContact NZ-OD2 2.71Å; K197-D200 PolarHBondContact NZ-OD2 2.78Å; K197-D200 PolarHBondContact O-N 3.17Å; K197-L201 WeakPolarHBondContact O-CB 3.33Å; K197-L201 PolarHBondContact O-N 2.86Å
198	L	65.4	Low	63.7	Low	11 Å²	11	62.4 Å²	62.4	6%	0.058	30%	0.304	C	S	.	.	H	α-helix	trans	-65.1	-36.4	172.6	-79.4	178	0	0	0	111.8	M1 L75 L80 F194 I195 L201 A202	M1-L198 HydrophobicContact SD-CD2 4.28Å; L75-L198 HydrophobicContact CD2-CB 4.38Å; L75-L198 WeakPolarHBondContact CD2-O 3.41Å; L80-L198 HydrophobicContact CD2-CD1 4.5Å; F194-L198 HydrophobicContact CD1-CD1 3.88Å; F194-L198 HydrophobicContact CD1-CG 4.5Å; F194-L198 HydrophobicContact CE1-CD1 3.28Å; F194-L198 HydrophobicContact CE1-CG 4.09Å; F194-L198 HydrophobicContact CE2-CD1 4.34Å; F194-L198 HydrophobicContact CE2-CG 4.33Å; F194-L198 HydrophobicContact CZ-CD1 3.54Å; F194-L198 HydrophobicContact CZ-CD2 4.31Å; F194-L198 HydrophobicContact CZ-CG 3.99Å; F194-L198 WeakPolarHBondContact O-CG 3.37Å; F194-L198 PolarHBondContact O-N 2.82Å; I195-L198 PolarHBondContact O-N 3.15Å; L198-L201 WeakPolarHBondContact O-CB 3.08Å; L198-L201 PolarHBondContact O-N 2.67Å; L198-A202 WeakPolarHBondContact O-CB 3.29Å; L198-A202 PolarHBondContact O-N 2.81Å
199	R	64.5	Low	63.8	Low	22 Å²	22	59.3 Å²	59.3	8%	0.083	29%	0.293	C	S	.	.	H	α-helix	trans	-71.6	-40.3	174.3	-77.4	174.8	171.5	177.6	-14.7	113.1	L80 N88 D89 I92 I195 E196 K197 L201 A202 N203	L80-R199 HydrophobicContact CD1-CG 4.13Å; L80-R199 PolarHBondContact O-NE 2.81Å; L80-R199 PolarHBondContact O-NH2 3.24Å; N88-R199 VanDerWaalsContact CA-NH2 3.33Å; D89-R199 PolarHBondContact O-NH1 2.71Å; I92-R199 VanDerWaalsContact CD1-NH1 3.3Å; I195-R199 PolarHBondContact O-N 2.95Å; E196-R199 PolarHBondContact O-N 2.94Å; K197-R199 VanDerWaalsContact C-N 3.31Å; R199-L201 PolarHBondContact O-N 3.15Å; R199-A202 VanDerWaalsContact O-CB 3.28Å; R199-A202 WeakPolarHBondContact O-CB 3.17Å; R199-A202 PolarHBondContact O-N 3.39Å; R199-A202 VanDerWaalsContact O-N 3.08Å; R199-N203 WeakPolarHBondContact O-CB 3.26Å; R199-N203 VanDerWaalsContact O-CG 3.24Å; R199-N203 PolarHBondContact O-N 2.45Å; R199-N203 PolarHBondContact O-ND2 2.96Å
200	D	65.3	Low	64	Low	66 Å²	66	65.3 Å²	65.3	35%	0.353	32%	0.324	S	S	.	.	H	α-helix	trans	-54.7	-44.7	171.3	-72	-18.1	0	0	0	109.8	E196 K197 N203 L204	E196-D200 PolarHBondContact O-N 3.23Å; K197-D200 IonicContact NZ-OD2 2.71Å; K197-D200 PolarHBondContact NZ-OD2 2.78Å; K197-D200 PolarHBondContact O-N 3.17Å; D200-N203 PolarHBondContact O-N 2.98Å; D200-L204 WeakPolarHBondContact O-CD1 3.11Å; D200-L204 VanDerWaalsContact O-CG 3.25Å; D200-L204 WeakPolarHBondContact O-CG 3.38Å; D200-L204 PolarHBondContact O-N 3.01Å; D200-L204 VanDerWaalsContact O-N 3.13Å
201	L	65.4	Low	64.5	Low	21 Å²	21	63.2 Å²	63.2	11%	0.11	31%	0.305	C	S	.	.	H	α-helix	trans	-63.9	-42.9	175	-174.1	68.7	0	0	0	112.3	M1 L71 K197 L198 R199 N203 L204 L205 L267 M270	M1-L201 HydrophobicContact SD-CD2 4.49Å; L71-L201 HydrophobicContact CD2-CD2 4.19Å; K197-L201 WeakPolarHBondContact O-CB 3.33Å; K197-L201 PolarHBondContact O-N 2.86Å; L198-L201 WeakPolarHBondContact O-CB 3.08Å; L198-L201 PolarHBondContact O-N 2.67Å; R199-L201 PolarHBondContact O-N 3.15Å; L201-N203 PolarHBondContact O-N 3.31Å; L201-L204 PolarHBondContact O-N 2.88Å; L201-L205 HydrophobicContact CG-CD1 4.27Å; L201-L205 WeakPolarHBondContact O-CG 3.24Å; L201-L205 PolarHBondContact O-N 2.92Å; L201-L205 VanDerWaalsContact O-N 3.11Å; L201-L267 HydrophobicContact CD1-CB 4.26Å; L201-L267 HydrophobicContact CD1-CD1 4.46Å; L201-L267 HydrophobicContact CD1-CD2 3.75Å; L201-L267 HydrophobicContact CD1-CG 4.36Å; L201-M270 HydrophobicContact CD1-CE 4.2Å
202	A	64	Low	65.3	Low	5 Å²	5	64 Å²	64	4%	0.041	31%	0.305	C	S	.	.	H	α-helix	trans	-57	-49.3	176.2	0	0	0	0	0	112.2	L75 L198 R199 L204 L205 Q206	L75-A202 HydrophobicContact CB-CB 4.17Å; L75-A202 HydrophobicContact CD1-CB 3.36Å; L75-A202 HydrophobicContact CD2-CB 3.53Å; L75-A202 HydrophobicContact CG-CB 3.82Å; L198-A202 WeakPolarHBondContact O-CB 3.29Å; L198-A202 PolarHBondContact O-N 2.81Å; R199-A202 VanDerWaalsContact O-CB 3.28Å; R199-A202 WeakPolarHBondContact O-CB 3.17Å; R199-A202 PolarHBondContact O-N 3.39Å; R199-A202 VanDerWaalsContact O-N 3.08Å; A202-L204 PolarHBondContact O-N 2.76Å; A202-L205 PolarHBondContact O-N 3.23Å; A202-Q206 PolarHBondContact O-N 3.01Å
203	N	65.9	Low	66.2	Low	71 Å²	71	63.6 Å²	63.6	38%	0.38	30%	0.301	S	S	.	.	H	α-helix	trans	-63.7	-31.4	179.9	-68.3	-20.5	0	0	0	111.3	R199 D200 L201 L205 T209	R199-N203 WeakPolarHBondContact O-CB 3.26Å; R199-N203 VanDerWaalsContact O-CG 3.24Å; R199-N203 PolarHBondContact O-N 2.45Å; R199-N203 PolarHBondContact O-ND2 2.96Å; D200-N203 PolarHBondContact O-N 2.98Å; L201-N203 PolarHBondContact O-N 3.31Å; N203-L205 VanDerWaalsContact C-N 3.35Å; N203-T209 PolarHBondContact O-OG1 2.8Å
204	L	65	Low	67	Low	11 Å²	11	62.2 Å²	62.2	6%	0.058	30%	0.295	C	S	.	.	H	α-helix	trans	-72.9	-26.1	173.6	-70.2	167.8	0	0	0	113.1	D200 L201 A202 R211 Y258 M270	D200-L204 WeakPolarHBondContact O-CD1 3.11Å; D200-L204 VanDerWaalsContact O-CG 3.25Å; D200-L204 WeakPolarHBondContact O-CG 3.38Å; D200-L204 PolarHBondContact O-N 3.01Å; D200-L204 VanDerWaalsContact O-N 3.13Å; L201-L204 PolarHBondContact O-N 2.88Å; A202-L204 PolarHBondContact O-N 2.76Å; L204-R211 PolarHBondContact O-NH2 3.27Å; L204-Y258 HydrophobicContact CD2-CD1 4.28Å; L204-Y258 HydrophobicContact CD2-CE1 3.76Å; L204-M270 HydrophobicContact CD1-CE 3.32Å; L204-M270 HydrophobicContact CD1-SD 3.94Å
205	L	62.1	Low	67.9	Low	15 Å²	15	62.2 Å²	62.2	8%	0.079	29%	0.292	C	S	.	.	H	α-helix	trans	-88.9	-21.9	-179.9	-68.7	174.4	0	0	0	113.8	L71 M72 L201 A202 N203 K207 L262 L267	L71-L205 HydrophobicContact CD2-CD1 3.34Å; L71-L205 HydrophobicContact CG-CD1 4.27Å; M72-L205 HydrophobicContact SD-CB 4.32Å; L201-L205 HydrophobicContact CG-CD1 4.27Å; L201-L205 WeakPolarHBondContact O-CG 3.24Å; L201-L205 PolarHBondContact O-N 2.92Å; L201-L205 VanDerWaalsContact O-N 3.11Å; A202-L205 PolarHBondContact O-N 3.23Å; N203-L205 VanDerWaalsContact C-N 3.35Å; L205-K207 PolarHBondContact O-N 3.43Å; L205-L262 HydrophobicContact CD2-CD2 3.63Å; L205-L267 HydrophobicContact CD2-CD1 3.88Å; L205-L267 HydrophobicContact CD2-CD2 4.41Å
206	Q	63.8	Low	68.9	Low	69 Å²	69	62.2 Å²	62.2	32%	0.322	29%	0.293	S	S	.	.			trans	-67.5	119.5	174.3	-73.3	177.7	11.8	0	0	110.2	M72 A202 E208 T209 R211	M72-Q206 HydrophobicContact CE-CG 3.86Å; A202-Q206 PolarHBondContact O-N 3.01Å; Q206-E208 PolarHBondContact O-N 3.02Å; Q206-T209 HydrophobicContact CB-CG2 3.8Å; Q206-T209 PolarHBondContact O-OG1 3.47Å; Q206-R211 PolarHBondContact O-NH2 3.38Å; Q206-R211 VanDerWaalsContact O-NH2 3.13Å
207	K	56.6	Low	69.6	Low	195 Å²	195	64.9 Å²	64.9	85%	0.848	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	-20.1	-178.6	-76.2	-175.2	175.3	-179.5	0	113.7	L205	L205-K207 PolarHBondContact O-N 3.43Å
208	E	59.6	Low	70.2	Confident	191 Å²	191	69 Å²	69	89%	0.893	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.1	0.7	-169.8	-63.7	-179.9	177.1	0	0	113.8	Q206 I210	Q206-E208 PolarHBondContact O-N 3.02Å; E208-I210 PolarHBondContact O-N 2.95Å
209	T	62.4	Low	70.7	Confident	44 Å²	44	75 Å²	75	27%	0.27	35%	0.352	S	S	.	.			trans	-81.1	112.7	178.9	54.9	0	0	0	0	110.7	N203 Q206 R211	N203-T209 PolarHBondContact O-OG1 2.8Å; Q206-T209 HydrophobicContact CB-CG2 3.8Å; Q206-T209 PolarHBondContact O-OG1 3.47Å; T209-R211 PolarHBondContact O-N 3.1Å; T209-R211 PolarHBondContact OG1-NH2 3.17Å
210	I	68.5	Low	71.2	Confident	134 Å²	134	81.4 Å²	81.4	69%	0.687	39%	0.388	S	S	*	.	P	Polyproline II helix	trans	-67	116.4	165.2	-58.9	172.7	0	0	0	107.5	E208 E224	E208-I210 PolarHBondContact O-N 2.95Å; I210-E224 HydrophobicContact CG2-CG 4.27Å
211	R	74.6	Confident	71.8	Confident	40 Å²	40	82.8 Å²	82.8	15%	0.151	39%	0.392	C	S	.	.	P	Polyproline II helix	trans	-95.9	129.3	-178.1	-61.8	173.9	-168.6	120.2	5.2	108.5	L204 Q206 T209 E224 A225 Y258	L204-R211 PolarHBondContact O-NH2 3.27Å; Q206-R211 PolarHBondContact O-NH2 3.38Å; Q206-R211 VanDerWaalsContact O-NH2 3.13Å; T209-R211 PolarHBondContact O-N 3.1Å; T209-R211 PolarHBondContact OG1-NH2 3.17Å; R211-E224 CarbonylContact O-C 3.51Å; R211-E224 WeakPolarHBondContact O-CA 3.45Å; R211-A225 HydrophobicContact CB-CB 4.19Å; R211-A225 PolarHBondContact O-N 3.1Å; R211-Y258 HydrophobicContact CB-CE2 4.3Å; R211-Y258 WeakPolarHBondContact CD-OH 3.45Å; R211-Y258 VanDerWaalsContact NH1-CB 3.27Å
212	K	83.3	Confident	72.3	Confident	87 Å²	87	87.5 Å²	87.5	38%	0.378	42%	0.418	S	S	.	.	B	Isolated β-bridge	trans	-92.7	150.6	179.1	-65	-176.2	179.8	-171.9	0	110.3	D214 M217 N222 N235	K212-D214 PolarHBondContact O-N 3.34Å; K212-M217 HydrophobicContact CB-CG 3.83Å; K212-M217 HydrophobicContact CB-SD 3.47Å; K212-M217 WeakPolarHBondContact CB-SD 3.25Å; K212-M217 HydrophobicContact CD-CG 4.13Å; K212-M217 HydrophobicContact CD-SD 3.67Å; K212-M217 HydrophobicContact CG-SD 4.21Å; K212-N222 WeakPolarHBondContact CE-OD1 3.41Å; K212-N222 PolarHBondContact NZ-OD1 2.76Å; K212-N235 WeakPolarHBondContact O-CB 3.4Å
213	C	86.4	Confident	73.3	Confident	0 Å²	0	89.2 Å²	89.2	0%	0	43%	0.429	C	S	.	.	P	Polyproline II helix	trans	-72.6	122.9	173.2	174.5	0	0	0	0	110	Y215 C216 M217 S223 N235 C237 C240	C213-Y215 VanDerWaalsContact C-N 3.29Å; C213-Y215 PolarHBondContact O-N 3.11Å; C213-C216 HydrophobicContact CB-CB 3.85Å; C213-C216 PolarHBondContact O-N 2.92Å; C213-M217 WeakPolarHBondContact O-CB 3.36Å; C213-M217 WeakPolarHBondContact O-CG 3.37Å; C213-M217 PolarHBondContact O-N 3.48Å; C213-S223 WeakPolarHBondContact CB-O 3.37Å; C213-S223 PolarHBondContact N-O 3.42Å; C213-N235 CarbonylContact C-O 3.55Å; C213-N235 VanDerWaalsContact CA-O 3.31Å; C213-N235 WeakPolarHBondContact CA-O 3.18Å; C213-C237 HydrophobicContact CB-CB 3.81Å; C213-C237 PolarHBondContact SG-N 3.09Å; C213-C237 VanDerWaalsContact SG-N 3.39Å; C213-C240 PolarHBondContact SG-SG 3.41Å
214	D	79.1	Confident	74.3	Confident	52 Å²	52	91.6 Å²	91.6	28%	0.278	44%	0.438	S	S	.	.	H	α-helix	trans	-62.5	-38.2	-174.9	-63.2	-28.6	0	0	0	111.2	K212 F218 D234 N235	K212-D214 PolarHBondContact O-N 3.34Å; D214-F218 WeakPolarHBondContact O-CD2 2.82Å; D214-F218 PolarHBondContact O-N 3.31Å; D214-D234 WeakPolarHBondContact OD2-CA 3.23Å; D214-N235 PolarHBondContact N-O 3.23Å; D214-N235 PolarHBondContact OD1-ND2 3.19Å; D214-N235 PolarHBondContact OD2-N 3.08Å; D214-N235 PolarHBondContact OD2-ND2 2.94Å
215	Y	82.5	Confident	75.4	Confident	124 Å²	124	91.3 Å²	91.3	49%	0.486	44%	0.438	S	S	.	.	H	α-helix	trans	-69.9	-44.3	175.6	-89.1	-85.4	0	0	0	113.3	C213 M217 F218 E219 L236	C213-Y215 VanDerWaalsContact C-N 3.29Å; C213-Y215 PolarHBondContact O-N 3.11Å; Y215-M217 VanDerWaalsContact C-N 3.26Å; Y215-M217 PolarHBondContact O-N 2.87Å; Y215-F218 WeakPolarHBondContact O-CB 3.27Å; Y215-F218 PolarHBondContact O-N 2.82Å; Y215-E219 PolarHBondContact O-N 2.51Å; Y215-L236 HydrophobicContact CD2-CD2 3.71Å; Y215-L236 HydrophobicContact CE2-CD2 4.26Å
216	C	84.8	Confident	76.5	Confident	7 Å²	7	96 Å²	96	5%	0.047	46%	0.459	C	S	.	.	H	α-helix	trans	-65	-35.1	177.1	-72.3	0	0	0	0	111.2	C213 F218 E219 N220 Q221 S223	C213-C216 HydrophobicContact CB-CB 3.85Å; C213-C216 PolarHBondContact O-N 2.92Å; C216-F218 VanDerWaalsContact C-N 3.28Å; C216-F218 PolarHBondContact O-N 2.81Å; C216-E219 CarbonylContact O-C 3.51Å; C216-E219 WeakPolarHBondContact O-CA 3.43Å; C216-E219 PolarHBondContact O-N 2.88Å; C216-N220 PolarHBondContact O-N 3.48Å; C216-Q221 CarbonylContact C-O 3.38Å; C216-Q221 HydrophobicContact CB-CB 3.85Å; C216-Q221 WeakPolarHBondContact CB-O 3.11Å; C216-Q221 WeakPolarHBondContact O-CA 3.25Å; C216-Q221 WeakPolarHBondContact O-CB 3.45Å; C216-Q221 PolarHBondContact O-N 3.04Å; C216-S223 VanDerWaalsContact SG-CB 3.57Å; C216-S223 PolarHBondContact SG-OG 2.98Å; C216-S223 VanDerWaalsContact SG-OG 3.37Å
217	M	79	Confident	77.6	Confident	94 Å²	94	93.4 Å²	93.4	46%	0.463	45%	0.448	S	S	.	.	H	α-helix	trans	-61	-38	175	-81.5	-167.1	57	0	0	112.3	K212 C213 Y215 E219 N220 Q221	K212-M217 HydrophobicContact CB-CG 3.83Å; K212-M217 HydrophobicContact CB-SD 3.47Å; K212-M217 WeakPolarHBondContact CB-SD 3.25Å; K212-M217 HydrophobicContact CD-CG 4.13Å; K212-M217 HydrophobicContact CD-SD 3.67Å; K212-M217 HydrophobicContact CG-SD 4.21Å; C213-M217 WeakPolarHBondContact O-CB 3.36Å; C213-M217 WeakPolarHBondContact O-CG 3.37Å; C213-M217 PolarHBondContact O-N 3.48Å; Y215-M217 VanDerWaalsContact C-N 3.26Å; Y215-M217 PolarHBondContact O-N 2.87Å; M217-E219 PolarHBondContact O-N 3.35Å; M217-N220 PolarHBondContact O-N 3.06Å; M217-N220 VanDerWaalsContact O-N 3.12Å; M217-Q221 PolarHBondContact N-O 3.39Å
218	F	76	Confident	78.8	Confident	191 Å²	191	86.1 Å²	86.1	84%	0.838	42%	0.416	S	S	*	.	H	α-helix	trans	-61.1	-30.2	172.2	-100.3	-82.2	0	0	0	113	D214 Y215 C216	D214-F218 WeakPolarHBondContact O-CD2 2.82Å; D214-F218 PolarHBondContact O-N 3.31Å; Y215-F218 WeakPolarHBondContact O-CB 3.27Å; Y215-F218 PolarHBondContact O-N 2.82Å; C216-F218 VanDerWaalsContact C-N 3.28Å; C216-F218 PolarHBondContact O-N 2.81Å
219	E	77.1	Confident	79.8	Confident	136 Å²	136	77 Å²	77	64%	0.636	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.4	15.6	176.5	-63.1	-169.6	167.6	0	0	113.6	Y215 C216 M217 Q221	Y215-E219 PolarHBondContact O-N 2.51Å; C216-E219 CarbonylContact O-C 3.51Å; C216-E219 WeakPolarHBondContact O-CA 3.43Å; C216-E219 PolarHBondContact O-N 2.88Å; M217-E219 PolarHBondContact O-N 3.35Å; E219-Q221 PolarHBondContact O-N 3.05Å
220	N	73.7	Confident	80.3	Confident	156 Å²	156	75.9 Å²	75.9	83%	0.834	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.2	26.4	-174.8	-69.9	-35.7	0	0	0	114.5	C216 M217	C216-N220 PolarHBondContact O-N 3.48Å; M217-N220 PolarHBondContact O-N 3.06Å; M217-N220 VanDerWaalsContact O-N 3.12Å
221	Q	78.8	Confident	80.2	Confident	95 Å²	95	72.5 Å²	72.5	44%	0.444	35%	0.346	S	S	.	.			trans	-103.2	135.5	173.5	-65.5	176.1	18.3	0	0	110.4	C216 M217 E219 S223	C216-Q221 CarbonylContact C-O 3.38Å; C216-Q221 HydrophobicContact CB-CB 3.85Å; C216-Q221 WeakPolarHBondContact CB-O 3.11Å; C216-Q221 WeakPolarHBondContact O-CA 3.25Å; C216-Q221 WeakPolarHBondContact O-CB 3.45Å; C216-Q221 PolarHBondContact O-N 3.04Å; M217-Q221 PolarHBondContact N-O 3.39Å; E219-Q221 PolarHBondContact O-N 3.05Å; Q221-S223 PolarHBondContact O-N 3.04Å
222	N	76	Confident	80.1	Confident	121 Å²	121	72.9 Å²	72.9	65%	0.647	36%	0.355	S	S	*	.			trans	-97.9	46.3	-178.8	-78.5	-40	0	0	0	112.3	K212	K212-N222 WeakPolarHBondContact CE-OD1 3.41Å; K212-N222 PolarHBondContact NZ-OD1 2.76Å
223	S	84.8	Confident	79.5	Confident	40 Å²	40	69.8 Å²	69.8	28%	0.28	35%	0.347	S	S	.	.	P	Polyproline II helix	trans	-68	134.7	177.3	-57.8	0	0	0	0	110.9	C213 C216 Q221	C213-S223 WeakPolarHBondContact CB-O 3.37Å; C213-S223 PolarHBondContact N-O 3.42Å; C216-S223 VanDerWaalsContact SG-CB 3.57Å; C216-S223 PolarHBondContact SG-OG 2.98Å; C216-S223 VanDerWaalsContact SG-OG 3.37Å; Q221-S223 PolarHBondContact O-N 3.04Å
224	E	87.2	Confident	79.2	Confident	122 Å²	122	71.7 Å²	71.7	57%	0.57	36%	0.357	S	S	*	.	B	Isolated β-bridge	trans	-71.5	131.8	175.7	-170.4	173.3	-169.4	0	0	110.7	I210 R211 C237	I210-E224 HydrophobicContact CG2-CG 4.27Å; R211-E224 CarbonylContact O-C 3.51Å; R211-E224 WeakPolarHBondContact O-CA 3.45Å; E224-C237 WeakPolarHBondContact O-CA 3.29Å; E224-C237 WeakPolarHBondContact O-CB 3.45Å
225	A	86.5	Confident	79.4	Confident	5 Å²	5	70.5 Å²	70.5	4%	0.041	35%	0.351	C	S	.	.	P	Polyproline II helix	trans	-76.7	132.9	174.8	0	0	0	0	0	109.9	R211 N235 L236 Y258	R211-A225 HydrophobicContact CB-CB 4.19Å; R211-A225 PolarHBondContact O-N 3.1Å; A225-N235 HydrophobicContact CB-CB 3.76Å; A225-L236 WeakPolarHBondContact CA-O 3.27Å; A225-Y258 HydrophobicContact CB-CE2 4.13Å; A225-Y258 WeakPolarHBondContact O-CE2 3.47Å
226	Q	85.9	Confident	79.6	Confident	114 Å²	114	64.6 Å²	64.6	53%	0.533	33%	0.328	S	S	.	.			trans	-106.2	-24.6	178.7	-65.9	-175.8	-11	0	0	112.2	L236 Y258	Q226-L236 PolarHBondContact N-O 3.02Å; Q226-Y258 WeakPolarHBondContact O-CD2 3.47Å
227	C	86.4	Confident	79.9	Confident	13 Å²	13	64.5 Å²	64.5	9%	0.088	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	162.9	179.3	67.1	0	0	0	0	111.4	L236 A241 L255 L256	C227-L236 PolarHBondContact N-O 3.49Å; C227-L236 PolarHBondContact O-N 2.9Å; C227-A241 WeakPolarHBondContact SG-CB 3.17Å; C227-L255 HydrophobicContact CB-CB 4.49Å; C227-L256 CarbonylContact C-O 3.32Å; C227-L256 WeakPolarHBondContact CA-O 3.35Å; C227-L256 VanDerWaalsContact CB-O 3.27Å; C227-L256 WeakPolarHBondContact CB-O 3.44Å
228	R	82.7	Confident	80.4	Confident	43 Å²	43	64.2 Å²	64.2	16%	0.162	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	136.3	173.3	-175	177.5	177.5	95.8	-0.8	109.7	G233 D234 N235 L256 Y258 I261	R228-G233 PolarHBondContact NH1-O 2.94Å; R228-G233 VanDerWaalsContact NH1-O 3.11Å; R228-G233 PolarHBondContact NH2-O 2.81Å; R228-D234 WeakPolarHBondContact CA-O 3.21Å; R228-N235 PolarHBondContact NH1-OD1 2.86Å; R228-L256 PolarHBondContact N-O 2.93Å; R228-L256 PolarHBondContact O-N 3.22Å; R228-Y258 HydrophobicContact CB-CE1 4.1Å; R228-I261 HydrophobicContact CB-CD1 3.95Å
229	C	80.9	Confident	81.1	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	125.6	171	168.3	0	0	0	0	110.3	C232 G233 D234 L236 H244 H253 L255	C229-C232 HydrophobicContact CB-CB 4.4Å; C229-C232 WeakPolarHBondContact CB-SG 3.38Å; C229-C232 WeakPolarHBondContact SG-CB 3.16Å; C229-C232 PolarHBondContact SG-N 3.36Å; C229-C232 CovalentContact SG-SG 2.05Å; C229-C232 PolarHBondContact SG-SG 2.95Å; C229-G233 VanDerWaalsContact O-CA 3.22Å; C229-G233 WeakPolarHBondContact O-CA 3.48Å; C229-G233 PolarHBondContact O-N 2.87Å; C229-D234 HydrophobicContact CB-CB 4.38Å; C229-D234 PolarHBondContact N-O 3.36Å; C229-L236 HydrophobicContact CB-CD1 4.44Å; C229-H244 PolarHBondContact SG-NE2 2.91Å; C229-H253 PolarHBondContact SG-ND1 3.31Å; C229-L255 HydrophobicContact CB-CD2 3.58Å
230	I	72.5	Confident	81.8	Confident	19 Å²	19	53.9 Å²	53.9	10%	0.097	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-34.3	-175.4	-58.8	-63.3	0	0	0	112.1	T254 L256 R269 M270	I230-T254 PolarHBondContact N-O 3.48Å; I230-L256 HydrophobicContact CD1-CB 4.37Å; I230-L256 HydrophobicContact CD1-CD1 3.67Å; I230-L256 HydrophobicContact CD1-CG 4.1Å; I230-L256 HydrophobicContact CG1-CD1 3.83Å; I230-L256 HydrophobicContact CG1-CG 3.93Å; I230-R269 HydrophobicContact CG2-CB 4.12Å; I230-R269 WeakPolarHBondContact CG2-O 3.34Å; I230-M270 HydrophobicContact CD1-CG 3.78Å; I230-M270 HydrophobicContact CD1-SD 4.24Å
231	E	67.1	Low	82.6	Confident	64 Å²	64	46.7 Å²	46.7	30%	0.299	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-29.5	-175.4	-61.9	80.1	175.4	0	0	112.6	H253 T254	E231-H253 HydrophobicContact CB-CB 4.4Å; E231-H253 VanDerWaalsContact OE2-CA 3.27Å; E231-H253 WeakPolarHBondContact OE2-CA 3.19Å; E231-H253 WeakPolarHBondContact OE2-CB 3.46Å; E231-H253 IonicContact OE2-CG 3.99Å; E231-T254 VanDerWaalsContact OE1-CB 3.23Å; E231-T254 WeakPolarHBondContact OE1-CB 3.32Å; E231-T254 PolarHBondContact OE1-N 2.92Å; E231-T254 PolarHBondContact OE1-OG1 2.87Å; E231-T254 PolarHBondContact OE2-N 3.43Å
232	C	71	Confident	83	Confident	48 Å²	48	46.2 Å²	46.2	32%	0.324	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-111.6	-19.4	-176.8	62.8	0	0	0	0	114	C229 D234 H244	C229-C232 HydrophobicContact CB-CB 4.4Å; C229-C232 WeakPolarHBondContact CB-SG 3.38Å; C229-C232 WeakPolarHBondContact SG-CB 3.16Å; C229-C232 PolarHBondContact SG-N 3.36Å; C229-C232 CovalentContact SG-SG 2.05Å; C229-C232 PolarHBondContact SG-SG 2.95Å; C232-D234 VanDerWaalsContact C-N 3.25Å; C232-D234 PolarHBondContact O-N 2.82Å; C232-D234 VanDerWaalsContact SG-CG 3.57Å; C232-D234 PolarHBondContact SG-OD2 2.81Å; C232-H244 PolarHBondContact SG-CE1 2.83Å; C232-H244 PolarHBondContact SG-NE2 2.76Å
233	G	70.3	Confident	83.7	Confident	21 Å²	21	42.8 Å²	42.8	22%	0.216	24%	0.237	C	C	.	.			trans	82.4	-5.3	-179.1	0	0	0	0	0	114.9	R228 C229 N235	R228-G233 PolarHBondContact NH1-O 2.94Å; R228-G233 VanDerWaalsContact NH1-O 3.11Å; R228-G233 PolarHBondContact NH2-O 2.81Å; C229-G233 VanDerWaalsContact O-CA 3.22Å; C229-G233 WeakPolarHBondContact O-CA 3.48Å; C229-G233 PolarHBondContact O-N 2.87Å; G233-N235 PolarHBondContact O-N 2.85Å
234	D	80.2	Confident	83.8	Confident	41 Å²	41	41.1 Å²	41.1	22%	0.219	23%	0.225	C	C	.	.			trans	-64.5	130.8	-177.4	-59	-24.9	0	0	0	111.9	D214 R228 C229 C232 L236 H244	D214-D234 WeakPolarHBondContact OD2-CA 3.23Å; R228-D234 WeakPolarHBondContact CA-O 3.21Å; C229-D234 HydrophobicContact CB-CB 4.38Å; C229-D234 PolarHBondContact N-O 3.36Å; C232-D234 VanDerWaalsContact C-N 3.25Å; C232-D234 PolarHBondContact O-N 2.82Å; C232-D234 VanDerWaalsContact SG-CG 3.57Å; C232-D234 PolarHBondContact SG-OD2 2.81Å; D234-L236 HydrophobicContact CB-CD1 4.46Å; D234-L236 HydrophobicContact CB-CD2 3.87Å; D234-L236 HydrophobicContact CB-CG 4.07Å; D234-H244 IonicContact OD2-CE1 3.39Å; D234-H244 PolarHBondContact OD2-CE1 2.94Å
235	N	83.2	Confident	83.7	Confident	26 Å²	26	40.5 Å²	40.5	14%	0.139	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	121.9	167.7	-54.7	-52.6	0	0	0	108.6	K212 C213 D214 A225 R228 G233 Y258	K212-N235 WeakPolarHBondContact O-CB 3.4Å; C213-N235 CarbonylContact C-O 3.55Å; C213-N235 VanDerWaalsContact CA-O 3.31Å; C213-N235 WeakPolarHBondContact CA-O 3.18Å; D214-N235 PolarHBondContact N-O 3.23Å; D214-N235 PolarHBondContact OD1-ND2 3.19Å; D214-N235 PolarHBondContact OD2-N 3.08Å; D214-N235 PolarHBondContact OD2-ND2 2.94Å; A225-N235 HydrophobicContact CB-CB 3.76Å; R228-N235 PolarHBondContact NH1-OD1 2.86Å; G233-N235 PolarHBondContact O-N 2.85Å; N235-Y258 WeakPolarHBondContact CB-OH 3.36Å; N235-Y258 PolarHBondContact OD1-OH 3.23Å
236	L	87.1	Confident	83.7	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	130.6	-169.3	-57	171.2	0	0	0	110.8	Y215 A225 Q226 C227 C229 D234 C240 A241 H244 L255	Y215-L236 HydrophobicContact CD2-CD2 3.71Å; Y215-L236 HydrophobicContact CE2-CD2 4.26Å; A225-L236 WeakPolarHBondContact CA-O 3.27Å; Q226-L236 PolarHBondContact N-O 3.02Å; C227-L236 PolarHBondContact N-O 3.49Å; C227-L236 PolarHBondContact O-N 2.9Å; C229-L236 HydrophobicContact CB-CD1 4.44Å; D234-L236 HydrophobicContact CB-CD1 4.46Å; D234-L236 HydrophobicContact CB-CD2 3.87Å; D234-L236 HydrophobicContact CB-CG 4.07Å; L236-C240 HydrophobicContact CB-CB 4.27Å; L236-C240 HydrophobicContact CD2-CB 3.98Å; L236-A241 HydrophobicContact CB-CB 4.08Å; L236-H244 HydrophobicContact CD1-CB 3.72Å; L236-L255 HydrophobicContact CD1-CD1 4.41Å; L236-L255 HydrophobicContact CD1-CD2 3.75Å
237	C	91.4	Very high	83.3	Confident	6 Å²	6	46.7 Å²	46.7	4%	0.041	24%	0.244	C	C	.	.			trans	-70.6	162.9	161.9	66.5	0	0	0	0	109.5	C213 E224 C240 A241	C213-C237 HydrophobicContact CB-CB 3.81Å; C213-C237 PolarHBondContact SG-N 3.09Å; C213-C237 VanDerWaalsContact SG-N 3.39Å; E224-C237 WeakPolarHBondContact O-CA 3.29Å; E224-C237 WeakPolarHBondContact O-CB 3.45Å; C237-C240 PolarHBondContact O-N 3.2Å; C237-C240 PolarHBondContact SG-SG 3.27Å; C237-A241 WeakPolarHBondContact O-CB 3.28Å; C237-A241 PolarHBondContact O-N 2.95Å
238	E	89.5	Confident	82.8	Confident	87 Å²	87	57.1 Å²	57.1	41%	0.407	28%	0.282	S	S	.	.	H	α-helix	trans	-51.7	-44.9	-176.9	-176.3	59.1	-150.7	0	0	113.9	C240 A241 Q242	E238-C240 PolarHBondContact O-N 2.83Å; E238-A241 WeakPolarHBondContact O-CB 3.38Å; E238-A241 PolarHBondContact O-N 3.11Å; E238-Q242 WeakPolarHBondContact O-CG 3.36Å; E238-Q242 PolarHBondContact O-N 2.96Å; E238-Q242 VanDerWaalsContact O-N 3.13Å; E238-Q242 PolarHBondContact OE1-NE2 2.8Å
239	P	91	Very high	82.4	Confident	89 Å²	89	61.9 Å²	61.9	58%	0.578	31%	0.309	S	S	*	.	H	α-helix	trans	-60	-44.6	173.7	-24.6	33.1	0	0	0	114.1	Q242 A243	P239-Q242 PolarHBondContact O-N 3.23Å; P239-A243 PolarHBondContact O-N 3.23Å
240	C	91.3	Very high	82.3	Confident	21 Å²	21	62.6 Å²	62.6	14%	0.142	31%	0.314	C	S	.	.	H	α-helix	trans	-71.2	-32.8	-179.3	-68	0	0	0	0	111.7	C213 L236 C237 E238 A243 H244	C213-C240 PolarHBondContact SG-SG 3.41Å; L236-C240 HydrophobicContact CB-CB 4.27Å; L236-C240 HydrophobicContact CD2-CB 3.98Å; C237-C240 PolarHBondContact O-N 3.2Å; C237-C240 PolarHBondContact SG-SG 3.27Å; E238-C240 PolarHBondContact O-N 2.83Å; C240-A243 PolarHBondContact O-N 2.64Å; C240-H244 VanDerWaalsContact O-CB 3.26Å; C240-H244 WeakPolarHBondContact O-CB 3.39Å; C240-H244 PolarHBondContact O-N 3.39Å
241	A	89.8	Confident	82.6	Confident	5 Å²	5	69.4 Å²	69.4	4%	0.041	34%	0.338	C	S	.	.	H	α-helix	trans	-61	-44.4	172.8	0	0	0	0	0	111.7	C227 L236 C237 E238 H244 K245 L255	C227-A241 WeakPolarHBondContact SG-CB 3.17Å; L236-A241 HydrophobicContact CB-CB 4.08Å; C237-A241 WeakPolarHBondContact O-CB 3.28Å; C237-A241 PolarHBondContact O-N 2.95Å; E238-A241 WeakPolarHBondContact O-CB 3.38Å; E238-A241 PolarHBondContact O-N 3.11Å; A241-H244 WeakPolarHBondContact O-CB 3.4Å; A241-H244 PolarHBondContact O-N 3.06Å; A241-K245 PolarHBondContact O-N 3.44Å; A241-L255 HydrophobicContact CB-CD1 3.7Å
242	Q	89.2	Confident	83.2	Confident	86 Å²	86	73 Å²	73	40%	0.402	36%	0.359	S	S	.	.	H	α-helix	trans	-66.8	-40.2	175	-67.2	178.2	14.6	0	0	112	E238 P239 R246	E238-Q242 WeakPolarHBondContact O-CG 3.36Å; E238-Q242 PolarHBondContact O-N 2.96Å; E238-Q242 VanDerWaalsContact O-N 3.13Å; E238-Q242 PolarHBondContact OE1-NE2 2.8Å; P239-Q242 PolarHBondContact O-N 3.23Å; Q242-R246 WeakPolarHBondContact O-CD 3.26Å; Q242-R246 VanDerWaalsContact O-CG 3.26Å; Q242-R246 WeakPolarHBondContact O-CG 3.25Å; Q242-R246 PolarHBondContact O-N 3.38Å
243	A	89.3	Confident	83.6	Confident	49 Å²	49	72.6 Å²	72.6	41%	0.405	35%	0.352	S	S	.	.	H	α-helix	trans	-64.6	-40.8	175.4	0	0	0	0	0	111.9	P239 C240 K245 R246 T247	P239-A243 PolarHBondContact O-N 3.23Å; C240-A243 PolarHBondContact O-N 2.64Å; A243-K245 PolarHBondContact O-N 3.02Å; A243-R246 WeakPolarHBondContact O-CA 3.35Å; A243-R246 WeakPolarHBondContact O-CB 2.98Å; A243-R246 PolarHBondContact O-N 3.29Å; A243-T247 PolarHBondContact O-N 3.29Å
244	H	87	Confident	84.1	Confident	5 Å²	5	74.5 Å²	74.5	2%	0.023	36%	0.359	C	S	.	.	H	α-helix	trans	-56.8	-53.3	177.8	-163.2	70.4	0	0	0	110.9	C229 C232 D234 L236 C240 A241 R246 T247 T250 H253	C229-H244 PolarHBondContact SG-NE2 2.91Å; C232-H244 PolarHBondContact SG-CE1 2.83Å; C232-H244 PolarHBondContact SG-NE2 2.76Å; D234-H244 IonicContact OD2-CE1 3.39Å; D234-H244 PolarHBondContact OD2-CE1 2.94Å; L236-H244 HydrophobicContact CD1-CB 3.72Å; C240-H244 VanDerWaalsContact O-CB 3.26Å; C240-H244 WeakPolarHBondContact O-CB 3.39Å; C240-H244 PolarHBondContact O-N 3.39Å; A241-H244 WeakPolarHBondContact O-CB 3.4Å; A241-H244 PolarHBondContact O-N 3.06Å; H244-R246 PolarHBondContact O-N 3.16Å; H244-T247 PolarHBondContact O-N 3.11Å; H244-T247 PolarHBondContact O-OG1 3.02Å; H244-T250 PolarHBondContact ND1-OG1 2.79Å; H244-T250 WeakPolarHBondContact NE2-CB 3.34Å; H244-T250 PolarHBondContact O-OG1 2.77Å; H244-H253 AromaticContact NE2-ND1 3.51Å
245	K	85.8	Confident	84.3	Confident	109 Å²	109	73.9 Å²	73.9	47%	0.474	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-12.4	177.5	-73.5	-176.2	172.3	175.2	0	114.4	A241 A243 R251 L255	A241-K245 PolarHBondContact O-N 3.44Å; A243-K245 PolarHBondContact O-N 3.02Å; K245-R251 WeakPolarHBondContact O-CA 3.21Å; K245-R251 WeakPolarHBondContact O-CB 3.42Å; K245-L255 HydrophobicContact CD-CD1 4.06Å; K245-L255 HydrophobicContact CG-CD1 4Å
246	R	86.5	Confident	84	Confident	191 Å²	191	73.6 Å²	73.6	72%	0.721	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.4	-9.4	177.1	-69.3	169.1	-176.8	165.4	5.8	113.6	Q242 A243 H244	Q242-R246 WeakPolarHBondContact O-CD 3.26Å; Q242-R246 VanDerWaalsContact O-CG 3.26Å; Q242-R246 WeakPolarHBondContact O-CG 3.25Å; Q242-R246 PolarHBondContact O-N 3.38Å; A243-R246 WeakPolarHBondContact O-CA 3.35Å; A243-R246 WeakPolarHBondContact O-CB 2.98Å; A243-R246 PolarHBondContact O-N 3.29Å; H244-R246 PolarHBondContact O-N 3.16Å
247	T	77.6	Confident	83.7	Confident	58 Å²	58	75.3 Å²	75.3	36%	0.356	37%	0.366	S	S	.	.	S	Bend	trans	-83.8	146.3	177.4	86.6	0	0	0	0	111.3	A243 H244 I249 T250 R251	A243-T247 PolarHBondContact O-N 3.29Å; H244-T247 PolarHBondContact O-N 3.11Å; H244-T247 PolarHBondContact O-OG1 3.02Å; T247-I249 PolarHBondContact O-N 3.42Å; T247-I249 VanDerWaalsContact O-N 3.17Å; T247-T250 PolarHBondContact O-N 3.49Å; T247-T250 PolarHBondContact OG1-N 2.7Å; T247-T250 PolarHBondContact OG1-OG1 2.76Å; T247-R251 VanDerWaalsContact O-CB 3.29Å; T247-R251 WeakPolarHBondContact O-CB 3.25Å; T247-R251 PolarHBondContact O-N 3.08Å
248	R	75.7	Confident	83	Confident	232 Å²	232	76.1 Å²	76.1	88%	0.875	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-32.4	-179.7	-174.5	177.2	177.7	178.1	-0.5	112.7
249	I	73.4	Confident	82.1	Confident	143 Å²	143	79.4 Å²	79.4	73%	0.733	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.7	-45.8	-176.2	-56.4	173.3	0	0	0	110	T247	T247-I249 PolarHBondContact O-N 3.42Å; T247-I249 VanDerWaalsContact O-N 3.17Å
250	T	78.9	Confident	81.2	Confident	15 Å²	15	78.4 Å²	78.4	9%	0.092	37%	0.374	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.4	5	-168.8	67.2	0	0	0	0	114.5	H244 T247 L252 H253	H244-T250 PolarHBondContact ND1-OG1 2.79Å; H244-T250 WeakPolarHBondContact NE2-CB 3.34Å; H244-T250 PolarHBondContact O-OG1 2.77Å; T247-T250 PolarHBondContact O-N 3.49Å; T247-T250 PolarHBondContact OG1-N 2.7Å; T247-T250 PolarHBondContact OG1-OG1 2.76Å; T250-L252 PolarHBondContact O-N 3.07Å; T250-L252 VanDerWaalsContact O-N 3.1Å; T250-H253 VanDerWaalsContact CG2-CE1 3.47Å; T250-H253 WeakPolarHBondContact CG2-CE1 3.25Å; T250-H253 VanDerWaalsContact O-CB 3.31Å; T250-H253 WeakPolarHBondContact O-CB 3.15Å; T250-H253 PolarHBondContact O-N 3.32Å
251	R	78.6	Confident	80	Confident	162 Å²	162	77.6 Å²	77.6	61%	0.611	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.3	-26.5	175.8	72	-178.8	-175.2	162.6	2.7	115.2	K245 T247	K245-R251 WeakPolarHBondContact O-CA 3.21Å; K245-R251 WeakPolarHBondContact O-CB 3.42Å; T247-R251 VanDerWaalsContact O-CB 3.29Å; T247-R251 WeakPolarHBondContact O-CB 3.25Å; T247-R251 PolarHBondContact O-N 3.08Å
252	L	79.9	Confident	78.7	Confident	140 Å²	140	80.2 Å²	80.2	73%	0.733	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.8	1.2	179	-63.5	-178.9	0	0	0	112.5	T250	T250-L252 PolarHBondContact O-N 3.07Å; T250-L252 VanDerWaalsContact O-N 3.1Å
253	H	79.8	Confident	77.4	Confident	38 Å²	38	81.5 Å²	81.5	18%	0.176	40%	0.395	C	S	.	.	P	Polyproline II helix	trans	-71.8	136.3	178	-67.9	-166.3	0	0	0	110.3	C229 E231 H244 T250	C229-H253 PolarHBondContact SG-ND1 3.31Å; E231-H253 HydrophobicContact CB-CB 4.4Å; E231-H253 VanDerWaalsContact OE2-CA 3.27Å; E231-H253 WeakPolarHBondContact OE2-CA 3.19Å; E231-H253 WeakPolarHBondContact OE2-CB 3.46Å; E231-H253 IonicContact OE2-CG 3.99Å; H244-H253 AromaticContact NE2-ND1 3.51Å; T250-H253 VanDerWaalsContact CG2-CE1 3.47Å; T250-H253 WeakPolarHBondContact CG2-CE1 3.25Å; T250-H253 VanDerWaalsContact O-CB 3.31Å; T250-H253 WeakPolarHBondContact O-CB 3.15Å; T250-H253 PolarHBondContact O-N 3.32Å
254	T	80.2	Confident	75.7	Confident	61 Å²	61	83.5 Å²	83.5	37%	0.374	40%	0.398	S	S	.	.	P	Polyproline II helix	trans	-80.4	116.5	176.1	-48.2	0	0	0	0	108.8	I230 E231 L256	I230-T254 PolarHBondContact N-O 3.48Å; E231-T254 VanDerWaalsContact OE1-CB 3.23Å; E231-T254 WeakPolarHBondContact OE1-CB 3.32Å; E231-T254 PolarHBondContact OE1-N 2.92Å; E231-T254 PolarHBondContact OE1-OG1 2.87Å; E231-T254 PolarHBondContact OE2-N 3.43Å; T254-L256 HydrophobicContact CG2-CD2 4.14Å; T254-L256 HydrophobicContact CG2-CG 4.3Å
255	L	84.4	Confident	74	Confident	28 Å²	28	85.2 Å²	85.2	15%	0.147	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	123.7	171.3	-59.1	-175.8	0	0	0	108.4	C227 C229 L236 A241 K245	C227-L255 HydrophobicContact CB-CB 4.49Å; C229-L255 HydrophobicContact CB-CD2 3.58Å; L236-L255 HydrophobicContact CD1-CD1 4.41Å; L236-L255 HydrophobicContact CD1-CD2 3.75Å; A241-L255 HydrophobicContact CB-CD1 3.7Å; K245-L255 HydrophobicContact CD-CD1 4.06Å; K245-L255 HydrophobicContact CG-CD1 4Å
256	L	77.8	Confident	72.3	Confident	20 Å²	20	82.6 Å²	82.6	11%	0.105	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	138.6	173.8	-65	-176.4	0	0	0	109.7	C227 R228 I230 T254 D260 I261 F266	C227-L256 CarbonylContact C-O 3.32Å; C227-L256 WeakPolarHBondContact CA-O 3.35Å; C227-L256 VanDerWaalsContact CB-O 3.27Å; C227-L256 WeakPolarHBondContact CB-O 3.44Å; R228-L256 PolarHBondContact N-O 2.93Å; R228-L256 PolarHBondContact O-N 3.22Å; I230-L256 HydrophobicContact CD1-CB 4.37Å; I230-L256 HydrophobicContact CD1-CD1 3.67Å; I230-L256 HydrophobicContact CD1-CG 4.1Å; I230-L256 HydrophobicContact CG1-CD1 3.83Å; I230-L256 HydrophobicContact CG1-CG 3.93Å; T254-L256 HydrophobicContact CG2-CD2 4.14Å; T254-L256 HydrophobicContact CG2-CG 4.3Å; L256-D260 HydrophobicContact CB-CB 4.34Å; L256-D260 HydrophobicContact CD2-CB 4.43Å; L256-I261 HydrophobicContact CB-CD1 4.24Å; L256-I261 HydrophobicContact CB-CG1 3.69Å; L256-I261 HydrophobicContact CD1-CG1 4.15Å; L256-F266 HydrophobicContact CD1-CB 3.63Å; L256-F266 HydrophobicContact CD1-CD1 4.42Å; L256-F266 HydrophobicContact CD1-CD2 3.46Å; L256-F266 VanDerWaalsContact CD1-CD2 3.46Å; L256-F266 HydrophobicContact CD1-CE2 4.21Å; L256-F266 HydrophobicContact CD1-CG 3.6Å; L256-F266 HydrophobicContact CD2-CD2 4.49Å
257	S	81.3	Confident	70.7	Confident	36 Å²	36	76 Å²	76	25%	0.252	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	156.3	167	74.7	0	0	0	0	109.5	E259 D260 I261	S257-E259 PolarHBondContact O-N 2.84Å; S257-D260 WeakPolarHBondContact CB-OD2 3.3Å; S257-D260 PolarHBondContact N-OD2 2.62Å; S257-D260 PolarHBondContact O-N 3.09Å; S257-D260 VanDerWaalsContact O-N 3.11Å; S257-D260 WeakPolarHBondContact OG-CB 3.1Å; S257-D260 PolarHBondContact OG-N 3.41Å; S257-D260 PolarHBondContact OG-OD2 2.77Å; S257-I261 WeakPolarHBondContact O-CG1 3.42Å; S257-I261 PolarHBondContact O-N 3.04Å
258	Y	75.1	Confident	69.1	Low	23 Å²	23	77 Å²	77	9%	0.09	39%	0.388	C	S	.	.	H	α-helix	trans	-63.5	-28.1	176.5	-68.6	-72.2	0	0	0	113.1	L204 R211 A225 Q226 R228 N235 I261 L262	L204-Y258 HydrophobicContact CD2-CD1 4.28Å; L204-Y258 HydrophobicContact CD2-CE1 3.76Å; R211-Y258 HydrophobicContact CB-CE2 4.3Å; R211-Y258 WeakPolarHBondContact CD-OH 3.45Å; R211-Y258 VanDerWaalsContact NH1-CB 3.27Å; A225-Y258 HydrophobicContact CB-CE2 4.13Å; A225-Y258 WeakPolarHBondContact O-CE2 3.47Å; Q226-Y258 WeakPolarHBondContact O-CD2 3.47Å; R228-Y258 HydrophobicContact CB-CE1 4.1Å; N235-Y258 WeakPolarHBondContact CB-OH 3.36Å; N235-Y258 PolarHBondContact OD1-OH 3.23Å; Y258-I261 HydrophobicContact CD1-CD1 4.17Å; Y258-L262 WeakPolarHBondContact O-CG 3.48Å; Y258-L262 PolarHBondContact O-N 2.89Å
259	E	71.3	Confident	67.6	Low	156 Å²	156	73.9 Å²	73.9	73%	0.729	38%	0.376	S	S	*	.	H	α-helix	trans	-65.9	-44.7	171.6	-66.5	-178.6	172.4	0	0	110.9	S257 I261 L262 V263	S257-E259 PolarHBondContact O-N 2.84Å; E259-I261 VanDerWaalsContact C-N 3.33Å; E259-I261 PolarHBondContact O-N 3.04Å; E259-L262 PolarHBondContact O-N 2.8Å; E259-V263 VanDerWaalsContact O-CG2 3.31Å; E259-V263 WeakPolarHBondContact O-CG2 3.42Å; E259-V263 PolarHBondContact O-N 2.87Å
260	D	71.4	Confident	66.5	Low	69 Å²	69	69.1 Å²	69.1	37%	0.369	35%	0.351	S	S	.	.	H	α-helix	trans	-64.7	-35.3	179	-65.8	-44.7	0	0	0	113	L256 S257 L262 V263 N264	L256-D260 HydrophobicContact CB-CB 4.34Å; L256-D260 HydrophobicContact CD2-CB 4.43Å; S257-D260 WeakPolarHBondContact CB-OD2 3.3Å; S257-D260 PolarHBondContact N-OD2 2.62Å; S257-D260 PolarHBondContact O-N 3.09Å; S257-D260 VanDerWaalsContact O-N 3.11Å; S257-D260 WeakPolarHBondContact OG-CB 3.1Å; S257-D260 PolarHBondContact OG-N 3.41Å; S257-D260 PolarHBondContact OG-OD2 2.77Å; D260-L262 VanDerWaalsContact C-N 3.3Å; D260-L262 PolarHBondContact O-N 3.32Å; D260-V263 PolarHBondContact O-N 3.26Å; D260-N264 WeakPolarHBondContact O-CB 3.17Å; D260-N264 PolarHBondContact O-N 2.85Å; D260-N264 VanDerWaalsContact O-N 3.11Å; D260-N264 PolarHBondContact O-ND2 2.82Å
261	I	67.4	Low	64.8	Low	3 Å²	3	73.5 Å²	73.5	2%	0.015	37%	0.366	C	S	.	.	H	α-helix	trans	-62.1	-40.8	177	-68.3	170.1	0	0	0	110.5	R228 L256 S257 Y258 E259 L267	R228-I261 HydrophobicContact CB-CD1 3.95Å; L256-I261 HydrophobicContact CB-CD1 4.24Å; L256-I261 HydrophobicContact CB-CG1 3.69Å; L256-I261 HydrophobicContact CD1-CG1 4.15Å; S257-I261 WeakPolarHBondContact O-CG1 3.42Å; S257-I261 PolarHBondContact O-N 3.04Å; Y258-I261 HydrophobicContact CD1-CD1 4.17Å; E259-I261 VanDerWaalsContact C-N 3.33Å; E259-I261 PolarHBondContact O-N 3.04Å; I261-L267 HydrophobicContact CG2-CD2 3.57Å; I261-L267 HydrophobicContact CG2-CG 4.48Å
262	L	62.9	Low	63.1	Low	60 Å²	60	71.2 Å²	71.2	31%	0.314	36%	0.362	S	S	.	.	H	α-helix	trans	-74.6	-38.6	-179.4	-68.7	171.5	0	0	0	112.3	L205 Y258 E259 D260	L205-L262 HydrophobicContact CD2-CD2 3.63Å; Y258-L262 WeakPolarHBondContact O-CG 3.48Å; Y258-L262 PolarHBondContact O-N 2.89Å; E259-L262 PolarHBondContact O-N 2.8Å; D260-L262 VanDerWaalsContact C-N 3.3Å; D260-L262 PolarHBondContact O-N 3.32Å
263	V	61.7	Low	61.1	Low	114 Å²	114	67.1 Å²	67.1	69%	0.691	35%	0.349	S	S	*	.	H	α-helix	trans	-77.4	-40.3	-174.1	173	0	0	0	0	112.6	E259 D260	E259-V263 VanDerWaalsContact O-CG2 3.31Å; E259-V263 WeakPolarHBondContact O-CG2 3.42Å; E259-V263 PolarHBondContact O-N 2.87Å; D260-V263 PolarHBondContact O-N 3.26Å
264	N	53.6	Low	59.1	Low	90 Å²	90	70.6 Å²	70.6	48%	0.481	37%	0.374	S	S	.	.	S	Bend	trans	-100.1	9.7	-166.7	-69.5	-48.7	0	0	0	114.8	D260 F266	D260-N264 WeakPolarHBondContact O-CB 3.17Å; D260-N264 PolarHBondContact O-N 2.85Å; D260-N264 VanDerWaalsContact O-N 3.11Å; D260-N264 PolarHBondContact O-ND2 2.82Å; N264-F266 HydrophobicContact CB-CD2 3.26Å; N264-F266 HydrophobicContact CB-CE2 3.22Å; N264-F266 HydrophobicContact CB-CG 4.27Å; N264-F266 HydrophobicContact CB-CZ 4.21Å; N264-F266 PolarHBondContact O-N 3.14Å; N264-F266 VanDerWaalsContact O-N 3.08Å
265	G	50.8	Low	57.3	Low	42 Å²	42	72 Å²	72	43%	0.433	39%	0.385	S	S	.	.			trans	63.4	17.2	178.8	0	0	0	0	0	114.2	L267 L268	G265-L267 PolarHBondContact O-N 3.04Å; G265-L268 PolarHBondContact O-N 3.32Å
266	F	50.9	Low	55.4	Low	54 Å²	54	75.1 Å²	75.1	24%	0.237	41%	0.405	C	S	.	.	G	3₁₀ helix	trans	-67.3	-0.4	179.1	-74.2	-62.3	0	0	0	113.8	L256 N264 L268 R269 M270	L256-F266 HydrophobicContact CD1-CB 3.63Å; L256-F266 HydrophobicContact CD1-CD1 4.42Å; L256-F266 HydrophobicContact CD1-CD2 3.46Å; L256-F266 VanDerWaalsContact CD1-CD2 3.46Å; L256-F266 HydrophobicContact CD1-CE2 4.21Å; L256-F266 HydrophobicContact CD1-CG 3.6Å; L256-F266 HydrophobicContact CD2-CD2 4.49Å; N264-F266 HydrophobicContact CB-CD2 3.26Å; N264-F266 HydrophobicContact CB-CE2 3.22Å; N264-F266 HydrophobicContact CB-CG 4.27Å; N264-F266 HydrophobicContact CB-CZ 4.21Å; N264-F266 PolarHBondContact O-N 3.14Å; N264-F266 VanDerWaalsContact O-N 3.08Å; F266-L268 PolarHBondContact O-N 3Å; F266-L268 VanDerWaalsContact O-N 3.1Å; F266-R269 HydrophobicContact CD1-CB 4.28Å; F266-R269 HydrophobicContact CD1-CG 4.17Å; F266-R269 WeakPolarHBondContact O-CA 3.47Å; F266-R269 PolarHBondContact O-N 2.86Å; F266-M270 PolarHBondContact O-N 2.96Å
267	L	51.6	Low	53.8	Low	51 Å²	51	80.3 Å²	80.3	27%	0.267	43%	0.429	S	S	.	.	G	3₁₀ helix	trans	-50.2	-32.1	166.9	-59	175.7	0	0	0	111.8	L201 L205 I261 G265 M270	L201-L267 HydrophobicContact CD1-CB 4.26Å; L201-L267 HydrophobicContact CD1-CD1 4.46Å; L201-L267 HydrophobicContact CD1-CD2 3.75Å; L201-L267 HydrophobicContact CD1-CG 4.36Å; L205-L267 HydrophobicContact CD2-CD1 3.88Å; L205-L267 HydrophobicContact CD2-CD2 4.41Å; I261-L267 HydrophobicContact CG2-CD2 3.57Å; I261-L267 HydrophobicContact CG2-CG 4.48Å; G265-L267 PolarHBondContact O-N 3.04Å; L267-M270 HydrophobicContact CD2-CE 3.86Å
268	L	43.9	Very low	52	Low	79 Å²	79	79.7 Å²	79.7	41%	0.414	42%	0.424	S	S	.	.	G	3₁₀ helix	trans	-74.9	-21.5	175.3	-69.8	168.5	0	0	0	114	G265 F266 R271	G265-L268 PolarHBondContact O-N 3.32Å; F266-L268 PolarHBondContact O-N 3Å; F266-L268 VanDerWaalsContact O-N 3.1Å; L268-R271 WeakPolarHBondContact O-CB 3.32Å; L268-R271 WeakPolarHBondContact O-CD 3.41Å; L268-R271 VanDerWaalsContact O-CG 3.23Å; L268-R271 WeakPolarHBondContact O-CG 3.41Å
269	R	45.2	Very low	50.6	Low	168 Å²	168	84.8 Å²	84.8	63%	0.634	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.9	-15.1	175.4	-83.5	-162.3	-170.8	178.6	2.2	114	I230 F266 R271	I230-R269 HydrophobicContact CG2-CB 4.12Å; I230-R269 WeakPolarHBondContact CG2-O 3.34Å; F266-R269 HydrophobicContact CD1-CB 4.28Å; F266-R269 HydrophobicContact CD1-CG 4.17Å; F266-R269 WeakPolarHBondContact O-CA 3.47Å; F266-R269 PolarHBondContact O-N 2.86Å; R269-R271 PolarHBondContact O-N 2.91Å
270	M	49.5	Very low	49.1	Very low	42 Å²	42	82.4 Å²	82.4	21%	0.207	45%	0.45	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	18.8	171.3	-61.4	-155.5	-60.4	0	0	113.4	L201 L204 I230 F266 L267	L201-M270 HydrophobicContact CD1-CE 4.2Å; L204-M270 HydrophobicContact CD1-CE 3.32Å; L204-M270 HydrophobicContact CD1-SD 3.94Å; I230-M270 HydrophobicContact CD1-CG 3.78Å; I230-M270 HydrophobicContact CD1-SD 4.24Å; F266-M270 PolarHBondContact O-N 2.96Å; L267-M270 HydrophobicContact CD2-CE 3.86Å
271	R	42.6	Very low	47.8	Very low	107 Å²	107	82.4 Å²	82.4	40%	0.404	45%	0.448	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.1	-8.8	-167.1	-95.2	-171.8	174.5	176.2	-9.5	115.4	E5 L268 R269 A273	E5-R271 IonicContact OE1-CZ 3.18Å; E5-R271 IonicContact OE1-NH1 3.88Å; E5-R271 PolarHBondContact OE1-NH1 2.96Å; E5-R271 IonicContact OE1-NH2 2.68Å; L268-R271 WeakPolarHBondContact O-CB 3.32Å; L268-R271 WeakPolarHBondContact O-CD 3.41Å; L268-R271 VanDerWaalsContact O-CG 3.23Å; L268-R271 WeakPolarHBondContact O-CG 3.41Å; R269-R271 PolarHBondContact O-N 2.91Å; R271-A273 PolarHBondContact O-N 2.88Å
272	E	43.1	Very low	46.6	Very low	114 Å²	114	90.7 Å²	90.7	53%	0.533	49%	0.487	S	S	.	.			trans	-84	63.8	170.9	-65.6	-170.3	176.8	0	0	109	K319	E272-K319 IonicContact OE1-NZ 2.66Å; E272-K319 PolarHBondContact OE1-NZ 3.28Å
273	A	39.5	Very low	45.3	Very low	55 Å²	55	94 Å²	94	46%	0.455	50%	0.499	S	S	.	.	P	Polyproline II helix	trans	-55.1	130.3	158.3	0	0	0	0	0	106.4	R271	R271-A273 PolarHBondContact O-N 2.88Å
274	P	37.3	Very low	43.7	Very low	110 Å²	110	93.4 Å²	93.4	71%	0.714	50%	0.5	S	S	*	.	P	Polyproline II helix	trans	-53.3	137.9	174.7	19.9	-29.3	0	0	0	108	T276	P274-T276 PolarHBondContact O-N 2.79Å
275	P	42.7	Very low	42.4	Very low	92 Å²	92	97.3 Å²	97.3	60%	0.597	52%	0.515	S	S	*	.	P	Polyproline II helix	trans	-50.9	133.9	-178.8	19.7	-31	0	0	0	109	Q277	P275-Q277 PolarHBondContact O-N 3.02Å; P275-Q277 VanDerWaalsContact O-N 3.16Å
276	T	43.8	Very low	41.3	Very low	92 Å²	92	102 Å²	102	56%	0.564	53%	0.529	S	S	*	.	P	Polyproline II helix	trans	-48.4	125.3	175.4	42.7	0	0	0	0	109	I193 P274 P333	I193-T276 HydrophobicContact CD1-CG2 3.82Å; P274-T276 PolarHBondContact O-N 2.79Å; T276-P333 WeakPolarHBondContact O-CG 3.31Å
277	Q	44.8	Very low	40.2	Very low	129 Å²	129	105.1 Å²	105.1	60%	0.603	55%	0.548	S	S	*	.	P	Polyproline II helix	trans	-63.3	148.2	-178.4	-63.6	-179.5	3.4	0	0	109.7	P275 T279 F283	P275-Q277 PolarHBondContact O-N 3.02Å; P275-Q277 VanDerWaalsContact O-N 3.16Å; Q277-T279 PolarHBondContact O-N 3.24Å; Q277-F283 HydrophobicContact CG-CD2 4.25Å; Q277-F283 HydrophobicContact CG-CE2 4.48Å
278	C	42.8	Very low	38.9	Very low	23 Å²	23	109.1 Å²	109.1	16%	0.155	58%	0.575	C	S	.	*	P	Polyproline II helix	trans	-65.7	128.8	173.8	179.3	0	0	0	0	108.6	D280 H281 P333	C278-D280 PolarHBondContact O-N 3.4Å; C278-D280 VanDerWaalsContact O-N 3.09Å; C278-H281 PolarHBondContact O-N 2.76Å; C278-H281 VanDerWaalsContact O-N 3.16Å; C278-H281 PolarHBondContact SG-ND1 3Å; C278-P333 HydrophobicContact CB-CG 4.41Å
279	T	45.2	Very low	38.2	Very low	130 Å²	130	110.7 Å²	110.7	80%	0.798	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.1	-18.3	-179.8	47.3	0	0	0	0	113.6	Q277	Q277-T279 PolarHBondContact O-N 3.24Å
280	D	41.5	Very low	37.3	Very low	107 Å²	107	106.2 Å²	106.2	57%	0.572	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.4	-10.8	-177.4	-56.5	-27.6	0	0	0	112.9	C278	C278-D280 PolarHBondContact O-N 3.4Å; C278-D280 VanDerWaalsContact O-N 3.09Å
281	H	44.1	Very low	36.2	Very low	68 Å²	68	109.7 Å²	109.7	32%	0.315	61%	0.606	S	S	.	*			trans	-145.2	116	-174.3	-35.9	88.4	0	0	0	112.6	C278 C342	C278-H281 PolarHBondContact O-N 2.76Å; C278-H281 VanDerWaalsContact O-N 3.16Å; C278-H281 PolarHBondContact SG-ND1 3Å; H281-C342 PolarHBondContact CE1-SG 3.05Å; H281-C342 PolarHBondContact NE2-SG 2.91Å
282	E	40.3	Very low	35.7	Very low	178 Å²	178	110.9 Å²	110.9	83%	0.832	62%	0.62	S	S	*	*			trans	-72	131.6	163.3	-70.2	-176.3	154.2	0	0	109.8	S284	E282-S284 PolarHBondContact O-N 3Å
283	F	35.8	Very low	35.1	Very low	129 Å²	129	112.2 Å²	112.2	57%	0.566	63%	0.626	S	S	*	*			trans	-63.3	94	178.8	-98	-100.6	0	0	0	111.3	Q277 L286	Q277-F283 HydrophobicContact CG-CD2 4.25Å; Q277-F283 HydrophobicContact CG-CE2 4.48Å; F283-L286 HydrophobicContact CD1-CD1 4.21Å; F283-L286 HydrophobicContact CE1-CD1 3.6Å; F283-L286 HydrophobicContact CZ-CD1 4.38Å
284	S	28.2	Very low	34.7	Very low	102 Å²	102	116.4 Å²	116.4	71%	0.713	64%	0.64	S	S	*	*			trans	-122.8	121	158.7	53.1	0	0	0	0	109	E282	E282-S284 PolarHBondContact O-N 3Å
285	E	26.7	Very low	34.4	Very low	172 Å²	172	118.5 Å²	118.5	80%	0.804	64%	0.643	S	S	*	*			trans	75.9	62.9	169	-51.1	-173.5	175.8	0	0	119.3	N287	E285-N287 VanDerWaalsContact C-N 3.3Å; E285-N287 PolarHBondContact O-N 3.07Å
286	L	28.6	Very low	33.9	Very low	139 Å²	139	118.9 Å²	118.9	73%	0.728	65%	0.648	S	S	*	*			trans	-88.8	73.4	151.5	-91.3	157.9	0	0	0	110	F283 T288	F283-L286 HydrophobicContact CD1-CD1 4.21Å; F283-L286 HydrophobicContact CE1-CD1 3.6Å; F283-L286 HydrophobicContact CZ-CD1 4.38Å; L286-T288 PolarHBondContact O-N 2.76Å
287	N	26.9	Very low	33.2	Very low	120 Å²	120	121.6 Å²	121.6	64%	0.642	66%	0.659	S	S	*	*			trans	-72.7	116.5	162.5	-84.6	-34.6	0	0	0	109.3	E285 I289	E285-N287 VanDerWaalsContact C-N 3.3Å; E285-N287 PolarHBondContact O-N 3.07Å; N287-I289 PolarHBondContact O-N 3.29Å
288	T	25.2	Very low	32.6	Very low	135 Å²	135	123 Å²	123	83%	0.828	67%	0.671	S	S	*	*			trans	16.7	92.9	148.5	53.9	0	0	0	0	116.6	L286	L286-T288 PolarHBondContact O-N 2.76Å
289	I	27.7	Very low	32	Very low	113 Å²	113	130.6 Å²	130.6	58%	0.579	70%	0.704	S	S	*	*			trans	-95.5	111.2	158.7	-61.1	178	0	0	0	107.5	N287	N287-I289 PolarHBondContact O-N 3.29Å
290	S	26.5	Very low	31.2	Very low	73 Å²	73	131.8 Å²	131.8	51%	0.51	71%	0.706	S	S	.	*			trans	-65	148.1	175.9	74.4	0	0	0	0	111.4	N292	S290-N292 PolarHBondContact O-N 2.87Å
291	S	27.5	Very low	30.6	Very low	116 Å²	116	133.8 Å²	133.8	81%	0.811	72%	0.721	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.1	5.5	-170.9	-19.5	0	0	0	0	117
292	N	30.7	Very low	29.7	Very low	131 Å²	131	134.6 Å²	134.6	70%	0.701	74%	0.739	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.9	-1.7	-165.1	-74	-12.8	0	0	0	115.8	S290	S290-N292 PolarHBondContact O-N 2.87Å
293	E	31.1	Very low	29	Very low	142 Å²	142	132.8 Å²	132.8	66%	0.664	74%	0.735	S	S	*	*	S	Bend	trans	-107.9	5.8	-173.6	-70	-171.5	161.3	0	0	115.8	I295	E293-I295 VanDerWaalsContact C-N 3.33Å
294	I	31.8	Very low	28.6	Very low	143 Å²	143	133.4 Å²	133.4	73%	0.733	75%	0.745	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.6	1.4	-179.6	-60.4	175.7	0	0	0	112.4
295	I	31.3	Very low	28.5	Very low	155 Å²	155	134.2 Å²	134.2	80%	0.795	75%	0.745	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87	-4.8	-170.3	-62.8	176	0	0	0	114.2	E293	E293-I295 VanDerWaalsContact C-N 3.33Å
296	S	30.9	Very low	28.4	Very low	99 Å²	99	132.2 Å²	132.2	69%	0.692	75%	0.745	S	S	*	*	S	Bend	trans	-114.2	4.7	-168.3	61.4	0	0	0	0	118.7
297	N	30.4	Very low	28.3	Very low	150 Å²	150	137.2 Å²	137.2	80%	0.802	75%	0.754	S	S	*	*			trans	-116.8	9.9	-175.8	-81.7	-3.6	0	0	0	116.6	Q299	N297-Q299 PolarHBondContact O-N 3.48Å
298	N	31	Very low	28.2	Very low	158 Å²	158	139.5 Å²	139.5	85%	0.845	77%	0.766	S	S	*	*			trans	-97.8	62.7	178.5	-79.6	-17.4	0	0	0	113.3
299	Q	30.1	Very low	28.2	Very low	182 Å²	182	136.8 Å²	136.8	85%	0.85	77%	0.765	S	S	*	*			trans	-125	-1.3	175.3	-86.7	-167.9	-19.1	0	0	117.1	N297	N297-Q299 PolarHBondContact O-N 3.48Å
300	N	28.2	Very low	28	Very low	156 Å²	156	136.6 Å²	136.6	83%	0.834	77%	0.774	S	S	*	*	S	Bend	trans	-142.8	65.4	-175.9	-72.5	-36.2	0	0	0	114.5
301	V	30.1	Very low	27.9	Very low	149 Å²	149	139.2 Å²	139.2	90%	0.903	79%	0.787	S	S	*	*			trans	-155.1	84.5	147	-169.9	0	0	0	0	107.9
302	A	25.1	Very low	27.8	Very low	84 Å²	84	141 Å²	141	69%	0.694	79%	0.785	S	S	*	*			trans	-88.1	155.5	161.1	0	0	0	0	0	108.8
303	D	25	Very low	27.6	Very low	140 Å²	140	140.5 Å²	140.5	75%	0.749	79%	0.787	S	S	*	*			trans	83.7	83.5	170.8	-54	-22.1	0	0	0	117
304	N	27.2	Very low	27.3	Very low	143 Å²	143	141.2 Å²	141.2	77%	0.765	80%	0.796	S	S	*	*				178.4	117.2	101.3	-87.4	-41	0	0	0	113.7
305	T	27	Very low	27.1	Very low	118 Å²	118	142.1 Å²	142.1	72%	0.724	80%	0.796	S	S	*	*			trans	56.9	87.1	138.4	54.5	0	0	0	0	119.2
306	V	25.3	Very low	26.8	Very low	131 Å²	131	143.2 Å²	143.2	79%	0.794	80%	0.798	S	S	*	*				67.2	104.4	87.7	-178.9	0	0	0	0	115.4
307	R	24.7	Very low	26.6	Very low	244 Å²	244	146.3 Å²	146.3	92%	0.921	81%	0.806	S	S	*	*				-166.1	117.4	115.7	-107.4	178.1	-175.6	-178.4	1.7	111.9
308	N	24.6	Very low	26.4	Very low	167 Å²	167	147.4 Å²	147.4	89%	0.893	81%	0.813	S	S	*	*			trans	-71.2	150.1	-179.4	-72.4	-31.4	0	0	0	113.5
309	G	25.5	Very low	26.4	Very low	78 Å²	78	147.1 Å²	147.1	80%	0.804	80%	0.804	S	S	*	*			trans	-167	69.4	166.1	0	0	0	0	0	109.5
310	S	24.2	Very low	26.4	Very low	109 Å²	109	143.7 Å²	143.7	76%	0.762	80%	0.8	S	S	*	*			trans	-46.4	135.7	180	44	0	0	0	0	116.6
311	T	25.1	Very low	26.6	Very low	128 Å²	128	142.5 Å²	142.5	79%	0.785	79%	0.787	S	S	*	*				-166.3	109.3	129.5	23	0	0	0	0	111.8
312	I	25.4	Very low	27	Very low	153 Å²	153	136.7 Å²	136.7	79%	0.785	75%	0.752	S	S	*	*			trans	47.1	106.2	135	-50.6	172.4	0	0	0	117.2
313	V	26.6	Very low	27.6	Very low	121 Å²	121	134.1 Å²	134.1	73%	0.733	73%	0.726	S	S	*	*			trans	-84.6	111.7	168.6	179.6	0	0	0	0	108.6	H315	V313-H315 PolarHBondContact O-N 3.33Å
314	D	24.7	Very low	28.2	Very low	158 Å²	158	128.7 Å²	128.7	85%	0.845	70%	0.697	S	S	*	*			trans	-72.5	114.6	168.5	-109.7	-25.6	0	0	0	110	H316	D314-H316 PolarHBondContact O-N 3.33Å
315	H	26.2	Very low	28.6	Very low	161 Å²	161	122.1 Å²	122.1	75%	0.745	66%	0.664	S	S	*	*			trans	-83	67.6	178.4	-85.1	-35.2	0	0	0	111.7	V313	V313-H315 PolarHBondContact O-N 3.33Å
316	H	26.3	Very low	29.2	Very low	179 Å²	179	122.1 Å²	122.1	83%	0.829	66%	0.655	S	S	*	*			trans	-164.2	86.7	163.3	-87	-58.9	0	0	0	111.8	D314	D314-H316 PolarHBondContact O-N 3.33Å
317	N	26.6	Very low	29.8	Very low	163 Å²	163	124.2 Å²	124.2	87%	0.872	65%	0.649	S	S	*	*			trans	170.9	115.2	138.3	-93.8	-28.2	0	0	0	111.4	K319	N317-K319 PolarHBondContact O-N 2.86Å; N317-K319 VanDerWaalsContact O-N 3.07Å
318	N	26.4	Very low	30.7	Very low	174 Å²	174	114.4 Å²	114.4	93%	0.93	62%	0.617	S	S	*	*			trans	-62.7	99	170.7	-82.1	-24.9	0	0	0	110.9
319	K	29.4	Very low	31.6	Very low	151 Å²	151	113.8 Å²	113.8	66%	0.657	61%	0.614	S	S	*	*			trans	-142.9	128.5	155.4	-75.7	-163.3	176.7	-166	0	109.4	E272 N317 K321	E272-K319 IonicContact OE1-NZ 2.66Å; E272-K319 PolarHBondContact OE1-NZ 3.28Å; N317-K319 PolarHBondContact O-N 2.86Å; N317-K319 VanDerWaalsContact O-N 3.07Å; K319-K321 PolarHBondContact O-N 2.75Å
320	S	30.6	Very low	32.5	Very low	111 Å²	111	117.5 Å²	117.5	78%	0.776	60%	0.604	S	S	*	*			trans	-53.3	102.2	-175.8	-42.9	0	0	0	0	112.5	T322	S320-T322 PolarHBondContact O-N 2.9Å
321	K	32.8	Very low	33.4	Very low	130 Å²	130	116.1 Å²	116.1	57%	0.565	59%	0.592	S	S	*	*			trans	-84.9	110.7	178.6	-74.3	-162.5	174.5	-146.3	0	111.6	K319 S334 E358	K319-K321 PolarHBondContact O-N 2.75Å; K321-S334 VanDerWaalsContact O-CB 3.3Å; K321-S334 WeakPolarHBondContact O-CB 3.5Å; K321-E358 WeakPolarHBondContact CE-OE1 3.34Å; K321-E358 IonicContact NZ-OE1 3.38Å; K321-E358 PolarHBondContact NZ-OE1 3.02Å; K321-E358 IonicContact NZ-OE2 3.44Å; K321-E358 PolarHBondContact NZ-OE2 3.09Å
322	T	39.1	Very low	34	Very low	27 Å²	27	111.1 Å²	111.1	17%	0.166	56%	0.562	C	S	.	*			trans	-66.6	148.8	172.1	-46.5	0	0	0	0	112.1	S320 S332 S334 L357	S320-T322 PolarHBondContact O-N 2.9Å; T322-S332 WeakPolarHBondContact CG2-O 3.05Å; T322-S334 WeakPolarHBondContact CA-OG 3.41Å; T322-S334 WeakPolarHBondContact CB-OG 3.19Å; T322-S334 PolarHBondContact N-OG 2.82Å; T322-S334 PolarHBondContact OG1-OG 2.93Å; T322-L357 VanDerWaalsContact CB-CD2 3.46Å; T322-L357 HydrophobicContact CG2-CB 4.09Å; T322-L357 HydrophobicContact CG2-CD1 4.25Å; T322-L357 HydrophobicContact CG2-CD2 3.86Å; T322-L357 HydrophobicContact CG2-CG 4.27Å; T322-L357 WeakPolarHBondContact O-CB 3.43Å; T322-L357 PolarHBondContact O-N 2.95Å
323	I	37	Very low	34.6	Very low	30 Å²	30	104.9 Å²	104.9	15%	0.154	53%	0.532	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	134.2	-168.5	-61.5	-174.5	0	0	0	109.3	S332 Y338 V354 L355	I323-S332 VanDerWaalsContact O-O 3.11Å; I323-Y338 HydrophobicContact CD1-CE2 4.12Å; I323-V354 HydrophobicContact CB-CG1 4.36Å; I323-V354 HydrophobicContact CG2-CB 4.29Å; I323-V354 HydrophobicContact CG2-CG1 2.9Å; I323-L355 CarbonylContact C-O 3.59Å; I323-L355 WeakPolarHBondContact CA-O 3.39Å; I323-L355 WeakPolarHBondContact CG2-O 3.49Å
324	I	36.7	Very low	35	Very low	26 Å²	26	100 Å²	100	13%	0.133	50%	0.503	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	133.2	-177.4	-60.2	-168.5	0	0	0	110.7	P331 L355 L357 A360	I324-P331 HydrophobicContact CD1-CB 3.98Å; I324-P331 HydrophobicContact CG1-CB 4.38Å; I324-L355 PolarHBondContact N-O 2.97Å; I324-L355 PolarHBondContact O-N 3.02Å; I324-L357 HydrophobicContact CD1-CD1 3.62Å; I324-L357 HydrophobicContact CG1-CD1 4.13Å; I324-A360 HydrophobicContact CB-CB 4.13Å; I324-A360 HydrophobicContact CD1-CB 3.69Å; I324-A360 HydrophobicContact CG1-CB 4.19Å
325	G	37.5	Very low	35.4	Very low	6 Å²	6	94.7 Å²	94.7	6%	0.062	48%	0.481	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	117.5	172.8	0	0	0	0	0	112	R327 C328 N329 V353	G325-R327 PolarHBondContact O-N 3.01Å; G325-R327 VanDerWaalsContact O-N 3.14Å; G325-C328 PolarHBondContact O-N 2.92Å; G325-C328 PolarHBondContact O-SG 2.8Å; G325-C328 VanDerWaalsContact O-SG 3.38Å; G325-N329 PolarHBondContact O-N 3.36Å; G325-V353 CarbonylContact C-O 3.53Å; G325-V353 WeakPolarHBondContact CA-O 3.2Å
326	H	39.1	Very low	36	Very low	118 Å²	118	87.3 Å²	87.3	55%	0.546	45%	0.448	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-18.1	-172.4	-158.5	-49.6	0	0	0	114.3	V353 L355	H326-V353 HydrophobicContact CB-CB 3.95Å; H326-V353 HydrophobicContact CB-CG1 4.3Å; H326-V353 WeakPolarHBondContact CB-O 3.39Å; H326-V353 PolarHBondContact N-O 3.46Å; H326-L355 HydrophobicContact CB-CD1 4.46Å; H326-L355 VanDerWaalsContact CD2-CD1 3.42Å; H326-L355 WeakPolarHBondContact CD2-CD1 3.24Å
327	R	36.6	Very low	36.6	Very low	174 Å²	174	80.9 Å²	80.9	66%	0.657	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100	-18.8	-178.4	-74	-172.8	177	-172.2	-0.4	114.7	G325	G325-R327 PolarHBondContact O-N 3.01Å; G325-R327 VanDerWaalsContact O-N 3.14Å
328	C	43.7	Very low	37.2	Very low	38 Å²	38	81.9 Å²	81.9	26%	0.257	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100	-6.3	178.9	41.1	0	0	0	0	113.3	G325 W330	G325-C328 PolarHBondContact O-N 2.92Å; G325-C328 PolarHBondContact O-SG 2.8Å; G325-C328 VanDerWaalsContact O-SG 3.38Å; C328-W330 PolarHBondContact O-N 2.81Å
329	N	43.8	Very low	37.9	Very low	155 Å²	155	75.6 Å²	75.6	83%	0.829	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.1	22.9	-179.4	-139.6	19.6	0	0	0	113.8	G325	G325-N329 PolarHBondContact O-N 3.36Å
330	W	45.1	Very low	38.2	Very low	156 Å²	156	77 Å²	77	59%	0.591	39%	0.385	S	S	*	.	B	Isolated β-bridge	trans	-112.5	123.7	-173.9	-158.4	-90	0	0	0	109.8	C328 S332	C328-W330 PolarHBondContact O-N 2.81Å; W330-S332 PolarHBondContact O-N 3.24Å
331	P	42.5	Very low	38.6	Very low	79 Å²	79	76.8 Å²	76.8	51%	0.513	38%	0.384	S	S	.	.			trans	-71.6	99.3	169.7	27.6	-29.2	0	0	0	108.8	I324	I324-P331 HydrophobicContact CD1-CB 3.98Å; I324-P331 HydrophobicContact CG1-CB 4.38Å
332	S	38.5	Very low	39.2	Very low	23 Å²	23	70.9 Å²	70.9	16%	0.161	36%	0.359	C	S	.	.			trans	-77.3	130	166.4	-174.8	0	0	0	0	108.5	T322 I323 W330 S334 C336	T322-S332 WeakPolarHBondContact CG2-O 3.05Å; I323-S332 VanDerWaalsContact O-O 3.11Å; W330-S332 PolarHBondContact O-N 3.24Å; S332-S334 PolarHBondContact O-N 3.47Å; S332-C336 VanDerWaalsContact OG-CB 3.26Å; S332-C336 WeakPolarHBondContact OG-CB 3.42Å
333	P	37.4	Very low	39.3	Very low	23 Å²	23	75.4 Å²	75.4	15%	0.149	38%	0.382	C	S	.	.			trans	-54	137.1	167	-20.6	31.3	0	0	0	108.7	T276 C278 A335 C336	T276-P333 WeakPolarHBondContact O-CG 3.31Å; C278-P333 HydrophobicContact CB-CG 4.41Å; P333-A335 PolarHBondContact O-N 2.88Å; P333-C336 PolarHBondContact O-N 3.45Å
334	S	34.4	Very low	39.6	Very low	18 Å²	18	82.4 Å²	82.4	13%	0.126	41%	0.411	C	S	.	.	T	Hydrogen-bonded Turn	trans	-44.8	-26.7	174.5	5.8	0	0	0	0	113.8	K321 T322 S332 C336	K321-S334 VanDerWaalsContact O-CB 3.3Å; K321-S334 WeakPolarHBondContact O-CB 3.5Å; T322-S334 WeakPolarHBondContact CA-OG 3.41Å; T322-S334 WeakPolarHBondContact CB-OG 3.19Å; T322-S334 PolarHBondContact N-OG 2.82Å; T322-S334 PolarHBondContact OG1-OG 2.93Å; S332-S334 PolarHBondContact O-N 3.47Å; S334-C336 VanDerWaalsContact C-N 3.26Å; S334-C336 PolarHBondContact O-N 3.33Å
335	A	34.5	Very low	40	Very low	46 Å²	46	82.9 Å²	82.9	38%	0.38	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-24.7	180	0	0	0	0	0	113.1	P333 C339	P333-A335 PolarHBondContact O-N 2.88Å; A335-C339 VanDerWaalsContact O-CB 3.28Å; A335-C339 WeakPolarHBondContact O-CB 3.32Å; A335-C339 PolarHBondContact O-N 3.1Å; A335-C339 VanDerWaalsContact O-N 3.1Å
336	C	37.6	Very low	40.4	Very low	7 Å²	7	87.2 Å²	87.2	5%	0.047	43%	0.431	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.2	-34.8	-173.1	-143.4	0	0	0	0	113.1	S332 P333 S334 Y338 L345	S332-C336 VanDerWaalsContact OG-CB 3.26Å; S332-C336 WeakPolarHBondContact OG-CB 3.42Å; P333-C336 PolarHBondContact O-N 3.45Å; S334-C336 VanDerWaalsContact C-N 3.26Å; S334-C336 PolarHBondContact O-N 3.33Å; C336-Y338 PolarHBondContact O-N 3.04Å; C336-L345 WeakPolarHBondContact SG-CD1 3.31Å
337	F	39.9	Very low	41	Very low	43 Å²	43	89.5 Å²	89.5	19%	0.189	44%	0.44	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72	-12.4	176.2	-111.8	-83.9	0	0	0	113.8	F346 H349 V354	F337-F346 HydrophobicContact CD1-CE2 4.37Å; F337-F346 HydrophobicContact CD1-CZ 4.41Å; F337-F346 VanDerWaalsContact O-CE2 3.24Å; F337-F346 WeakPolarHBondContact O-CE2 3.18Å; F337-H349 HydrophobicContact CE2-CB 4.34Å; F337-H349 HydrophobicContact CZ-CB 4.08Å; F337-V354 HydrophobicContact CZ-CG2 4.39Å
338	Y	39.4	Very low	41.6	Very low	184 Å²	184	85 Å²	85	72%	0.722	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-125.2	4.6	-177.9	-67.1	-76.9	0	0	0	114.1	I323 C336 K340	I323-Y338 HydrophobicContact CD1-CE2 4.12Å; C336-Y338 PolarHBondContact O-N 3.04Å; Y338-K340 PolarHBondContact O-N 3.26Å
339	C	39.8	Very low	42	Very low	42 Å²	42	85 Å²	85	28%	0.284	42%	0.422	S	S	.	.			trans	-77.7	114.1	173.3	-179.8	0	0	0	0	109.7	A335 S341 C342	A335-C339 VanDerWaalsContact O-CB 3.28Å; A335-C339 WeakPolarHBondContact O-CB 3.32Å; A335-C339 PolarHBondContact O-N 3.1Å; A335-C339 VanDerWaalsContact O-N 3.1Å; C339-S341 PolarHBondContact O-N 3.47Å; C339-S341 VanDerWaalsContact SG-CB 3.51Å; C339-S341 PolarHBondContact SG-N 3.5Å; C339-C342 HydrophobicContact CB-CB 3.95Å; C339-C342 WeakPolarHBondContact CB-SG 3.43Å; C339-C342 PolarHBondContact O-N 3.24Å; C339-C342 PolarHBondContact SG-SG 3.34Å
340	K	37.3	Very low	42.3	Very low	181 Å²	181	84 Å²	84	79%	0.787	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	-21.7	176.7	-153.4	176.5	-174.6	178.6	0	112.5	Y338	Y338-K340 PolarHBondContact O-N 3.26Å
341	S	38.5	Very low	42.7	Very low	106 Å²	106	83.2 Å²	83.2	74%	0.741	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84	-20.1	178.9	-35.4	0	0	0	0	113.4	C339 N343	C339-S341 PolarHBondContact O-N 3.47Å; C339-S341 VanDerWaalsContact SG-CB 3.51Å; C339-S341 PolarHBondContact SG-N 3.5Å; S341-N343 VanDerWaalsContact C-N 3.31Å; S341-N343 PolarHBondContact O-N 3.25Å
342	C	44.4	Very low	43.3	Very low	6 Å²	6	81.9 Å²	81.9	4%	0.041	41%	0.407	C	S	.	.			trans	-91.8	36.5	-175.3	-60.7	0	0	0	0	113.3	H281 C339 K344 L345	H281-C342 PolarHBondContact CE1-SG 3.05Å; H281-C342 PolarHBondContact NE2-SG 2.91Å; C339-C342 HydrophobicContact CB-CB 3.95Å; C339-C342 WeakPolarHBondContact CB-SG 3.43Å; C339-C342 PolarHBondContact O-N 3.24Å; C339-C342 PolarHBondContact SG-SG 3.34Å; C342-K344 PolarHBondContact O-N 3.27Å; C342-L345 PolarHBondContact O-N 3.1Å; C342-L345 VanDerWaalsContact O-N 3.11Å
343	N	42.2	Very low	44.1	Very low	123 Å²	123	84.7 Å²	84.7	66%	0.658	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-3.4	-176.9	-134	1.1	0	0	0	114.3	S341	S341-N343 VanDerWaalsContact C-N 3.31Å; S341-N343 PolarHBondContact O-N 3.25Å
344	K	42.8	Very low	44.8	Very low	176 Å²	176	86.9 Å²	86.9	77%	0.765	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.4	-41.4	172.5	-84.7	-175.5	171.9	-176.2	0	113.4	C342 K347	C342-K344 PolarHBondContact O-N 3.27Å; K344-K347 PolarHBondContact O-N 3.28Å
345	L	45.3	Very low	45.8	Very low	37 Å²	37	87.5 Å²	87.5	19%	0.194	44%	0.437	C	S	.	.	H	α-helix	trans	-78.2	-21.2	-176.6	-87.1	153.6	0	0	0	113.4	C336 C342 K347 E348 H349	C336-L345 WeakPolarHBondContact SG-CD1 3.31Å; C342-L345 PolarHBondContact O-N 3.1Å; C342-L345 VanDerWaalsContact O-N 3.11Å; L345-K347 VanDerWaalsContact C-N 3.27Å; L345-K347 PolarHBondContact O-N 3.25Å; L345-E348 PolarHBondContact O-N 3.38Å; L345-H349 PolarHBondContact O-N 2.99Å
346	F	46.5	Very low	46.8	Very low	97 Å²	97	87.5 Å²	87.5	43%	0.425	44%	0.435	S	S	.	.	H	α-helix	trans	-60.8	-36.7	173.1	-124.7	-81.2	0	0	0	112	F337 E350	F337-F346 HydrophobicContact CD1-CE2 4.37Å; F337-F346 HydrophobicContact CD1-CZ 4.41Å; F337-F346 VanDerWaalsContact O-CE2 3.24Å; F337-F346 WeakPolarHBondContact O-CE2 3.18Å; F346-E350 WeakPolarHBondContact O-CA 3.34Å; F346-E350 VanDerWaalsContact O-CB 3.27Å; F346-E350 WeakPolarHBondContact O-CB 3.35Å; F346-E350 PolarHBondContact O-N 3.06Å; F346-E350 VanDerWaalsContact O-N 3.07Å
347	K	50.2	Low	47.8	Very low	166 Å²	166	89.9 Å²	89.9	72%	0.722	45%	0.447	S	S	*	.	H	α-helix	trans	-75.9	-32.6	180	-75.2	-173	174.9	-175.7	0	113.5	K344 L345 H349	K344-K347 PolarHBondContact O-N 3.28Å; L345-K347 VanDerWaalsContact C-N 3.27Å; L345-K347 PolarHBondContact O-N 3.25Å; K347-H349 VanDerWaalsContact C-N 3.34Å
348	E	50	Low	48.8	Very low	78 Å²	78	93.6 Å²	93.6	36%	0.364	47%	0.465	S	S	.	.	H	α-helix	trans	-80.7	-17.9	-176.7	-68.4	176.8	-167.5	0	0	112.7	P139 L345	P139-E348 VanDerWaalsContact CB-CD 3.44Å; P139-E348 HydrophobicContact CB-CG 4.3Å; P139-E348 WeakPolarHBondContact CB-OE2 3.3Å; P139-E348 VanDerWaalsContact CG-CD 3.46Å; P139-E348 WeakPolarHBondContact CG-OE1 3.22Å; L345-E348 PolarHBondContact O-N 3.38Å
349	H	51.2	Low	50	Low	38 Å²	38	90 Å²	90	18%	0.176	45%	0.453	C	S	.	.	H	α-helix	trans	-125.4	9.8	-178.5	-62	-33	0	0	0	114.1	F337 L345 K347 N351 H352	F337-H349 HydrophobicContact CE2-CB 4.34Å; F337-H349 HydrophobicContact CZ-CB 4.08Å; L345-H349 PolarHBondContact O-N 2.99Å; K347-H349 VanDerWaalsContact C-N 3.34Å; H349-N351 PolarHBondContact O-N 3.47Å; H349-H352 HydrophobicContact CB-CB 4.35Å; H349-H352 AromaticContact CE1-ND1 3.89Å; H349-H352 AromaticContact CG-ND1 3.82Å; H349-H352 AromaticContact ND1-CE1 3.38Å; H349-H352 PolarHBondContact ND1-CE1 3.35Å; H349-H352 AromaticContact ND1-ND1 3.07Å; H349-H352 PolarHBondContact ND1-ND1 2.75Å; H349-H352 PolarHBondContact O-N 2.66Å
350	E	50.7	Low	51	Low	135 Å²	135	88.7 Å²	88.7	63%	0.631	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.8	-32	-180	-151.8	170.9	170.7	0	0	112.5	F346	F346-E350 WeakPolarHBondContact O-CA 3.34Å; F346-E350 VanDerWaalsContact O-CB 3.27Å; F346-E350 WeakPolarHBondContact O-CB 3.35Å; F346-E350 PolarHBondContact O-N 3.06Å; F346-E350 VanDerWaalsContact O-N 3.07Å
351	N	54.5	Low	52.4	Low	140 Å²	140	83.5 Å²	83.5	75%	0.749	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.5	8.7	-177.7	-64.2	-34.9	0	0	0	114	H349	H349-N351 PolarHBondContact O-N 3.47Å
352	H	54.6	Low	53.9	Low	50 Å²	50	83.4 Å²	83.4	23%	0.231	42%	0.416	C	S	.	.	S	Bend	trans	-89.9	139	-178.6	-73.9	-176.3	0	0	0	111.4	H349 V354	H349-H352 HydrophobicContact CB-CB 4.35Å; H349-H352 AromaticContact CE1-ND1 3.89Å; H349-H352 AromaticContact CG-ND1 3.82Å; H349-H352 AromaticContact ND1-CE1 3.38Å; H349-H352 PolarHBondContact ND1-CE1 3.35Å; H349-H352 AromaticContact ND1-ND1 3.07Å; H349-H352 PolarHBondContact ND1-ND1 2.75Å; H349-H352 PolarHBondContact O-N 2.66Å; H352-V354 VanDerWaalsContact O-CG2 3.32Å; H352-V354 WeakPolarHBondContact O-CG2 3.47Å; H352-V354 PolarHBondContact O-N 2.81Å
353	V	54.1	Low	55.1	Low	82 Å²	82	86.6 Å²	86.6	50%	0.497	43%	0.433	S	S	.	.			trans	-68.2	134	172.3	177.3	0	0	0	0	108.7	G325 H326	G325-V353 CarbonylContact C-O 3.53Å; G325-V353 WeakPolarHBondContact CA-O 3.2Å; H326-V353 HydrophobicContact CB-CB 3.95Å; H326-V353 HydrophobicContact CB-CG1 4.3Å; H326-V353 WeakPolarHBondContact CB-O 3.39Å; H326-V353 PolarHBondContact N-O 3.46Å
354	V	53.3	Low	56.3	Low	70 Å²	70	83 Å²	83	42%	0.424	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	121.5	-169.8	-179.5	0	0	0	0	109.4	I323 F337 H352	I323-V354 HydrophobicContact CB-CG1 4.36Å; I323-V354 HydrophobicContact CG2-CB 4.29Å; I323-V354 HydrophobicContact CG2-CG1 2.9Å; F337-V354 HydrophobicContact CZ-CG2 4.39Å; H352-V354 VanDerWaalsContact O-CG2 3.32Å; H352-V354 WeakPolarHBondContact O-CG2 3.47Å; H352-V354 PolarHBondContact O-N 2.81Å
355	L	54.8	Low	57.6	Low	30 Å²	30	76.2 Å²	76.2	16%	0.157	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	147.6	177.4	-67.6	176.6	0	0	0	111	I323 I324 H326 K359 A360	I323-L355 CarbonylContact C-O 3.59Å; I323-L355 WeakPolarHBondContact CA-O 3.39Å; I323-L355 WeakPolarHBondContact CG2-O 3.49Å; I324-L355 PolarHBondContact N-O 2.97Å; I324-L355 PolarHBondContact O-N 3.02Å; H326-L355 HydrophobicContact CB-CD1 4.46Å; H326-L355 VanDerWaalsContact CD2-CD1 3.42Å; H326-L355 WeakPolarHBondContact CD2-CD1 3.24Å; L355-K359 HydrophobicContact CD2-CD 4.15Å; L355-A360 HydrophobicContact CB-CB 4.4Å; L355-A360 HydrophobicContact CD1-CB 4.43Å
356	S	56.3	Low	58.9	Low	47 Å²	47	77.8 Å²	77.8	33%	0.329	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	144.5	167.6	66.9	0	0	0	0	110.3	E358 K359 A360	S356-E358 PolarHBondContact O-N 3.41Å; S356-K359 PolarHBondContact O-N 3.15Å; S356-K359 VanDerWaalsContact O-N 3.12Å; S356-K359 WeakPolarHBondContact OG-CB 3.4Å; S356-K359 PolarHBondContact OG-N 3.42Å; S356-A360 PolarHBondContact O-N 2.97Å
357	L	58.3	Low	60.2	Low	57 Å²	57	77 Å²	77	30%	0.298	40%	0.396	S	S	.	.	H	α-helix	trans	-55.7	-40.5	174.4	177.5	71.2	0	0	0	110.9	T322 I324 K359 A360 V361	T322-L357 VanDerWaalsContact CB-CD2 3.46Å; T322-L357 HydrophobicContact CG2-CB 4.09Å; T322-L357 HydrophobicContact CG2-CD1 4.25Å; T322-L357 HydrophobicContact CG2-CD2 3.86Å; T322-L357 HydrophobicContact CG2-CG 4.27Å; T322-L357 WeakPolarHBondContact O-CB 3.43Å; T322-L357 PolarHBondContact O-N 2.95Å; I324-L357 HydrophobicContact CD1-CD1 3.62Å; I324-L357 HydrophobicContact CG1-CD1 4.13Å; L357-K359 VanDerWaalsContact C-N 3.31Å; L357-K359 PolarHBondContact O-N 2.79Å; L357-A360 PolarHBondContact O-N 3.5Å; L357-V361 HydrophobicContact CD1-CG2 3.66Å; L357-V361 HydrophobicContact CG-CG2 3.93Å; L357-V361 VanDerWaalsContact O-CB 3.29Å; L357-V361 WeakPolarHBondContact O-CB 3.18Å; L357-V361 WeakPolarHBondContact O-CG2 3.35Å; L357-V361 PolarHBondContact O-N 3.28Å
358	E	60.2	Low	61.2	Low	120 Å²	120	73.6 Å²	73.6	56%	0.561	39%	0.385	S	S	*	.	H	α-helix	trans	-53.1	-48.2	176.3	-68.9	166.1	179.4	0	0	111.4	K321 S356 H362	K321-E358 WeakPolarHBondContact CE-OE1 3.34Å; K321-E358 IonicContact NZ-OE1 3.38Å; K321-E358 PolarHBondContact NZ-OE1 3.02Å; K321-E358 IonicContact NZ-OE2 3.44Å; K321-E358 PolarHBondContact NZ-OE2 3.09Å; S356-E358 PolarHBondContact O-N 3.41Å; E358-H362 WeakPolarHBondContact O-CB 3.02Å; E358-H362 PolarHBondContact O-N 2.78Å; E358-H362 VanDerWaalsContact O-N 3.13Å
359	K	65.4	Low	62.4	Low	108 Å²	108	72.6 Å²	72.6	47%	0.47	38%	0.382	S	S	.	.	H	α-helix	trans	-70.9	-46.9	179.6	-179.4	171.7	176.3	-177.7	0	112	L355 S356 L357 V361 H362 D363	L355-K359 HydrophobicContact CD2-CD 4.15Å; S356-K359 PolarHBondContact O-N 3.15Å; S356-K359 VanDerWaalsContact O-N 3.12Å; S356-K359 WeakPolarHBondContact OG-CB 3.4Å; S356-K359 PolarHBondContact OG-N 3.42Å; L357-K359 VanDerWaalsContact C-N 3.31Å; L357-K359 PolarHBondContact O-N 2.79Å; K359-V361 VanDerWaalsContact C-N 3.33Å; K359-V361 PolarHBondContact O-N 2.93Å; K359-H362 WeakPolarHBondContact O-CB 3.29Å; K359-H362 PolarHBondContact O-N 2.58Å; K359-D363 PolarHBondContact O-N 2.74Å
360	A	60.3	Low	63.6	Low	16 Å²	16	76 Å²	76	13%	0.132	40%	0.396	C	S	.	.	H	α-helix	trans	-63.8	-37.9	-178.4	0	0	0	0	0	112.4	I324 L355 S356 L357 A364	I324-A360 HydrophobicContact CB-CB 4.13Å; I324-A360 HydrophobicContact CD1-CB 3.69Å; I324-A360 HydrophobicContact CG1-CB 4.19Å; L355-A360 HydrophobicContact CB-CB 4.4Å; L355-A360 HydrophobicContact CD1-CB 4.43Å; S356-A360 PolarHBondContact O-N 2.97Å; L357-A360 PolarHBondContact O-N 3.5Å; A360-A364 WeakPolarHBondContact O-CB 3.5Å; A360-A364 PolarHBondContact O-N 3.5Å
361	V	66	Low	64.9	Low	71 Å²	71	74.4 Å²	74.4	43%	0.43	39%	0.389	S	S	.	.	H	α-helix	trans	-66.5	-41.4	173.5	170.7	0	0	0	0	111.1	L357 K359 K365	L357-V361 HydrophobicContact CD1-CG2 3.66Å; L357-V361 HydrophobicContact CG-CG2 3.93Å; L357-V361 VanDerWaalsContact O-CB 3.29Å; L357-V361 WeakPolarHBondContact O-CB 3.18Å; L357-V361 WeakPolarHBondContact O-CG2 3.35Å; L357-V361 PolarHBondContact O-N 3.28Å; K359-V361 VanDerWaalsContact C-N 3.33Å; K359-V361 PolarHBondContact O-N 2.93Å; V361-K365 WeakPolarHBondContact O-CB 3.48Å; V361-K365 PolarHBondContact O-N 2.82Å
362	H	71.7	Confident	65.9	Low	105 Å²	105	71 Å²	71	49%	0.486	37%	0.37	S	S	.	.	H	α-helix	trans	-62	-49.3	176.5	-178.2	78.1	0	0	0	112.1	E358 K359 A364 K365 I366	E358-H362 WeakPolarHBondContact O-CB 3.02Å; E358-H362 PolarHBondContact O-N 2.78Å; E358-H362 VanDerWaalsContact O-N 3.13Å; K359-H362 WeakPolarHBondContact O-CB 3.29Å; K359-H362 PolarHBondContact O-N 2.58Å; H362-A364 PolarHBondContact O-N 3.31Å; H362-K365 WeakPolarHBondContact O-CB 3.49Å; H362-K365 PolarHBondContact O-N 2.65Å; H362-I366 WeakPolarHBondContact NE2-CD1 3.41Å; H362-I366 PolarHBondContact O-N 2.81Å; H362-I366 VanDerWaalsContact O-N 3.09Å
363	D	69.1	Low	66.9	Low	73 Å²	73	72.7 Å²	72.7	39%	0.39	38%	0.381	S	S	.	.	H	α-helix	trans	-63.2	-43.2	179.5	-67.3	-17.4	0	0	0	111.1	K359 K365 I366 E367	K359-D363 PolarHBondContact O-N 2.74Å; D363-K365 PolarHBondContact O-N 2.86Å; D363-I366 PolarHBondContact O-N 2.95Å; D363-E367 PolarHBondContact O-N 3.06Å; D363-E367 VanDerWaalsContact O-N 3.09Å
364	A	66.4	Low	68	Low	47 Å²	47	75.4 Å²	75.4	39%	0.388	38%	0.382	S	S	.	.	H	α-helix	trans	-62.6	-39.6	174.8	0	0	0	0	0	112.4	A360 H362 I366 E367 I368	A360-A364 WeakPolarHBondContact O-CB 3.5Å; A360-A364 PolarHBondContact O-N 3.5Å; H362-A364 PolarHBondContact O-N 3.31Å; A364-I366 PolarHBondContact O-N 2.89Å; A364-E367 PolarHBondContact O-N 3.01Å; A364-I368 WeakPolarHBondContact O-CB 3.38Å; A364-I368 VanDerWaalsContact O-CG1 3.22Å; A364-I368 WeakPolarHBondContact O-CG1 3.36Å; A364-I368 PolarHBondContact O-N 2.83Å
365	K	70.1	Confident	69	Low	34 Å²	34	76.1 Å²	76.1	15%	0.148	39%	0.386	C	S	.	.	H	α-helix	trans	-61.4	-44.3	176.7	-174.6	-175.9	174.4	-166.6	0	111.1	L2 E6 V361 H362 D363 N369	L2-K365 PolarHBondContact O-NZ 3.33Å; L2-K365 VanDerWaalsContact O-NZ 3.16Å; E6-K365 IonicContact OE1-NZ 2.89Å; E6-K365 PolarHBondContact OE1-NZ 3.34Å; E6-K365 IonicContact OE2-NZ 2.63Å; E6-K365 PolarHBondContact OE2-NZ 3.42Å; V361-K365 WeakPolarHBondContact O-CB 3.48Å; V361-K365 PolarHBondContact O-N 2.82Å; H362-K365 WeakPolarHBondContact O-CB 3.49Å; H362-K365 PolarHBondContact O-N 2.65Å; D363-K365 PolarHBondContact O-N 2.86Å; K365-N369 WeakPolarHBondContact O-CB 3.5Å; K365-N369 VanDerWaalsContact O-CG 3.29Å; K365-N369 PolarHBondContact O-N 2.84Å; K365-N369 PolarHBondContact O-ND2 2.84Å
366	I	74.3	Confident	69.9	Low	70 Å²	70	77.1 Å²	77.1	36%	0.359	39%	0.389	S	S	.	.	H	α-helix	trans	-61.5	-46.9	177.3	-69.3	172.1	0	0	0	110.7	H362 D363 A364 N369 K370	H362-I366 WeakPolarHBondContact NE2-CD1 3.41Å; H362-I366 PolarHBondContact O-N 2.81Å; H362-I366 VanDerWaalsContact O-N 3.09Å; D363-I366 PolarHBondContact O-N 2.95Å; A364-I366 PolarHBondContact O-N 2.89Å; I366-N369 PolarHBondContact O-N 2.9Å; I366-K370 HydrophobicContact CG2-CD 4.38Å; I366-K370 WeakPolarHBondContact O-CG 3.1Å; I366-K370 PolarHBondContact O-N 3.08Å; I366-K370 VanDerWaalsContact O-N 3.08Å
367	E	72.2	Confident	70.8	Confident	79 Å²	79	81.8 Å²	81.8	37%	0.369	40%	0.4	S	S	.	.	H	α-helix	trans	-68.2	-43.9	-177.5	-173.5	53.7	-148.5	0	0	112.2	D363 A364 N369 K370 Q371	D363-E367 PolarHBondContact O-N 3.06Å; D363-E367 VanDerWaalsContact O-N 3.09Å; A364-E367 PolarHBondContact O-N 3.01Å; E367-N369 VanDerWaalsContact C-N 3.33Å; E367-N369 PolarHBondContact O-N 3.29Å; E367-K370 WeakPolarHBondContact O-CB 3.43Å; E367-K370 PolarHBondContact O-N 2.9Å; E367-Q371 WeakPolarHBondContact O-CG 3.4Å; E367-Q371 PolarHBondContact O-N 3.48Å; E367-Q371 PolarHBondContact OE1-NE2 3.17Å
368	I	72.4	Confident	71.7	Confident	96 Å²	96	83.6 Å²	83.6	49%	0.492	41%	0.41	S	S	.	.	H	α-helix	trans	-59.7	-44.1	175.6	-70.6	167.5	0	0	0	110.7	A364 K370 Q371 I372	A364-I368 WeakPolarHBondContact O-CB 3.38Å; A364-I368 VanDerWaalsContact O-CG1 3.22Å; A364-I368 WeakPolarHBondContact O-CG1 3.36Å; A364-I368 PolarHBondContact O-N 2.83Å; I368-K370 PolarHBondContact O-N 2.89Å; I368-Q371 PolarHBondContact O-N 2.71Å; I368-Q371 VanDerWaalsContact O-N 3.17Å; I368-I372 HydrophobicContact CG2-CD1 3.74Å; I368-I372 HydrophobicContact CG2-CG1 4.32Å; I368-I372 WeakPolarHBondContact O-CG1 3.34Å; I368-I372 PolarHBondContact O-N 3.01Å
369	N	74.6	Confident	72.3	Confident	56 Å²	56	80.4 Å²	80.4	30%	0.299	40%	0.4	S	S	.	.	H	α-helix	trans	-62.7	-41.2	178	-78	-23.7	0	0	0	112.2	K365 I366 E367 Q371 I372 D373	K365-N369 WeakPolarHBondContact O-CB 3.5Å; K365-N369 VanDerWaalsContact O-CG 3.29Å; K365-N369 PolarHBondContact O-N 2.84Å; K365-N369 PolarHBondContact O-ND2 2.84Å; I366-N369 PolarHBondContact O-N 2.9Å; E367-N369 VanDerWaalsContact C-N 3.33Å; E367-N369 PolarHBondContact O-N 3.29Å; N369-Q371 VanDerWaalsContact C-N 3.3Å; N369-Q371 PolarHBondContact O-N 2.84Å; N369-I372 PolarHBondContact O-N 2.89Å; N369-D373 PolarHBondContact O-N 2.88Å
370	K	77	Confident	72.7	Confident	109 Å²	109	78 Å²	78	47%	0.474	40%	0.397	S	S	.	.	H	α-helix	trans	-60.1	-39.3	173.6	-73.8	174.1	-177.3	171.6	0	112.3	I366 E367 I368 R374	I366-K370 HydrophobicContact CG2-CD 4.38Å; I366-K370 WeakPolarHBondContact O-CG 3.1Å; I366-K370 PolarHBondContact O-N 3.08Å; I366-K370 VanDerWaalsContact O-N 3.08Å; E367-K370 WeakPolarHBondContact O-CB 3.43Å; E367-K370 PolarHBondContact O-N 2.9Å; I368-K370 PolarHBondContact O-N 2.89Å; K370-R374 WeakPolarHBondContact O-CG 3.49Å; K370-R374 PolarHBondContact O-N 3.12Å
371	Q	76.7	Confident	73.5	Confident	103 Å²	103	82.1 Å²	82.1	48%	0.481	41%	0.414	S	S	.	.	H	α-helix	trans	-69.4	-42.3	177.3	-68.4	-175.1	20	0	0	111.7	E367 I368 N369 D373 R374 V375	E367-Q371 WeakPolarHBondContact O-CG 3.4Å; E367-Q371 PolarHBondContact O-N 3.48Å; E367-Q371 PolarHBondContact OE1-NE2 3.17Å; I368-Q371 PolarHBondContact O-N 2.71Å; I368-Q371 VanDerWaalsContact O-N 3.17Å; N369-Q371 VanDerWaalsContact C-N 3.3Å; N369-Q371 PolarHBondContact O-N 2.84Å; Q371-D373 VanDerWaalsContact C-N 3.33Å; Q371-D373 PolarHBondContact O-N 3.04Å; Q371-R374 WeakPolarHBondContact O-CB 3.46Å; Q371-R374 PolarHBondContact O-N 3.46Å; Q371-R374 VanDerWaalsContact O-N 3.16Å; Q371-V375 WeakPolarHBondContact O-CG2 3.5Å; Q371-V375 PolarHBondContact O-N 3.15Å
372	I	76.4	Confident	74	Confident	67 Å²	67	83.8 Å²	83.8	34%	0.344	42%	0.416	S	S	.	.	H	α-helix	trans	-58	-44.9	174.4	-70.4	169.1	0	0	0	110.8	I368 N369 R374 V375 K376	I368-I372 HydrophobicContact CG2-CD1 3.74Å; I368-I372 HydrophobicContact CG2-CG1 4.32Å; I368-I372 WeakPolarHBondContact O-CG1 3.34Å; I368-I372 PolarHBondContact O-N 3.01Å; N369-I372 PolarHBondContact O-N 2.89Å; I372-R374 VanDerWaalsContact C-N 3.3Å; I372-R374 PolarHBondContact O-N 3.4Å; I372-V375 PolarHBondContact O-N 2.86Å; I372-K376 HydrophobicContact CG2-CD 4.21Å; I372-K376 WeakPolarHBondContact O-CG 3.49Å; I372-K376 PolarHBondContact O-N 3.4Å
373	D	75.8	Confident	74.1	Confident	87 Å²	87	83.7 Å²	83.7	47%	0.465	42%	0.415	S	S	.	.	H	α-helix	trans	-66.6	-30.3	178.9	-70.8	-21.6	0	0	0	113	N369 Q371 R377	N369-D373 PolarHBondContact O-N 2.88Å; Q371-D373 VanDerWaalsContact C-N 3.33Å; Q371-D373 PolarHBondContact O-N 3.04Å; D373-R377 WeakPolarHBondContact O-CG 3.19Å; D373-R377 PolarHBondContact O-N 3.21Å; D373-R377 PolarHBondContact O-NE 3.4Å
374	R	76	Confident	74.5	Confident	139 Å²	139	84.9 Å²	84.9	53%	0.525	42%	0.421	S	S	.	.	H	α-helix	trans	-67.8	-47.1	170.6	-73.1	172.9	-175.8	177.7	2.8	111.1	K370 Q371 I372 K376 R377 N378	K370-R374 WeakPolarHBondContact O-CG 3.49Å; K370-R374 PolarHBondContact O-N 3.12Å; Q371-R374 WeakPolarHBondContact O-CB 3.46Å; Q371-R374 PolarHBondContact O-N 3.46Å; Q371-R374 VanDerWaalsContact O-N 3.16Å; I372-R374 VanDerWaalsContact C-N 3.3Å; I372-R374 PolarHBondContact O-N 3.4Å; R374-K376 PolarHBondContact O-N 2.95Å; R374-R377 PolarHBondContact O-N 3.05Å; R374-N378 PolarHBondContact O-N 2.99Å; R374-N378 PolarHBondContact O-OD1 3.2Å
375	V	76.2	Confident	75.1	Confident	84 Å²	84	89.8 Å²	89.8	51%	0.509	43%	0.431	S	S	.	.	H	α-helix	trans	-61	-43.3	178.8	173.8	0	0	0	0	111	Q371 I372 R377 N378 S379	Q371-V375 WeakPolarHBondContact O-CG2 3.5Å; Q371-V375 PolarHBondContact O-N 3.15Å; I372-V375 PolarHBondContact O-N 2.86Å; V375-R377 PolarHBondContact O-N 3.43Å; V375-N378 PolarHBondContact O-N 3.28Å; V375-S379 PolarHBondContact O-N 3.28Å
376	K	73.6	Confident	75.5	Confident	52 Å²	52	90.6 Å²	90.6	23%	0.226	44%	0.437	C	S	.	.	H	α-helix	trans	-58.8	-46.8	176.3	-76.3	177.2	-179.2	170.4	0	113.1	L55 T58 I372 R374 N378 S379 S380	L55-K376 HydrophobicContact CD2-CD 4.09Å; L55-K376 HydrophobicContact CD2-CG 3.65Å; T58-K376 PolarHBondContact OG1-NZ 3.49Å; I372-K376 HydrophobicContact CG2-CD 4.21Å; I372-K376 WeakPolarHBondContact O-CG 3.49Å; I372-K376 PolarHBondContact O-N 3.4Å; R374-K376 PolarHBondContact O-N 2.95Å; K376-N378 VanDerWaalsContact C-N 3.34Å; K376-N378 PolarHBondContact O-N 2.97Å; K376-S379 PolarHBondContact O-N 3.48Å; K376-S380 PolarHBondContact O-N 3.21Å; K376-S380 VanDerWaalsContact O-N 3.09Å
377	R	74.9	Confident	75.9	Confident	144 Å²	144	92.4 Å²	92.4	54%	0.543	45%	0.447	S	S	.	.	H	α-helix	trans	-61.8	-43.9	176.9	-76	-174.4	-67.3	132.6	-5.7	111.3	D373 R374 V375 S379 S380 Q381	D373-R377 WeakPolarHBondContact O-CG 3.19Å; D373-R377 PolarHBondContact O-N 3.21Å; D373-R377 PolarHBondContact O-NE 3.4Å; R374-R377 PolarHBondContact O-N 3.05Å; V375-R377 PolarHBondContact O-N 3.43Å; R377-S379 PolarHBondContact O-N 3.25Å; R377-S380 PolarHBondContact O-N 3.26Å; R377-S380 PolarHBondContact O-OG 3.05Å; R377-Q381 WeakPolarHBondContact O-CG 3.14Å; R377-Q381 PolarHBondContact O-N 3.45Å; R377-Q381 VanDerWaalsContact O-N 3.11Å
378	N	75.7	Confident	76.4	Confident	96 Å²	96	92.2 Å²	92.2	51%	0.513	45%	0.449	S	S	.	.	H	α-helix	trans	-63.8	-39.8	177.3	-69.1	-0.1	0	0	0	112.1	R374 V375 K376 Q381 F382	R374-N378 PolarHBondContact O-N 2.99Å; R374-N378 PolarHBondContact O-OD1 3.2Å; V375-N378 PolarHBondContact O-N 3.28Å; K376-N378 VanDerWaalsContact C-N 3.34Å; K376-N378 PolarHBondContact O-N 2.97Å; N378-Q381 PolarHBondContact O-N 3.21Å; N378-F382 WeakPolarHBondContact O-CB 3.17Å; N378-F382 PolarHBondContact O-N 2.99Å
379	S	74.1	Confident	76.9	Confident	52 Å²	52	92.5 Å²	92.5	36%	0.364	45%	0.45	S	S	.	.	H	α-helix	trans	-59.1	-47.9	175.7	-160.8	0	0	0	0	111.6	V375 K376 R377 Q381 F382 E383	V375-S379 PolarHBondContact O-N 3.28Å; K376-S379 PolarHBondContact O-N 3.48Å; R377-S379 PolarHBondContact O-N 3.25Å; S379-Q381 VanDerWaalsContact C-N 3.3Å; S379-Q381 PolarHBondContact O-N 3.46Å; S379-F382 WeakPolarHBondContact O-CB 3.49Å; S379-F382 PolarHBondContact O-N 3.38Å; S379-F382 VanDerWaalsContact O-N 3.12Å; S379-E383 PolarHBondContact O-N 2.94Å
380	S	72.4	Confident	77.3	Confident	57 Å²	57	94.1 Å²	94.1	40%	0.399	46%	0.462	S	S	.	.	H	α-helix	trans	-63.8	-33.2	177.9	66.8	0	0	0	0	113.4	K376 R377 N384	K376-S380 PolarHBondContact O-N 3.21Å; K376-S380 VanDerWaalsContact O-N 3.09Å; R377-S380 PolarHBondContact O-N 3.26Å; R377-S380 PolarHBondContact O-OG 3.05Å; S380-N384 PolarHBondContact O-N 3.46Å; S380-N384 PolarHBondContact O-ND2 3.17Å; S380-N384 VanDerWaalsContact O-ND2 3.12Å
381	Q	77.8	Confident	77.6	Confident	104 Å²	104	94.9 Å²	94.9	49%	0.486	47%	0.465	S	S	.	.	H	α-helix	trans	-69.3	-42.3	173.3	-71.9	179.9	-2.8	0	0	111	R377 N378 S379 N384 Y385	R377-Q381 WeakPolarHBondContact O-CG 3.14Å; R377-Q381 PolarHBondContact O-N 3.45Å; R377-Q381 VanDerWaalsContact O-N 3.11Å; N378-Q381 PolarHBondContact O-N 3.21Å; S379-Q381 VanDerWaalsContact C-N 3.3Å; S379-Q381 PolarHBondContact O-N 3.46Å; Q381-N384 WeakPolarHBondContact O-CB 3.33Å; Q381-N384 PolarHBondContact O-N 3.47Å; Q381-Y385 HydrophobicContact CB-CE2 4.38Å; Q381-Y385 WeakPolarHBondContact O-CD2 3.41Å; Q381-Y385 PolarHBondContact O-N 3.49Å
382	F	76.6	Confident	77.9	Confident	106 Å²	106	97 Å²	97	47%	0.465	47%	0.47	S	S	.	.	H	α-helix	trans	-62.6	-43.2	178.2	-169.7	-104.4	0	0	0	112.4	L48 N378 S379 N384 Y385 L386	L48-F382 HydrophobicContact CD1-CE1 4.22Å; N378-F382 WeakPolarHBondContact O-CB 3.17Å; N378-F382 PolarHBondContact O-N 2.99Å; S379-F382 WeakPolarHBondContact O-CB 3.49Å; S379-F382 PolarHBondContact O-N 3.38Å; S379-F382 VanDerWaalsContact O-N 3.12Å; F382-N384 VanDerWaalsContact C-N 3.33Å; F382-N384 PolarHBondContact O-N 2.82Å; F382-Y385 WeakPolarHBondContact O-CB 3.34Å; F382-Y385 PolarHBondContact O-N 3.05Å; F382-Y385 VanDerWaalsContact O-N 3.15Å; F382-L386 HydrophobicContact CD1-CD1 3.9Å; F382-L386 HydrophobicContact CD1-CG 4.3Å; F382-L386 HydrophobicContact CE1-CD1 3.61Å; F382-L386 HydrophobicContact CE1-CD2 4.38Å; F382-L386 HydrophobicContact CE1-CG 4.04Å; F382-L386 HydrophobicContact CZ-CD1 4.38Å; F382-L386 HydrophobicContact CZ-CD2 4.35Å; F382-L386 HydrophobicContact CZ-CG 4.41Å; F382-L386 WeakPolarHBondContact O-CG 3.33Å; F382-L386 PolarHBondContact O-N 3.24Å
383	E	74.4	Confident	78.2	Confident	103 Å²	103	95.5 Å²	95.5	48%	0.481	47%	0.471	S	S	.	.	H	α-helix	trans	-57.8	-43.8	172.3	-76.4	173.5	-165.4	0	0	112.3	S379 Y385 L386 N387	S379-E383 PolarHBondContact O-N 2.94Å; E383-Y385 VanDerWaalsContact C-N 3.34Å; E383-Y385 PolarHBondContact O-N 2.95Å; E383-L386 PolarHBondContact O-N 3.42Å; E383-N387 PolarHBondContact O-N 2.85Å; E383-N387 PolarHBondContact O-ND2 3.02Å
384	N	77.2	Confident	78.6	Confident	97 Å²	97	97.4 Å²	97.4	52%	0.519	48%	0.477	S	S	.	.	H	α-helix	trans	-63.5	-38.7	175.3	-75.5	-34.5	0	0	0	112.3	S380 Q381 F382 N387 N388	S380-N384 PolarHBondContact O-N 3.46Å; S380-N384 PolarHBondContact O-ND2 3.17Å; S380-N384 VanDerWaalsContact O-ND2 3.12Å; Q381-N384 WeakPolarHBondContact O-CB 3.33Å; Q381-N384 PolarHBondContact O-N 3.47Å; F382-N384 VanDerWaalsContact C-N 3.33Å; F382-N384 PolarHBondContact O-N 2.82Å; N384-N387 PolarHBondContact O-N 3.36Å; N384-N388 VanDerWaalsContact O-CG 3.26Å; N384-N388 PolarHBondContact O-N 3.17Å; N384-N388 PolarHBondContact O-ND2 2.94Å
385	Y	78.8	Confident	79	Confident	150 Å²	150	94.8 Å²	94.8	59%	0.588	47%	0.47	S	S	*	.	H	α-helix	trans	-63.2	-43.9	174	-77.6	-64.2	0	0	0	112	Q381 F382 E383 N388 I389	Q381-Y385 HydrophobicContact CB-CE2 4.38Å; Q381-Y385 WeakPolarHBondContact O-CD2 3.41Å; Q381-Y385 PolarHBondContact O-N 3.49Å; F382-Y385 WeakPolarHBondContact O-CB 3.34Å; F382-Y385 PolarHBondContact O-N 3.05Å; F382-Y385 VanDerWaalsContact O-N 3.15Å; E383-Y385 VanDerWaalsContact C-N 3.34Å; E383-Y385 PolarHBondContact O-N 2.95Å; Y385-N388 PolarHBondContact O-N 3.46Å; Y385-I389 WeakPolarHBondContact O-CG1 3.32Å; Y385-I389 PolarHBondContact O-N 3.14Å
386	L	79.3	Confident	79.5	Confident	52 Å²	52	96.7 Å²	96.7	27%	0.272	48%	0.477	S	S	.	.	H	α-helix	trans	-61.1	-45.5	176.7	-70.9	176.3	0	0	0	111.7	F382 E383 N388 I389 V390	F382-L386 HydrophobicContact CD1-CD1 3.9Å; F382-L386 HydrophobicContact CD1-CG 4.3Å; F382-L386 HydrophobicContact CE1-CD1 3.61Å; F382-L386 HydrophobicContact CE1-CD2 4.38Å; F382-L386 HydrophobicContact CE1-CG 4.04Å; F382-L386 HydrophobicContact CZ-CD1 4.38Å; F382-L386 HydrophobicContact CZ-CD2 4.35Å; F382-L386 HydrophobicContact CZ-CG 4.41Å; F382-L386 WeakPolarHBondContact O-CG 3.33Å; F382-L386 PolarHBondContact O-N 3.24Å; E383-L386 PolarHBondContact O-N 3.42Å; L386-N388 VanDerWaalsContact C-N 3.3Å; L386-N388 PolarHBondContact O-N 3.24Å; L386-I389 PolarHBondContact O-N 2.86Å; L386-V390 WeakPolarHBondContact O-CG2 3.25Å; L386-V390 PolarHBondContact O-N 2.82Å
387	N	81.5	Confident	79.9	Confident	107 Å²	107	97.7 Å²	97.7	57%	0.572	49%	0.491	S	S	*	.	H	α-helix	trans	-60.5	-39.1	176.6	-73.7	-27.1	0	0	0	112.3	E383 N384 V390 K391	E383-N387 PolarHBondContact O-N 2.85Å; E383-N387 PolarHBondContact O-ND2 3.02Å; N384-N387 PolarHBondContact O-N 3.36Å; N387-V390 PolarHBondContact O-N 2.85Å; N387-K391 PolarHBondContact O-N 3.5Å; N387-K391 VanDerWaalsContact O-N 3.1Å
388	N	83	Confident	80.5	Confident	75 Å²	75	97.6 Å²	97.6	40%	0.401	50%	0.496	S	S	.	.	H	α-helix	trans	-66.9	-41.1	175.5	-72.2	-27.3	0	0	0	112.2	N384 Y385 L386 V390 K391 Y392	N384-N388 VanDerWaalsContact O-CG 3.26Å; N384-N388 PolarHBondContact O-N 3.17Å; N384-N388 PolarHBondContact O-ND2 2.94Å; Y385-N388 PolarHBondContact O-N 3.46Å; L386-N388 VanDerWaalsContact C-N 3.3Å; L386-N388 PolarHBondContact O-N 3.24Å; N388-V390 VanDerWaalsContact C-N 3.34Å; N388-V390 PolarHBondContact O-N 3.28Å; N388-K391 WeakPolarHBondContact O-CB 3.36Å; N388-K391 PolarHBondContact O-N 3.42Å; N388-Y392 HydrophobicContact CB-CD2 4.41Å; N388-Y392 HydrophobicContact CB-CE2 4.1Å; N388-Y392 WeakPolarHBondContact O-CD2 3.12Å; N388-Y392 PolarHBondContact O-N 2.76Å
389	I	83.9	Confident	81	Confident	103 Å²	103	96.4 Å²	96.4	53%	0.528	49%	0.493	S	S	.	.	H	α-helix	trans	-61	-43.8	176.9	-69.8	166.3	0	0	0	110.8	Y385 L386 K391 Y392 G393	Y385-I389 WeakPolarHBondContact O-CG1 3.32Å; Y385-I389 PolarHBondContact O-N 3.14Å; L386-I389 PolarHBondContact O-N 2.86Å; I389-K391 VanDerWaalsContact C-N 3.34Å; I389-K391 PolarHBondContact O-N 3.42Å; I389-Y392 PolarHBondContact O-N 3.19Å; I389-G393 PolarHBondContact O-N 2.94Å
390	V	82	Confident	81.6	Confident	89 Å²	89	100 Å²	100	54%	0.539	50%	0.504	S	S	.	.	H	α-helix	trans	-60.3	-44.8	176	173.6	0	0	0	0	110.8	L386 N387 N388 G393 H394	L386-V390 WeakPolarHBondContact O-CG2 3.25Å; L386-V390 PolarHBondContact O-N 2.82Å; N387-V390 PolarHBondContact O-N 2.85Å; N388-V390 VanDerWaalsContact C-N 3.34Å; N388-V390 PolarHBondContact O-N 3.28Å; V390-G393 PolarHBondContact O-N 3.04Å; V390-H394 PolarHBondContact O-CD2 2.81Å; V390-H394 VanDerWaalsContact O-CD2 3.24Å; V390-H394 PolarHBondContact O-N 3.37Å; V390-H394 VanDerWaalsContact O-N 3.16Å
391	K	82.7	Confident	82.3	Confident	125 Å²	125	102.6 Å²	102.6	54%	0.543	51%	0.512	S	S	.	.	H	α-helix	trans	-60.8	-46.8	176.3	-175.2	-178.7	174.1	-172.8	0	112.4	N387 N388 I389 G393 H394 E395	N387-K391 PolarHBondContact O-N 3.5Å; N387-K391 VanDerWaalsContact O-N 3.1Å; N388-K391 WeakPolarHBondContact O-CB 3.36Å; N388-K391 PolarHBondContact O-N 3.42Å; I389-K391 VanDerWaalsContact C-N 3.34Å; I389-K391 PolarHBondContact O-N 3.42Å; K391-G393 VanDerWaalsContact C-N 3.29Å; K391-G393 PolarHBondContact O-N 3.21Å; K391-H394 PolarHBondContact O-N 3.3Å; K391-E395 WeakPolarHBondContact CE-OE1 3.21Å; K391-E395 PolarHBondContact O-N 3.44Å
392	Y	84	Confident	82.8	Confident	147 Å²	147	104.3 Å²	104.3	58%	0.576	52%	0.518	S	S	*	.	H	α-helix	trans	-63.6	-34.5	176.8	-70.2	-51.9	0	0	0	112.6	N388 I389 E395 L396	N388-Y392 HydrophobicContact CB-CD2 4.41Å; N388-Y392 HydrophobicContact CB-CE2 4.1Å; N388-Y392 WeakPolarHBondContact O-CD2 3.12Å; N388-Y392 PolarHBondContact O-N 2.76Å; I389-Y392 PolarHBondContact O-N 3.19Å; Y392-E395 PolarHBondContact O-N 2.82Å; Y392-L396 VanDerWaalsContact O-CB 3.32Å; Y392-L396 WeakPolarHBondContact O-CB 3.46Å; Y392-L396 PolarHBondContact O-N 3.1Å
393	G	81.4	Confident	83.2	Confident	36 Å²	36	103.1 Å²	103.1	37%	0.371	52%	0.516	S	S	.	.	H	α-helix	trans	-58.4	-47.5	172.6	0	0	0	0	0	112.1	I389 V390 K391 L396 S397	I389-G393 PolarHBondContact O-N 2.94Å; V390-G393 PolarHBondContact O-N 3.04Å; K391-G393 VanDerWaalsContact C-N 3.29Å; K391-G393 PolarHBondContact O-N 3.21Å; G393-L396 PolarHBondContact O-N 3.02Å; G393-S397 PolarHBondContact O-N 3.23Å; G393-S397 VanDerWaalsContact O-N 3.11Å; G393-S397 PolarHBondContact O-OG 3.49Å
394	H	84.7	Confident	83.7	Confident	128 Å²	128	102 Å²	102	59%	0.593	52%	0.516	S	S	*	.	H	α-helix	trans	-62.8	-46.2	175.9	-75.3	-68.1	0	0	0	112.9	V390 K391 L396 S397 E398	V390-H394 PolarHBondContact O-CD2 2.81Å; V390-H394 VanDerWaalsContact O-CD2 3.24Å; V390-H394 PolarHBondContact O-N 3.37Å; V390-H394 VanDerWaalsContact O-N 3.16Å; K391-H394 PolarHBondContact O-N 3.3Å; H394-L396 VanDerWaalsContact C-N 3.29Å; H394-L396 PolarHBondContact O-N 3.32Å; H394-S397 PolarHBondContact O-N 2.74Å; H394-E398 PolarHBondContact O-N 2.84Å
395	E	85.1	Confident	84.1	Confident	83 Å²	83	101.3 Å²	101.3	39%	0.388	51%	0.513	S	S	.	.	H	α-helix	trans	-61.4	-36.7	177.8	-70.9	175.9	-177.4	0	0	112.3	K391 Y392 T399	K391-E395 WeakPolarHBondContact CE-OE1 3.21Å; K391-E395 PolarHBondContact O-N 3.44Å; Y392-E395 PolarHBondContact O-N 2.82Å; E395-T399 WeakPolarHBondContact O-CB 3.46Å; E395-T399 PolarHBondContact O-N 3.26Å; E395-T399 PolarHBondContact O-OG1 2.88Å
396	L	86	Confident	84.5	Confident	124 Å²	124	99.5 Å²	99.5	65%	0.649	51%	0.509	S	S	*	.	H	α-helix	trans	-67.3	-44.7	177.2	-168.2	70.5	0	0	0	111.4	Y392 G393 H394 T399 E400	Y392-L396 VanDerWaalsContact O-CB 3.32Å; Y392-L396 WeakPolarHBondContact O-CB 3.46Å; Y392-L396 PolarHBondContact O-N 3.1Å; G393-L396 PolarHBondContact O-N 3.02Å; H394-L396 VanDerWaalsContact C-N 3.29Å; H394-L396 PolarHBondContact O-N 3.32Å; L396-T399 PolarHBondContact O-N 3.11Å; L396-E400 WeakPolarHBondContact O-CB 3.38Å; L396-E400 PolarHBondContact O-N 2.81Å
397	S	82.8	Confident	84.7	Confident	73 Å²	73	102.3 Å²	102.3	51%	0.51	52%	0.524	S	S	.	.	H	α-helix	trans	-62.8	-39.9	175.8	-64.3	0	0	0	0	112.8	G393 H394 T399 L401	G393-S397 PolarHBondContact O-N 3.23Å; G393-S397 VanDerWaalsContact O-N 3.11Å; G393-S397 PolarHBondContact O-OG 3.49Å; H394-S397 PolarHBondContact O-N 2.74Å; S397-T399 VanDerWaalsContact C-N 3.34Å; S397-L401 PolarHBondContact O-N 2.82Å; S397-L401 VanDerWaalsContact O-N 3.1Å
398	E	87.3	Confident	84.8	Confident	142 Å²	142	101.1 Å²	101.1	66%	0.664	52%	0.515	S	S	*	.	H	α-helix	trans	-64	-40.1	173.7	-74.7	-174.3	175.5	0	0	112.1	H394 L401 K402	H394-E398 PolarHBondContact O-N 2.84Å; E398-L401 PolarHBondContact O-N 2.99Å; E398-K402 WeakPolarHBondContact O-CB 3.26Å; E398-K402 PolarHBondContact O-N 2.74Å
399	T	86.6	Confident	85	Confident	71 Å²	71	102.5 Å²	102.5	44%	0.436	52%	0.522	S	S	.	.	H	α-helix	trans	-67.9	-41.6	178.8	-57.2	0	0	0	0	111.6	E395 L396 S397 K402 I403	E395-T399 WeakPolarHBondContact O-CB 3.46Å; E395-T399 PolarHBondContact O-N 3.26Å; E395-T399 PolarHBondContact O-OG1 2.88Å; L396-T399 PolarHBondContact O-N 3.11Å; S397-T399 VanDerWaalsContact C-N 3.34Å; T399-K402 PolarHBondContact O-N 3.34Å; T399-I403 HydrophobicContact CG2-CD1 3.91Å; T399-I403 HydrophobicContact CG2-CG1 4.43Å; T399-I403 WeakPolarHBondContact O-CG1 3.5Å; T399-I403 PolarHBondContact O-N 2.9Å
400	E	85.7	Confident	85.1	Confident	129 Å²	129	103.3 Å²	103.3	60%	0.603	52%	0.518	S	S	*	.	H	α-helix	trans	-58.2	-47.6	174.2	-177.3	-176.1	-172.7	0	0	111.4	L396 K402 I403 T404	L396-E400 WeakPolarHBondContact O-CB 3.38Å; L396-E400 PolarHBondContact O-N 2.81Å; E400-K402 VanDerWaalsContact C-N 3.33Å; E400-K402 PolarHBondContact O-N 3.07Å; E400-I403 PolarHBondContact O-N 2.91Å; E400-T404 WeakPolarHBondContact O-CB 3.25Å; E400-T404 PolarHBondContact O-N 2.92Å; E400-T404 PolarHBondContact O-OG1 2.78Å
401	L	87.5	Confident	85.1	Confident	110 Å²	110	100.8 Å²	100.8	58%	0.576	51%	0.507	S	S	*	.	H	α-helix	trans	-60	-43.4	176.6	-176	67.1	0	0	0	111.4	S397 E398 T404 N405	S397-L401 PolarHBondContact O-N 2.82Å; S397-L401 VanDerWaalsContact O-N 3.1Å; E398-L401 PolarHBondContact O-N 2.99Å; L401-T404 PolarHBondContact O-N 2.88Å; L401-N405 VanDerWaalsContact O-CG 3.32Å; L401-N405 PolarHBondContact O-N 3.19Å; L401-N405 PolarHBondContact O-ND2 3.42Å
402	K	88.3	Confident	85.2	Confident	140 Å²	140	99.4 Å²	99.4	61%	0.609	50%	0.503	S	S	*	.	H	α-helix	trans	-64.2	-44.9	178.9	-172.2	178.4	-179.6	179.8	0	112.5	E398 T399 E400 N405 Q406	E398-K402 WeakPolarHBondContact O-CB 3.26Å; E398-K402 PolarHBondContact O-N 2.74Å; T399-K402 PolarHBondContact O-N 3.34Å; E400-K402 VanDerWaalsContact C-N 3.33Å; E400-K402 PolarHBondContact O-N 3.07Å; K402-N405 PolarHBondContact O-N 2.93Å; K402-Q406 WeakPolarHBondContact O-CG 3.41Å; K402-Q406 PolarHBondContact O-N 3.12Å
403	I	85.4	Confident	85.3	Confident	82 Å²	82	96.8 Å²	96.8	42%	0.421	50%	0.496	S	S	.	.	H	α-helix	trans	-65.5	-42.1	178.1	-69.3	171	0	0	0	110.4	T399 E400 N405 Q406 I407	T399-I403 HydrophobicContact CG2-CD1 3.91Å; T399-I403 HydrophobicContact CG2-CG1 4.43Å; T399-I403 WeakPolarHBondContact O-CG1 3.5Å; T399-I403 PolarHBondContact O-N 2.9Å; E400-I403 PolarHBondContact O-N 2.91Å; I403-N405 VanDerWaalsContact C-N 3.34Å; I403-N405 PolarHBondContact O-N 3.24Å; I403-Q406 PolarHBondContact O-N 3.42Å; I403-I407 HydrophobicContact CG2-CD1 3.84Å; I403-I407 HydrophobicContact CG2-CG1 4.37Å; I403-I407 WeakPolarHBondContact O-CG1 3.28Å; I403-I407 PolarHBondContact O-N 3.5Å
404	T	84.1	Confident	85.4	Confident	78 Å²	78	98.5 Å²	98.5	48%	0.479	50%	0.496	S	S	.	.	H	α-helix	trans	-59.1	-45	177.5	-57.8	0	0	0	0	111.4	E400 L401 I407 Q408	E400-T404 WeakPolarHBondContact O-CB 3.25Å; E400-T404 PolarHBondContact O-N 2.92Å; E400-T404 PolarHBondContact O-OG1 2.78Å; L401-T404 PolarHBondContact O-N 2.88Å; T404-I407 PolarHBondContact O-N 3.49Å; T404-Q408 PolarHBondContact O-N 3.24Å; T404-Q408 VanDerWaalsContact O-N 3.08Å
405	N	86.5	Confident	85.5	Confident	84 Å²	84	99 Å²	99	45%	0.449	50%	0.496	S	S	.	.	H	α-helix	trans	-62.9	-42.3	175	-70.4	-22.6	0	0	0	112.3	L401 K402 I403 I407 Q408 D409	L401-N405 VanDerWaalsContact O-CG 3.32Å; L401-N405 PolarHBondContact O-N 3.19Å; L401-N405 PolarHBondContact O-ND2 3.42Å; K402-N405 PolarHBondContact O-N 2.93Å; I403-N405 VanDerWaalsContact C-N 3.34Å; I403-N405 PolarHBondContact O-N 3.24Å; N405-I407 PolarHBondContact O-N 3.3Å; N405-Q408 PolarHBondContact O-N 2.82Å; N405-D409 VanDerWaalsContact O-CG 3.31Å; N405-D409 PolarHBondContact O-N 3.18Å
406	Q	87	Confident	85.7	Confident	111 Å²	111	101.6 Å²	101.6	52%	0.519	51%	0.506	S	S	.	.	H	α-helix	trans	-63	-38.9	177.2	-74.7	179	-17.1	0	0	113.1	K402 I403 R410	K402-Q406 WeakPolarHBondContact O-CG 3.41Å; K402-Q406 PolarHBondContact O-N 3.12Å; I403-Q406 PolarHBondContact O-N 3.42Å; Q406-R410 WeakPolarHBondContact O-CB 3.42Å; Q406-R410 PolarHBondContact O-N 3.41Å
407	I	83.4	Confident	85.8	Confident	111 Å²	111	99.3 Å²	99.3	57%	0.569	49%	0.492	S	S	*	.	H	α-helix	trans	-64.3	-44.9	175.6	-69	168.9	0	0	0	110	I403 T404 N405 R410 A411	I403-I407 HydrophobicContact CG2-CD1 3.84Å; I403-I407 HydrophobicContact CG2-CG1 4.37Å; I403-I407 WeakPolarHBondContact O-CG1 3.28Å; I403-I407 PolarHBondContact O-N 3.5Å; T404-I407 PolarHBondContact O-N 3.49Å; N405-I407 PolarHBondContact O-N 3.3Å; I407-R410 PolarHBondContact O-N 3.23Å; I407-A411 WeakPolarHBondContact O-CB 3.35Å; I407-A411 PolarHBondContact O-N 3.48Å
408	Q	83	Confident	85.9	Confident	82 Å²	82	101 Å²	101	38%	0.383	50%	0.495	S	S	.	.	H	α-helix	trans	-61.6	-48.3	178.3	-175.9	62.8	21.7	0	0	111.6	T404 N405 R410 A411 E412	T404-Q408 PolarHBondContact O-N 3.24Å; T404-Q408 VanDerWaalsContact O-N 3.08Å; N405-Q408 PolarHBondContact O-N 2.82Å; Q408-R410 VanDerWaalsContact C-N 3.33Å; Q408-R410 PolarHBondContact O-N 2.83Å; Q408-A411 PolarHBondContact O-N 2.82Å; Q408-E412 PolarHBondContact NE2-OE1 3.34Å; Q408-E412 PolarHBondContact O-N 2.9Å
409	D	86.7	Confident	85.7	Confident	104 Å²	104	98 Å²	98	56%	0.556	48%	0.483	S	S	*	.	H	α-helix	trans	-60.1	-42.6	177.8	-71.1	-19.2	0	0	0	111.6	N405 E412 Q413	N405-D409 VanDerWaalsContact O-CG 3.31Å; N405-D409 PolarHBondContact O-N 3.18Å; D409-E412 PolarHBondContact O-N 3.48Å; D409-Q413 PolarHBondContact O-N 3.08Å
410	R	87.7	Confident	85.8	Confident	120 Å²	120	101.1 Å²	101.1	45%	0.453	49%	0.493	S	S	.	.	H	α-helix	trans	-68.1	-38.6	178.8	-173.4	60.2	178	152	6.6	112	Q406 I407 Q408 E412 Q413 L414	Q406-R410 WeakPolarHBondContact O-CB 3.42Å; Q406-R410 PolarHBondContact O-N 3.41Å; I407-R410 PolarHBondContact O-N 3.23Å; Q408-R410 VanDerWaalsContact C-N 3.33Å; Q408-R410 PolarHBondContact O-N 2.83Å; R410-E412 VanDerWaalsContact C-N 3.34Å; R410-Q413 PolarHBondContact O-N 3.04Å; R410-L414 HydrophobicContact CG-CD1 4.31Å; R410-L414 WeakPolarHBondContact O-CG 3.22Å; R410-L414 PolarHBondContact O-N 3.23Å
411	A	80.3	Confident	85.9	Confident	37 Å²	37	99.9 Å²	99.9	31%	0.306	49%	0.489	S	S	.	.	H	α-helix	trans	-62.4	-42.1	175.2	0	0	0	0	0	111.4	I407 Q408 L414 K415	I407-A411 WeakPolarHBondContact O-CB 3.35Å; I407-A411 PolarHBondContact O-N 3.48Å; Q408-A411 PolarHBondContact O-N 2.82Å; A411-L414 PolarHBondContact O-N 3.39Å; A411-K415 WeakPolarHBondContact O-CB 3.39Å; A411-K415 PolarHBondContact O-N 3.5Å
412	E	85.2	Confident	85.6	Confident	96 Å²	96	96.8 Å²	96.8	45%	0.449	48%	0.48	S	S	.	.	H	α-helix	trans	-65.6	-38.6	175.4	-73.2	-175.6	-169	0	0	112.9	Q408 D409 R410 K416	Q408-E412 PolarHBondContact NE2-OE1 3.34Å; Q408-E412 PolarHBondContact O-N 2.9Å; D409-E412 PolarHBondContact O-N 3.48Å; R410-E412 VanDerWaalsContact C-N 3.34Å; E412-K416 WeakPolarHBondContact O-CG 3.44Å; E412-K416 PolarHBondContact O-N 3.32Å; E412-K416 VanDerWaalsContact O-N 3.16Å
413	Q	86.8	Confident	85.5	Confident	91 Å²	91	94.7 Å²	94.7	43%	0.425	48%	0.475	S	S	.	.	H	α-helix	trans	-64.2	-48.7	175.5	-172.7	-174.1	-5	0	0	111.7	D409 R410 K415 K416 E417	D409-Q413 PolarHBondContact O-N 3.08Å; R410-Q413 PolarHBondContact O-N 3.04Å; Q413-K415 VanDerWaalsContact C-N 3.29Å; Q413-K415 PolarHBondContact O-N 2.87Å; Q413-K416 WeakPolarHBondContact O-CB 3.33Å; Q413-K416 PolarHBondContact O-N 2.96Å; Q413-K416 VanDerWaalsContact O-N 3.14Å; Q413-E417 PolarHBondContact NE2-OE1 2.75Å; Q413-E417 PolarHBondContact O-N 3.11Å
414	L	83.1	Confident	85.6	Confident	73 Å²	73	97.4 Å²	97.4	38%	0.382	48%	0.484	S	S	.	.	H	α-helix	trans	-61.5	-38.9	178.8	-74.5	171.2	0	0	0	111.6	R410 A411 K416 E417 I418	R410-L414 HydrophobicContact CG-CD1 4.31Å; R410-L414 WeakPolarHBondContact O-CG 3.22Å; R410-L414 PolarHBondContact O-N 3.23Å; A411-L414 PolarHBondContact O-N 3.39Å; L414-K416 VanDerWaalsContact C-N 3.35Å; L414-K416 PolarHBondContact O-N 3.33Å; L414-E417 PolarHBondContact O-N 3.4Å; L414-I418 VanDerWaalsContact O-CG1 3.3Å; L414-I418 WeakPolarHBondContact O-CG1 3.15Å; L414-I418 PolarHBondContact O-N 3.12Å
415	K	87.3	Confident	85.5	Confident	138 Å²	138	98.6 Å²	98.6	60%	0.6	49%	0.486	S	S	*	.	H	α-helix	trans	-57.9	-46.3	173.8	-175	-179.3	176.2	-175.8	0	111.7	A411 Q413 E417 I418 D419	A411-K415 WeakPolarHBondContact O-CB 3.39Å; A411-K415 PolarHBondContact O-N 3.5Å; Q413-K415 VanDerWaalsContact C-N 3.29Å; Q413-K415 PolarHBondContact O-N 2.87Å; K415-E417 VanDerWaalsContact C-N 3.35Å; K415-E417 PolarHBondContact O-N 2.67Å; K415-I418 PolarHBondContact O-N 3.15Å; K415-D419 WeakPolarHBondContact O-CB 3.49Å; K415-D419 VanDerWaalsContact O-CG 3.27Å; K415-D419 PolarHBondContact O-N 3.15Å
416	K	88.3	Confident	85.5	Confident	137 Å²	137	99.1 Å²	99.1	60%	0.596	49%	0.489	S	S	*	.	H	α-helix	trans	-61.3	-40.7	176.3	-73.2	173.3	-179.4	167.5	0	112.4	E412 Q413 L414 D419 Q420	E412-K416 WeakPolarHBondContact O-CG 3.44Å; E412-K416 PolarHBondContact O-N 3.32Å; E412-K416 VanDerWaalsContact O-N 3.16Å; Q413-K416 WeakPolarHBondContact O-CB 3.33Å; Q413-K416 PolarHBondContact O-N 2.96Å; Q413-K416 VanDerWaalsContact O-N 3.14Å; L414-K416 VanDerWaalsContact C-N 3.35Å; L414-K416 PolarHBondContact O-N 3.33Å; K416-D419 PolarHBondContact O-N 3.05Å; K416-Q420 VanDerWaalsContact O-CG 3.28Å; K416-Q420 WeakPolarHBondContact O-CG 3.47Å; K416-Q420 PolarHBondContact O-N 2.94Å
417	E	88.1	Confident	85.4	Confident	76 Å²	76	98.5 Å²	98.5	36%	0.355	49%	0.489	S	S	.	.	H	α-helix	trans	-67.1	-42.7	178.1	-70.9	173.8	-161.7	0	0	111.7	Q413 L414 K415 Q420 I421	Q413-E417 PolarHBondContact NE2-OE1 2.75Å; Q413-E417 PolarHBondContact O-N 3.11Å; L414-E417 PolarHBondContact O-N 3.4Å; K415-E417 VanDerWaalsContact C-N 3.35Å; K415-E417 PolarHBondContact O-N 2.67Å; E417-Q420 WeakPolarHBondContact O-CB 3.46Å; E417-Q420 PolarHBondContact O-N 2.89Å; E417-I421 WeakPolarHBondContact O-CG1 3.29Å; E417-I421 PolarHBondContact O-N 2.6Å
418	I	84.6	Confident	85.5	Confident	109 Å²	109	98 Å²	98	56%	0.559	48%	0.484	S	S	*	.	H	α-helix	trans	-61.4	-45.9	174.8	-69	167.3	0	0	0	110.6	L414 K415 Q420 I421 A422	L414-I418 VanDerWaalsContact O-CG1 3.3Å; L414-I418 WeakPolarHBondContact O-CG1 3.15Å; L414-I418 PolarHBondContact O-N 3.12Å; K415-I418 PolarHBondContact O-N 3.15Å; I418-Q420 VanDerWaalsContact C-N 3.28Å; I418-Q420 PolarHBondContact O-N 3.47Å; I418-I421 PolarHBondContact O-N 2.89Å; I418-A422 WeakPolarHBondContact O-CB 3.26Å; I418-A422 PolarHBondContact O-N 3.45Å
419	D	84.4	Confident	85.5	Confident	80 Å²	80	98.4 Å²	98.4	43%	0.428	49%	0.489	S	S	.	.	H	α-helix	trans	-61.2	-37.2	177.8	-72.6	-23.7	0	0	0	111.5	K415 K416 N423	K415-D419 WeakPolarHBondContact O-CB 3.49Å; K415-D419 VanDerWaalsContact O-CG 3.27Å; K415-D419 PolarHBondContact O-N 3.15Å; K416-D419 PolarHBondContact O-N 3.05Å; D419-N423 WeakPolarHBondContact O-CB 3.29Å; D419-N423 VanDerWaalsContact O-CG 3.28Å; D419-N423 PolarHBondContact O-N 3.49Å; D419-N423 PolarHBondContact O-ND2 3.19Å
420	Q	88.4	Confident	85.3	Confident	136 Å²	136	97.6 Å²	97.6	64%	0.636	49%	0.485	S	S	*	.	H	α-helix	trans	-65.9	-43.9	175.2	-75.3	173.6	5.2	0	0	112.6	K416 E417 I418 N423 K424	K416-Q420 VanDerWaalsContact O-CG 3.28Å; K416-Q420 WeakPolarHBondContact O-CG 3.47Å; K416-Q420 PolarHBondContact O-N 2.94Å; E417-Q420 WeakPolarHBondContact O-CB 3.46Å; E417-Q420 PolarHBondContact O-N 2.89Å; I418-Q420 VanDerWaalsContact C-N 3.28Å; I418-Q420 PolarHBondContact O-N 3.47Å; Q420-N423 PolarHBondContact O-N 3.4Å; Q420-K424 PolarHBondContact O-N 3.16Å
421	I	87.2	Confident	85.1	Confident	103 Å²	103	98.6 Å²	98.6	53%	0.528	49%	0.492	S	S	.	.	H	α-helix	trans	-65.8	-44.6	177.9	-66.2	168.6	0	0	0	110.4	E417 I418 N423 K424 L425	E417-I421 WeakPolarHBondContact O-CG1 3.29Å; E417-I421 PolarHBondContact O-N 2.6Å; I418-I421 PolarHBondContact O-N 2.89Å; I421-N423 VanDerWaalsContact C-N 3.34Å; I421-N423 PolarHBondContact O-N 3.34Å; I421-K424 WeakPolarHBondContact O-CB 3.3Å; I421-K424 PolarHBondContact O-N 3.4Å; I421-K424 VanDerWaalsContact O-N 3.12Å; I421-L425 HydrophobicContact CG2-CD1 4.05Å; I421-L425 HydrophobicContact CG2-CG 4.44Å; I421-L425 WeakPolarHBondContact O-CG 3.42Å; I421-L425 PolarHBondContact O-N 3.38Å
422	A	81	Confident	85.2	Confident	45 Å²	45	103 Å²	103	37%	0.372	51%	0.506	S	S	.	.	H	α-helix	trans	-57.8	-46.6	177.3	0	0	0	0	0	111.4	I418 K424 L425 L426	I418-A422 WeakPolarHBondContact O-CB 3.26Å; I418-A422 PolarHBondContact O-N 3.45Å; A422-K424 VanDerWaalsContact C-N 3.32Å; A422-K424 PolarHBondContact O-N 3.39Å; A422-L425 PolarHBondContact O-N 3.26Å; A422-L426 WeakPolarHBondContact O-CG 3.28Å; A422-L426 PolarHBondContact O-N 2.93Å
423	N	87.1	Confident	84.9	Confident	95 Å²	95	102.1 Å²	102.1	51%	0.508	50%	0.504	S	S	.	.	H	α-helix	trans	-63.4	-36.1	176.1	-75.6	-44	0	0	0	112.7	D419 Q420 I421 N427	D419-N423 WeakPolarHBondContact O-CB 3.29Å; D419-N423 VanDerWaalsContact O-CG 3.28Å; D419-N423 PolarHBondContact O-N 3.49Å; D419-N423 PolarHBondContact O-ND2 3.19Å; Q420-N423 PolarHBondContact O-N 3.4Å; I421-N423 VanDerWaalsContact C-N 3.34Å; I421-N423 PolarHBondContact O-N 3.34Å; N423-N427 WeakPolarHBondContact O-CB 3.43Å; N423-N427 VanDerWaalsContact O-CG 3.27Å; N423-N427 PolarHBondContact O-N 2.8Å; N423-N427 VanDerWaalsContact O-N 3.1Å; N423-N427 PolarHBondContact O-ND2 3.27Å
424	K	87.4	Confident	84.6	Confident	140 Å²	140	103 Å²	103	61%	0.609	51%	0.508	S	S	*	.	H	α-helix	trans	-66.7	-42.7	177	-171.1	179.7	178.4	-176.3	0	112	Q420 I421 A422 N427 Q428	Q420-K424 PolarHBondContact O-N 3.16Å; I421-K424 WeakPolarHBondContact O-CB 3.3Å; I421-K424 PolarHBondContact O-N 3.4Å; I421-K424 VanDerWaalsContact O-N 3.12Å; A422-K424 VanDerWaalsContact C-N 3.32Å; A422-K424 PolarHBondContact O-N 3.39Å; K424-N427 PolarHBondContact O-N 3.23Å; K424-Q428 WeakPolarHBondContact O-CG 3.48Å; K424-Q428 PolarHBondContact O-N 2.94Å; K424-Q428 VanDerWaalsContact O-N 3.12Å
425	L	83.1	Confident	84.5	Confident	102 Å²	102	104 Å²	104	53%	0.534	51%	0.514	S	S	.	.	H	α-helix	trans	-67.4	-42.1	177.8	-69.9	172	0	0	0	111.8	I421 A422 N427 Q428 L429	I421-L425 HydrophobicContact CG2-CD1 4.05Å; I421-L425 HydrophobicContact CG2-CG 4.44Å; I421-L425 WeakPolarHBondContact O-CG 3.42Å; I421-L425 PolarHBondContact O-N 3.38Å; A422-L425 PolarHBondContact O-N 3.26Å; L425-N427 VanDerWaalsContact C-N 3.34Å; L425-N427 PolarHBondContact O-N 2.66Å; L425-Q428 PolarHBondContact O-N 3.15Å; L425-Q428 VanDerWaalsContact O-N 3.15Å; L425-L429 PolarHBondContact O-N 3.29Å
426	L	85.1	Confident	83.9	Confident	96 Å²	96	103.5 Å²	103.5	50%	0.503	51%	0.514	S	S	.	.	H	α-helix	trans	-58.1	-46.6	174.4	-74.3	170.7	0	0	0	111.4	A422 Q428 L429 D430	A422-L426 WeakPolarHBondContact O-CG 3.28Å; A422-L426 PolarHBondContact O-N 2.93Å; L426-Q428 VanDerWaalsContact C-N 3.29Å; L426-Q428 PolarHBondContact O-N 2.94Å; L426-L429 PolarHBondContact O-N 3.1Å; L426-D430 PolarHBondContact O-N 3.28Å
427	N	86.1	Confident	83.3	Confident	98 Å²	98	102.2 Å²	102.2	52%	0.524	51%	0.511	S	S	.	.	H	α-helix	trans	-64.3	-28.8	176.8	-74.5	-39.2	0	0	0	113.9	N423 K424 L425 K431	N423-N427 WeakPolarHBondContact O-CB 3.43Å; N423-N427 VanDerWaalsContact O-CG 3.27Å; N423-N427 PolarHBondContact O-N 2.8Å; N423-N427 VanDerWaalsContact O-N 3.1Å; N423-N427 PolarHBondContact O-ND2 3.27Å; K424-N427 PolarHBondContact O-N 3.23Å; L425-N427 VanDerWaalsContact C-N 3.34Å; L425-N427 PolarHBondContact O-N 2.66Å; N427-K431 WeakPolarHBondContact O-CG 3.31Å; N427-K431 PolarHBondContact O-N 3.01Å
428	Q	85.6	Confident	82.8	Confident	99 Å²	99	104.7 Å²	104.7	46%	0.463	52%	0.521	S	S	.	.	H	α-helix	trans	-73.3	-44	174.4	-77.3	177.8	-37.6	0	0	111	K424 L425 L426 K431 E432	K424-Q428 WeakPolarHBondContact O-CG 3.48Å; K424-Q428 PolarHBondContact O-N 2.94Å; K424-Q428 VanDerWaalsContact O-N 3.12Å; L425-Q428 PolarHBondContact O-N 3.15Å; L425-Q428 VanDerWaalsContact O-N 3.15Å; L426-Q428 VanDerWaalsContact C-N 3.29Å; L426-Q428 PolarHBondContact O-N 2.94Å; Q428-K431 PolarHBondContact O-N 3.37Å; Q428-E432 PolarHBondContact O-N 3.42Å; Q428-E432 VanDerWaalsContact O-N 3.09Å
429	L	82.2	Confident	82.2	Confident	91 Å²	91	102.7 Å²	102.7	48%	0.476	52%	0.516	S	S	.	.	H	α-helix	trans	-62	-44.1	177.2	-175.8	64.4	0	0	0	111.7	L425 L426 K431 E432 I433	L425-L429 PolarHBondContact O-N 3.29Å; L426-L429 PolarHBondContact O-N 3.1Å; L429-K431 VanDerWaalsContact C-N 3.28Å; L429-K431 PolarHBondContact O-N 3.08Å; L429-E432 PolarHBondContact O-N 2.87Å; L429-I433 HydrophobicContact CD1-CD1 4.35Å; L429-I433 HydrophobicContact CG-CD1 3.96Å; L429-I433 VanDerWaalsContact O-CG1 3.31Å; L429-I433 WeakPolarHBondContact O-CG1 3.45Å; L429-I433 PolarHBondContact O-N 2.81Å
430	D	83.1	Confident	81.6	Confident	88 Å²	88	102.1 Å²	102.1	47%	0.471	51%	0.513	S	S	.	.	H	α-helix	trans	-59.4	-39	177.2	-73.3	-24	0	0	0	111.7	L426 E434	L426-D430 PolarHBondContact O-N 3.28Å; D430-E434 WeakPolarHBondContact O-CG 3.07Å; D430-E434 PolarHBondContact O-N 3.41Å
431	K	83.8	Confident	80.5	Confident	140 Å²	140	101 Å²	101	61%	0.609	51%	0.511	S	S	*	.	H	α-helix	trans	-67.7	-39.9	176.2	-75.2	177.6	-178.6	-177.8	0	113.2	N427 Q428 L429 E434 N435	N427-K431 WeakPolarHBondContact O-CG 3.31Å; N427-K431 PolarHBondContact O-N 3.01Å; Q428-K431 PolarHBondContact O-N 3.37Å; L429-K431 VanDerWaalsContact C-N 3.28Å; L429-K431 PolarHBondContact O-N 3.08Å; K431-E434 PolarHBondContact O-N 2.86Å; K431-N435 VanDerWaalsContact O-CG 3.25Å; K431-N435 PolarHBondContact O-N 3.03Å; K431-N435 VanDerWaalsContact O-N 3.12Å; K431-N435 PolarHBondContact O-ND2 3.37Å
432	E	80.9	Confident	79.5	Confident	129 Å²	129	103.8 Å²	103.8	60%	0.603	52%	0.521	S	S	*	.	H	α-helix	trans	-66.2	-43	176.4	-74.6	-177.2	-178	0	0	111.1	Q428 L429 E434 N435 E436	Q428-E432 PolarHBondContact O-N 3.42Å; Q428-E432 VanDerWaalsContact O-N 3.09Å; L429-E432 PolarHBondContact O-N 2.87Å; E432-E434 PolarHBondContact O-N 3.28Å; E432-N435 PolarHBondContact O-N 3.26Å; E432-E436 PolarHBondContact O-N 2.83Å
433	I	79.3	Confident	78.4	Confident	79 Å²	79	105.1 Å²	105.1	41%	0.405	53%	0.527	S	S	.	.	H	α-helix	trans	-58.8	-46.4	174.7	-68.4	169.7	0	0	0	110.7	L429 N435 E436 M437	L429-I433 HydrophobicContact CD1-CD1 4.35Å; L429-I433 HydrophobicContact CG-CD1 3.96Å; L429-I433 VanDerWaalsContact O-CG1 3.31Å; L429-I433 WeakPolarHBondContact O-CG1 3.45Å; L429-I433 PolarHBondContact O-N 2.81Å; I433-N435 VanDerWaalsContact C-N 3.31Å; I433-N435 PolarHBondContact O-N 3.48Å; I433-E436 PolarHBondContact O-N 3.03Å; I433-M437 HydrophobicContact CG2-CG 4.38Å; I433-M437 HydrophobicContact CG2-SD 4.06Å; I433-M437 WeakPolarHBondContact O-CB 3.24Å; I433-M437 VanDerWaalsContact O-CG 3.31Å; I433-M437 WeakPolarHBondContact O-CG 2.81Å; I433-M437 PolarHBondContact O-N 2.79Å
434	E	81.5	Confident	76.9	Confident	110 Å²	110	101.9 Å²	101.9	51%	0.514	51%	0.513	S	S	.	.	H	α-helix	trans	-60.9	-37.3	177	-80.1	-174	-173.8	0	0	113.2	D430 K431 E432 K438	D430-E434 WeakPolarHBondContact O-CG 3.07Å; D430-E434 PolarHBondContact O-N 3.41Å; K431-E434 PolarHBondContact O-N 2.86Å; E432-E434 PolarHBondContact O-N 3.28Å; E434-K438 WeakPolarHBondContact O-CG 3.33Å; E434-K438 PolarHBondContact O-N 3.49Å
435	N	80.3	Confident	75.5	Confident	94 Å²	94	98.8 Å²	98.8	50%	0.503	52%	0.521	S	S	.	.	H	α-helix	trans	-71.1	-41.2	179.4	-72.5	-23.3	0	0	0	112.2	K431 E432 I433 K438 S439	K431-N435 VanDerWaalsContact O-CG 3.25Å; K431-N435 PolarHBondContact O-N 3.03Å; K431-N435 VanDerWaalsContact O-N 3.12Å; K431-N435 PolarHBondContact O-ND2 3.37Å; E432-N435 PolarHBondContact O-N 3.26Å; I433-N435 VanDerWaalsContact C-N 3.31Å; I433-N435 PolarHBondContact O-N 3.48Å; N435-K438 PolarHBondContact O-N 3.47Å; N435-S439 PolarHBondContact O-N 3.09Å; N435-S439 VanDerWaalsContact O-N 3.13Å; N435-S439 PolarHBondContact O-OG 2.89Å
436	E	75.2	Confident	74.2	Confident	127 Å²	127	98.7 Å²	98.7	59%	0.593	53%	0.529	S	S	*	.	H	α-helix	trans	-64.5	-43.3	173.7	-73.5	-62.6	149.9	0	0	111.1	E432 I433 K438 S439 I440	E432-E436 PolarHBondContact O-N 2.83Å; I433-E436 PolarHBondContact O-N 3.03Å; E436-K438 PolarHBondContact O-N 3.31Å; E436-S439 WeakPolarHBondContact O-CB 3.2Å; E436-S439 PolarHBondContact O-N 3.45Å; E436-S439 VanDerWaalsContact O-N 3.1Å; E436-I440 WeakPolarHBondContact O-CG1 3.38Å; E436-I440 PolarHBondContact O-N 3.02Å
437	M	74.2	Confident	72.5	Confident	110 Å²	110	97 Å²	97	54%	0.542	52%	0.52	S	S	.	.	H	α-helix	trans	-59.5	-44	175.9	-75	-175.6	70.6	0	0	112.3	I433 S439 I440 D441	I433-M437 HydrophobicContact CG2-CG 4.38Å; I433-M437 HydrophobicContact CG2-SD 4.06Å; I433-M437 WeakPolarHBondContact O-CB 3.24Å; I433-M437 VanDerWaalsContact O-CG 3.31Å; I433-M437 WeakPolarHBondContact O-CG 2.81Å; I433-M437 PolarHBondContact O-N 2.79Å; M437-S439 VanDerWaalsContact C-N 3.28Å; M437-S439 PolarHBondContact O-N 2.92Å; M437-I440 PolarHBondContact O-N 3.3Å; M437-D441 PolarHBondContact O-N 3.34Å
438	K	77.8	Confident	71.1	Confident	128 Å²	128	95.9 Å²	95.9	56%	0.557	52%	0.519	S	S	*	.	H	α-helix	trans	-61.1	-36.1	174.7	-74.6	168.6	-173	158.7	0	112.6	E434 N435 E436 H442	E434-K438 WeakPolarHBondContact O-CG 3.33Å; E434-K438 PolarHBondContact O-N 3.49Å; N435-K438 PolarHBondContact O-N 3.47Å; E436-K438 PolarHBondContact O-N 3.31Å; K438-H442 PolarHBondContact O-N 3.43Å
439	S	73.3	Confident	69.7	Low	66 Å²	66	99.3 Å²	99.3	46%	0.462	54%	0.535	S	S	.	.	H	α-helix	trans	-70.5	-36.1	177.9	-58.8	0	0	0	0	112	N435 E436 M437 C443	N435-S439 PolarHBondContact O-N 3.09Å; N435-S439 VanDerWaalsContact O-N 3.13Å; N435-S439 PolarHBondContact O-OG 2.89Å; E436-S439 WeakPolarHBondContact O-CB 3.2Å; E436-S439 PolarHBondContact O-N 3.45Å; E436-S439 VanDerWaalsContact O-N 3.1Å; M437-S439 VanDerWaalsContact C-N 3.28Å; M437-S439 PolarHBondContact O-N 2.92Å; S439-C443 PolarHBondContact O-N 3.38Å; S439-C443 PolarHBondContact O-SG 2.85Å; S439-C443 VanDerWaalsContact O-SG 3.32Å
440	I	70.1	Confident	68.4	Low	69 Å²	69	102.6 Å²	102.6	35%	0.354	55%	0.548	S	S	.	.	H	α-helix	trans	-68.7	-46.1	174.3	-67.4	168.2	0	0	0	111	E436 M437 H442 C443 A444 F455	E436-I440 WeakPolarHBondContact O-CG1 3.38Å; E436-I440 PolarHBondContact O-N 3.02Å; M437-I440 PolarHBondContact O-N 3.3Å; I440-H442 VanDerWaalsContact C-N 3.27Å; I440-H442 PolarHBondContact O-N 3.4Å; I440-C443 WeakPolarHBondContact O-CB 3.3Å; I440-C443 PolarHBondContact O-N 2.81Å; I440-C443 VanDerWaalsContact O-N 3.07Å; I440-A444 PolarHBondContact O-N 2.77Å; I440-F455 HydrophobicContact CG2-CE1 3.69Å; I440-F455 HydrophobicContact CG2-CZ 4.1Å
441	D	67.2	Low	67.1	Low	113 Å²	113	101 Å²	101	60%	0.604	54%	0.541	S	S	*	.	H	α-helix	trans	-59.8	-37.5	178.3	-79.3	-16.7	0	0	0	112	M437 C443 A444 G445	M437-D441 PolarHBondContact O-N 3.34Å; D441-C443 VanDerWaalsContact C-N 3.35Å; D441-C443 PolarHBondContact O-N 2.86Å; D441-A444 PolarHBondContact O-N 3.45Å; D441-G445 PolarHBondContact O-N 2.84Å
442	H	66.2	Low	65.8	Low	160 Å²	160	98.3 Å²	98.3	74%	0.741	53%	0.532	S	S	*	.	H	α-helix	trans	-63.8	-39.5	175.1	-171.1	67.6	0	0	0	112.4	K438 I440	K438-H442 PolarHBondContact O-N 3.43Å; I440-H442 VanDerWaalsContact C-N 3.27Å; I440-H442 PolarHBondContact O-N 3.4Å
443	C	57.7	Low	64.7	Low	73 Å²	73	95.7 Å²	95.7	49%	0.493	53%	0.529	S	S	.	.	H	α-helix	trans	-69.2	-39.4	175.5	-65.6	0	0	0	0	111.8	S439 I440 D441 G445 S446 L447	S439-C443 PolarHBondContact O-N 3.38Å; S439-C443 PolarHBondContact O-SG 2.85Å; S439-C443 VanDerWaalsContact O-SG 3.32Å; I440-C443 WeakPolarHBondContact O-CB 3.3Å; I440-C443 PolarHBondContact O-N 2.81Å; I440-C443 VanDerWaalsContact O-N 3.07Å; D441-C443 VanDerWaalsContact C-N 3.35Å; D441-C443 PolarHBondContact O-N 2.86Å; C443-G445 VanDerWaalsContact C-N 3.26Å; C443-G445 PolarHBondContact O-N 3.32Å; C443-S446 PolarHBondContact O-N 3Å; C443-S446 PolarHBondContact O-OG 2.86Å; C443-L447 WeakPolarHBondContact O-CD1 3.11Å
444	A	54.2	Low	63.5	Low	27 Å²	27	95.3 Å²	95.3	22%	0.223	53%	0.532	C	S	.	.	H	α-helix	trans	-60.9	-29.3	-177.2	0	0	0	0	0	113.8	I440 D441 S446	I440-A444 PolarHBondContact O-N 2.77Å; D441-A444 PolarHBondContact O-N 3.45Å; A444-S446 PolarHBondContact O-N 3.46Å
445	G	57.7	Low	62.3	Low	75 Å²	75	93.1 Å²	93.1	77%	0.773	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-0.9	179.4	0	0	0	0	0	116.3	D441 C443	D441-G445 PolarHBondContact O-N 2.84Å; C443-G445 VanDerWaalsContact C-N 3.26Å; C443-G445 PolarHBondContact O-N 3.32Å
446	S	56.2	Low	61.4	Low	100 Å²	100	93.9 Å²	93.9	70%	0.699	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-126.6	10.9	-175.4	55.9	0	0	0	0	114.7	C443 A444	C443-S446 PolarHBondContact O-N 3Å; C443-S446 PolarHBondContact O-OG 2.86Å; A444-S446 PolarHBondContact O-N 3.46Å
447	L	50.8	Low	60.6	Low	60 Å²	60	94.1 Å²	94.1	31%	0.314	53%	0.526	S	S	.	.	S	Bend	trans	-102.6	134.2	-174.9	-81.2	140.5	0	0	0	112.5	C443 V451 F455	C443-L447 WeakPolarHBondContact O-CD1 3.11Å; L447-V451 HydrophobicContact CB-CB 4.3Å; L447-V451 HydrophobicContact CD2-CB 3.9Å; L447-V451 HydrophobicContact CD2-CG1 3.51Å; L447-V451 HydrophobicContact CD2-CG2 4.2Å; L447-F455 HydrophobicContact CD1-CE2 4.29Å
448	P	56	Low	59.9	Low	76 Å²	76	92.6 Å²	92.6	49%	0.494	52%	0.523	S	S	.	.			trans	-55.4	150.1	175.6	-23.3	32.1	0	0	0	113	E450 V451 L452	P448-E450 PolarHBondContact O-N 3.12Å; P448-V451 PolarHBondContact O-N 3.46Å; P448-L452 PolarHBondContact O-N 3.21Å
449	E	55.9	Low	59	Low	171 Å²	171	90 Å²	90	80%	0.799	52%	0.515	S	S	*	.	H	α-helix	trans	-51	-31.9	-177.1	-85.9	-175.2	158.4	0	0	114.1	V451 L452	E449-V451 VanDerWaalsContact C-N 3.26Å; E449-V451 PolarHBondContact O-N 3.42Å; E449-L452 PolarHBondContact O-N 2.7Å
450	E	54.3	Low	58.6	Low	160 Å²	160	94.4 Å²	94.4	75%	0.748	53%	0.526	S	S	*	.	H	α-helix	trans	-67	-26.6	178.1	-67.1	134.5	179.1	0	0	112.8	P448	P448-E450 PolarHBondContact O-N 3.12Å
451	V	56.5	Low	57.9	Low	54 Å²	54	97.7 Å²	97.7	33%	0.327	54%	0.54	S	S	.	.	H	α-helix	trans	-85.7	-26.8	178.4	-168.1	0	0	0	0	111.9	L447 P448 E449 S453 C454 F455	L447-V451 HydrophobicContact CB-CB 4.3Å; L447-V451 HydrophobicContact CD2-CB 3.9Å; L447-V451 HydrophobicContact CD2-CG1 3.51Å; L447-V451 HydrophobicContact CD2-CG2 4.2Å; P448-V451 PolarHBondContact O-N 3.46Å; E449-V451 VanDerWaalsContact C-N 3.26Å; E449-V451 PolarHBondContact O-N 3.42Å; V451-S453 VanDerWaalsContact C-N 3.29Å; V451-S453 PolarHBondContact O-N 3.14Å; V451-C454 PolarHBondContact O-N 3.12Å; V451-C454 VanDerWaalsContact O-N 3.14Å; V451-F455 PolarHBondContact O-N 3.35Å
452	L	57.1	Low	57.2	Low	83 Å²	83	97 Å²	97	44%	0.435	54%	0.536	S	S	.	.	H	α-helix	trans	-61.3	-37.1	174.5	-76.6	167.8	0	0	0	111.9	P448 E449 F455 D456	P448-L452 PolarHBondContact O-N 3.21Å; E449-L452 PolarHBondContact O-N 2.7Å; L452-F455 PolarHBondContact O-N 3.32Å; L452-D456 PolarHBondContact O-N 3.12Å
453	S	57.8	Low	56.9	Low	75 Å²	75	92.8 Å²	92.8	52%	0.524	52%	0.524	S	S	.	.	H	α-helix	trans	-61.1	-43	172.9	146.5	0	0	0	0	112.5	V451 Q457	V451-S453 VanDerWaalsContact C-N 3.29Å; V451-S453 PolarHBondContact O-N 3.14Å; S453-Q457 PolarHBondContact O-N 3.24Å
454	C	54.2	Low	57.1	Low	70 Å²	70	95.8 Å²	95.8	47%	0.473	53%	0.526	S	S	.	.	H	α-helix	trans	-70	-37	175.7	-72.1	0	0	0	0	111.9	V451 Q457 V458	V451-C454 PolarHBondContact O-N 3.12Å; V451-C454 VanDerWaalsContact O-N 3.14Å; C454-Q457 PolarHBondContact O-N 3.49Å; C454-V458 WeakPolarHBondContact O-CB 3.31Å; C454-V458 VanDerWaalsContact O-CG2 3.27Å; C454-V458 WeakPolarHBondContact O-CG2 3.34Å; C454-V458 PolarHBondContact O-N 2.97Å
455	F	55.4	Low	57.1	Low	65 Å²	65	98.8 Å²	98.8	29%	0.285	54%	0.538	S	S	.	.	H	α-helix	trans	-64	-40.7	176.9	-128.7	-83.5	0	0	0	111.8	I440 L447 V451 L452 Q457 V458 N459	I440-F455 HydrophobicContact CG2-CE1 3.69Å; I440-F455 HydrophobicContact CG2-CZ 4.1Å; L447-F455 HydrophobicContact CD1-CE2 4.29Å; V451-F455 PolarHBondContact O-N 3.35Å; L452-F455 PolarHBondContact O-N 3.32Å; F455-Q457 VanDerWaalsContact C-N 3.34Å; F455-Q457 PolarHBondContact O-N 3.35Å; F455-V458 PolarHBondContact O-N 3.24Å; F455-N459 WeakPolarHBondContact O-CB 3.5Å; F455-N459 PolarHBondContact O-N 2.88Å
456	D	60.6	Low	57.3	Low	109 Å²	109	96.7 Å²	96.7	58%	0.583	52%	0.516	S	S	*	.	H	α-helix	trans	-64.5	-37.6	174.8	-103.4	1.4	0	0	0	112.6	L452 K460	L452-D456 PolarHBondContact O-N 3.12Å; D456-K460 WeakPolarHBondContact O-CB 3.3Å; D456-K460 PolarHBondContact O-N 3.43Å
457	Q	59.4	Low	57.6	Low	132 Å²	132	98.5 Å²	98.5	62%	0.617	51%	0.513	S	S	*	.	H	α-helix	trans	-68.3	-41.2	175.4	-118.1	171.6	-7.8	0	0	111.9	S453 C454 F455 K460 Q461	S453-Q457 PolarHBondContact O-N 3.24Å; C454-Q457 PolarHBondContact O-N 3.49Å; F455-Q457 VanDerWaalsContact C-N 3.34Å; F455-Q457 PolarHBondContact O-N 3.35Å; Q457-K460 PolarHBondContact O-N 3.18Å; Q457-Q461 PolarHBondContact O-N 3.42Å
458	V	59.4	Low	58.3	Low	79 Å²	79	101 Å²	101	48%	0.479	52%	0.522	S	S	.	.	H	α-helix	trans	-67.7	-41.8	175.7	171.6	0	0	0	0	110.8	C454 F455 Q461 L462	C454-V458 WeakPolarHBondContact O-CB 3.31Å; C454-V458 VanDerWaalsContact O-CG2 3.27Å; C454-V458 WeakPolarHBondContact O-CG2 3.34Å; C454-V458 PolarHBondContact O-N 2.97Å; F455-V458 PolarHBondContact O-N 3.24Å; V458-Q461 PolarHBondContact O-N 3.47Å; V458-L462 HydrophobicContact CG1-CD1 3.64Å; V458-L462 HydrophobicContact CG1-CG 4.2Å; V458-L462 WeakPolarHBondContact O-CB 3.46Å; V458-L462 WeakPolarHBondContact O-CG 3.03Å; V458-L462 PolarHBondContact O-N 2.99Å
459	N	59.2	Low	58.5	Low	72 Å²	72	104.6 Å²	104.6	39%	0.385	53%	0.529	S	S	.	.	H	α-helix	trans	-64.7	-38.6	175	-92.3	-20.8	0	0	0	112.7	F455 L462 S463	F455-N459 WeakPolarHBondContact O-CB 3.5Å; F455-N459 PolarHBondContact O-N 2.88Å; N459-L462 PolarHBondContact O-N 3.48Å; N459-S463 WeakPolarHBondContact O-CB 3.47Å; N459-S463 PolarHBondContact O-N 3.39Å; N459-S463 PolarHBondContact O-OG 2.72Å
460	K	64.3	Low	58.6	Low	159 Å²	159	100.9 Å²	100.9	69%	0.691	51%	0.514	S	S	*	.	H	α-helix	trans	-64.4	-37.8	171.6	-88.2	177.1	176.8	166.7	0	112.6	D456 Q457 S463 Y464	D456-K460 WeakPolarHBondContact O-CB 3.3Å; D456-K460 PolarHBondContact O-N 3.43Å; Q457-K460 PolarHBondContact O-N 3.18Å; K460-S463 WeakPolarHBondContact CA-OG 3.38Å; K460-S463 PolarHBondContact O-OG 3.18Å; K460-S463 VanDerWaalsContact O-OG 3.05Å; K460-Y464 WeakPolarHBondContact O-CB 3.2Å; K460-Y464 PolarHBondContact O-N 2.99Å
461	Q	55.6	Low	58.9	Low	138 Å²	138	99.6 Å²	99.6	65%	0.645	51%	0.508	S	S	*	.	H	α-helix	trans	-73.9	-38.4	175.7	-75.2	-149.3	-10	0	0	112.9	Q457 V458 Y464 L465	Q457-Q461 PolarHBondContact O-N 3.42Å; V458-Q461 PolarHBondContact O-N 3.47Å; Q461-Y464 PolarHBondContact O-N 2.73Å; Q461-L465 WeakPolarHBondContact O-CB 3.33Å; Q461-L465 VanDerWaalsContact O-CG 3.31Å; Q461-L465 WeakPolarHBondContact O-CG 3.47Å; Q461-L465 PolarHBondContact O-N 3.29Å
462	L	52.3	Low	59	Low	100 Å²	100	103.7 Å²	103.7	52%	0.524	52%	0.519	S	S	.	.	H	α-helix	trans	-66.9	-42.2	177.3	-77	168.8	0	0	0	111.9	V458 N459 Y464 L465 G466	V458-L462 HydrophobicContact CG1-CD1 3.64Å; V458-L462 HydrophobicContact CG1-CG 4.2Å; V458-L462 WeakPolarHBondContact O-CB 3.46Å; V458-L462 WeakPolarHBondContact O-CG 3.03Å; V458-L462 PolarHBondContact O-N 2.99Å; N459-L462 PolarHBondContact O-N 3.48Å; L462-Y464 PolarHBondContact O-N 3.2Å; L462-L465 PolarHBondContact O-N 3.25Å; L462-G466 PolarHBondContact O-N 2.93Å
463	S	61.1	Low	58.6	Low	71 Å²	71	104.3 Å²	104.3	50%	0.497	52%	0.522	S	S	.	.	H	α-helix	trans	-63.8	-39.4	174.8	51.2	0	0	0	0	112.3	N459 K460 G466 Q467	N459-S463 WeakPolarHBondContact O-CB 3.47Å; N459-S463 PolarHBondContact O-N 3.39Å; N459-S463 PolarHBondContact O-OG 2.72Å; K460-S463 WeakPolarHBondContact CA-OG 3.38Å; K460-S463 PolarHBondContact O-OG 3.18Å; K460-S463 VanDerWaalsContact O-OG 3.05Å; S463-G466 PolarHBondContact O-N 2.62Å; S463-Q467 PolarHBondContact O-N 2.74Å
464	Y	61.4	Low	58.4	Low	135 Å²	135	107 Å²	107	53%	0.529	52%	0.524	S	S	.	.	H	α-helix	trans	-65.5	-39.8	173.1	-176	-103.8	0	0	0	112.7	K460 Q461 L462 K468	K460-Y464 WeakPolarHBondContact O-CB 3.2Å; K460-Y464 PolarHBondContact O-N 2.99Å; Q461-Y464 PolarHBondContact O-N 2.73Å; L462-Y464 PolarHBondContact O-N 3.2Å; Y464-K468 HydrophobicContact CD1-CD 4.28Å; Y464-K468 HydrophobicContact CE1-CD 3.62Å; Y464-K468 HydrophobicContact CE1-CG 4.42Å; Y464-K468 WeakPolarHBondContact O-CB 3.41Å; Y464-K468 PolarHBondContact O-N 2.96Å; Y464-K468 WeakPolarHBondContact OH-CE 3.47Å; Y464-K468 PolarHBondContact OH-NZ 3.32Å
465	L	54.7	Low	58.6	Low	91 Å²	91	106.3 Å²	106.3	48%	0.476	52%	0.523	S	S	.	.	H	α-helix	trans	-68.1	-37.6	175.1	-77.1	165.4	0	0	0	112.4	Q461 L462 K468 K469	Q461-L465 WeakPolarHBondContact O-CB 3.33Å; Q461-L465 VanDerWaalsContact O-CG 3.31Å; Q461-L465 WeakPolarHBondContact O-CG 3.47Å; Q461-L465 PolarHBondContact O-N 3.29Å; L462-L465 PolarHBondContact O-N 3.25Å; L465-K468 PolarHBondContact O-N 3.38Å; L465-K469 WeakPolarHBondContact O-CB 3.45Å; L465-K469 WeakPolarHBondContact O-CG 3.46Å; L465-K469 PolarHBondContact O-N 3.11Å
466	G	60.4	Low	58.5	Low	30 Å²	30	105.9 Å²	105.9	31%	0.309	52%	0.52	S	S	.	.	H	α-helix	trans	-63.2	-48.1	174.3	0	0	0	0	0	112	L462 S463 K469 I470	L462-G466 PolarHBondContact O-N 2.93Å; S463-G466 PolarHBondContact O-N 2.62Å; G466-K469 PolarHBondContact O-N 3.14Å; G466-I470 WeakPolarHBondContact O-CB 3.48Å; G466-I470 VanDerWaalsContact O-CG1 3.27Å; G466-I470 WeakPolarHBondContact O-CG1 3.4Å; G466-I470 PolarHBondContact O-N 2.68Å
467	Q	64.1	Low	57.8	Low	139 Å²	139	105.4 Å²	105.4	65%	0.65	52%	0.517	S	S	*	.	H	α-helix	trans	-63.8	-40.5	173.9	-88.5	-178.1	-12.7	0	0	112.6	S463 I470 E471	S463-Q467 PolarHBondContact O-N 2.74Å; Q467-I470 PolarHBondContact O-N 3.17Å; Q467-E471 VanDerWaalsContact O-CB 3.28Å; Q467-E471 WeakPolarHBondContact O-CB 3.46Å; Q467-E471 WeakPolarHBondContact O-CG 3.02Å; Q467-E471 PolarHBondContact O-N 3.47Å
468	K	64.7	Low	57.2	Low	113 Å²	113	107.2 Å²	107.2	49%	0.491	52%	0.522	S	S	.	.	H	α-helix	trans	-64.9	-38.1	174.8	-98.1	-174.4	166.5	171.7	0	112.8	Y464 L465 Y472	Y464-K468 HydrophobicContact CD1-CD 4.28Å; Y464-K468 HydrophobicContact CE1-CD 3.62Å; Y464-K468 HydrophobicContact CE1-CG 4.42Å; Y464-K468 WeakPolarHBondContact O-CB 3.41Å; Y464-K468 PolarHBondContact O-N 2.96Å; Y464-K468 WeakPolarHBondContact OH-CE 3.47Å; Y464-K468 PolarHBondContact OH-NZ 3.32Å; L465-K468 PolarHBondContact O-N 3.38Å; K468-Y472 WeakPolarHBondContact O-CB 3.31Å; K468-Y472 PolarHBondContact O-N 3.25Å
469	K	60	Low	56.3	Low	150 Å²	150	108.6 Å²	108.6	65%	0.652	53%	0.531	S	S	*	.	H	α-helix	trans	-65.5	-41.1	173.1	-82.1	-178.3	175.5	-178.1	0	111.3	L465 G466 L473	L465-K469 WeakPolarHBondContact O-CB 3.45Å; L465-K469 WeakPolarHBondContact O-CG 3.46Å; L465-K469 PolarHBondContact O-N 3.11Å; G466-K469 PolarHBondContact O-N 3.14Å; K469-L473 VanDerWaalsContact O-CB 3.27Å; K469-L473 WeakPolarHBondContact O-CB 3.43Å; K469-L473 WeakPolarHBondContact O-CD1 3.43Å; K469-L473 WeakPolarHBondContact O-CG 3.18Å; K469-L473 PolarHBondContact O-N 3.33Å
470	I	57.7	Low	55.2	Low	94 Å²	94	108.8 Å²	108.8	48%	0.482	53%	0.527	S	S	.	.	H	α-helix	trans	-68.7	-41.1	176.3	-68.7	167.3	0	0	0	111.7	G466 Q467 L473 K474	G466-I470 WeakPolarHBondContact O-CB 3.48Å; G466-I470 VanDerWaalsContact O-CG1 3.27Å; G466-I470 WeakPolarHBondContact O-CG1 3.4Å; G466-I470 PolarHBondContact O-N 2.68Å; Q467-I470 PolarHBondContact O-N 3.17Å; I470-L473 PolarHBondContact O-N 2.86Å; I470-K474 HydrophobicContact CG2-CD 4.17Å; I470-K474 HydrophobicContact CG2-CG 4.41Å; I470-K474 VanDerWaalsContact O-CB 3.26Å; I470-K474 WeakPolarHBondContact O-CB 3.49Å; I470-K474 VanDerWaalsContact O-CG 3.3Å; I470-K474 WeakPolarHBondContact O-CG 3.41Å; I470-K474 PolarHBondContact O-N 3.42Å
471	E	61.2	Low	53.7	Low	133 Å²	133	108.9 Å²	108.9	62%	0.621	53%	0.528	S	S	*	.	H	α-helix	trans	-65.8	-42.6	173.9	-83	-91.9	135.6	0	0	111.2	Q467 K474 A475	Q467-E471 VanDerWaalsContact O-CB 3.28Å; Q467-E471 WeakPolarHBondContact O-CB 3.46Å; Q467-E471 WeakPolarHBondContact O-CG 3.02Å; Q467-E471 PolarHBondContact O-N 3.47Å; E471-K474 PolarHBondContact O-N 3.37Å; E471-A475 WeakPolarHBondContact O-CB 3.39Å; E471-A475 PolarHBondContact O-N 3.13Å
472	Y	58.8	Low	53	Low	139 Å²	139	111.6 Å²	111.6	55%	0.545	54%	0.537	S	S	.	.	H	α-helix	trans	-63.3	-42.5	174.2	177.7	-99.7	0	0	0	111.6	K468 R476	K468-Y472 WeakPolarHBondContact O-CB 3.31Å; K468-Y472 PolarHBondContact O-N 3.25Å; Y472-R476 HydrophobicContact CE1-CG 4.48Å; Y472-R476 WeakPolarHBondContact O-CB 3.47Å; Y472-R476 PolarHBondContact O-N 3.26Å; Y472-R476 WeakPolarHBondContact OH-CD 3.5Å; Y472-R476 PolarHBondContact OH-NH1 2.88Å
473	L	49.4	Very low	52.3	Low	96 Å²	96	112.4 Å²	112.4	50%	0.503	55%	0.551	S	S	.	*	H	α-helix	trans	-65.5	-45.1	172.8	-84	160.4	0	0	0	111.5	K469 I470 A475 R476 I477	K469-L473 VanDerWaalsContact O-CB 3.27Å; K469-L473 WeakPolarHBondContact O-CB 3.43Å; K469-L473 WeakPolarHBondContact O-CD1 3.43Å; K469-L473 WeakPolarHBondContact O-CG 3.18Å; K469-L473 PolarHBondContact O-N 3.33Å; I470-L473 PolarHBondContact O-N 2.86Å; L473-A475 PolarHBondContact O-N 2.95Å; L473-R476 PolarHBondContact O-N 2.84Å; L473-I477 VanDerWaalsContact O-CB 3.26Å; L473-I477 WeakPolarHBondContact O-CB 3.29Å; L473-I477 WeakPolarHBondContact O-CD1 3.17Å; L473-I477 WeakPolarHBondContact O-CG1 3.25Å; L473-I477 PolarHBondContact O-N 2.82Å
474	K	52	Low	50.9	Low	132 Å²	132	113 Å²	113	57%	0.574	57%	0.569	S	S	*	*	H	α-helix	trans	-62.2	-40.9	175.6	-82.5	179.7	178.1	178.9	0	111.7	I470 E471 K478	I470-K474 HydrophobicContact CG2-CD 4.17Å; I470-K474 HydrophobicContact CG2-CG 4.41Å; I470-K474 VanDerWaalsContact O-CB 3.26Å; I470-K474 WeakPolarHBondContact O-CB 3.49Å; I470-K474 VanDerWaalsContact O-CG 3.3Å; I470-K474 WeakPolarHBondContact O-CG 3.41Å; I470-K474 PolarHBondContact O-N 3.42Å; E471-K474 PolarHBondContact O-N 3.37Å; K474-K478 VanDerWaalsContact O-CB 3.29Å; K474-K478 WeakPolarHBondContact O-CB 3.21Å; K474-K478 PolarHBondContact O-N 3.44Å
475	A	59.8	Low	49.3	Very low	55 Å²	55	109.4 Å²	109.4	46%	0.455	57%	0.572	S	S	.	*	H	α-helix	trans	-67.4	-42.2	176.6	0	0	0	0	0	111.2	E471 L473 K478 T479	E471-A475 WeakPolarHBondContact O-CB 3.39Å; E471-A475 PolarHBondContact O-N 3.13Å; L473-A475 PolarHBondContact O-N 2.95Å; A475-K478 PolarHBondContact O-N 3.09Å; A475-T479 PolarHBondContact O-N 2.82Å; A475-T479 PolarHBondContact O-OG1 3.06Å; A475-T479 VanDerWaalsContact O-OG1 3.09Å
476	R	52	Low	48.1	Very low	56 Å²	56	116.4 Å²	116.4	21%	0.211	59%	0.594	C	S	.	*	H	α-helix	trans	-64.5	-46.2	173.7	-87	177.5	69.6	143	8.3	111.9	Y472 L473 K478 T479 Y480 E517	Y472-R476 HydrophobicContact CE1-CG 4.48Å; Y472-R476 WeakPolarHBondContact O-CB 3.47Å; Y472-R476 PolarHBondContact O-N 3.26Å; Y472-R476 WeakPolarHBondContact OH-CD 3.5Å; Y472-R476 PolarHBondContact OH-NH1 2.88Å; L473-R476 PolarHBondContact O-N 2.84Å; R476-K478 VanDerWaalsContact C-N 3.34Å; R476-K478 PolarHBondContact O-N 2.77Å; R476-T479 VanDerWaalsContact C-OG1 3.29Å; R476-T479 VanDerWaalsContact CA-OG1 3.25Å; R476-T479 WeakPolarHBondContact CA-OG1 3.34Å; R476-T479 PolarHBondContact O-N 3.17Å; R476-T479 VanDerWaalsContact O-N 3.08Å; R476-T479 PolarHBondContact O-OG1 2.7Å; R476-Y480 HydrophobicContact CB-CE2 4.23Å; R476-Y480 PolarHBondContact NH2-OH 2.83Å; R476-Y480 WeakPolarHBondContact O-CD2 3.43Å; R476-Y480 VanDerWaalsContact O-CE2 3.27Å; R476-Y480 WeakPolarHBondContact O-CE2 3.42Å; R476-Y480 PolarHBondContact O-N 2.82Å; R476-E517 IonicContact CZ-OE1 3.93Å; R476-E517 IonicContact CZ-OE2 2.67Å; R476-E517 IonicContact NH1-OE1 3.83Å; R476-E517 PolarHBondContact NH1-OE1 3.41Å; R476-E517 IonicContact NH1-OE2 3.67Å; R476-E517 IonicContact NH2-OE1 2.75Å; R476-E517 PolarHBondContact NH2-OE1 2.91Å; R476-E517 IonicContact NH2-OE2 3.54Å; R476-E517 PolarHBondContact NH2-OE2 3.21Å
477	I	46.7	Very low	46.7	Very low	100 Å²	100	120.4 Å²	120.4	51%	0.513	62%	0.617	S	S	.	*	H	α-helix	trans	-62.6	-39.4	176	-67.1	164.1	0	0	0	111	L473 T479 Y480	L473-I477 VanDerWaalsContact O-CB 3.26Å; L473-I477 WeakPolarHBondContact O-CB 3.29Å; L473-I477 WeakPolarHBondContact O-CD1 3.17Å; L473-I477 WeakPolarHBondContact O-CG1 3.25Å; L473-I477 PolarHBondContact O-N 2.82Å; I477-T479 VanDerWaalsContact C-N 3.33Å; I477-T479 PolarHBondContact O-N 3.11Å; I477-Y480 PolarHBondContact O-N 3.21Å
478	K	46.3	Very low	44.9	Very low	169 Å²	169	124.2 Å²	124.2	74%	0.735	63%	0.627	S	S	*	*	H	α-helix	trans	-63.5	-34.9	171.9	-113.5	179.5	172.6	179.5	0	112.7	K474 A475 R476 Y480 F481	K474-K478 VanDerWaalsContact O-CB 3.29Å; K474-K478 WeakPolarHBondContact O-CB 3.21Å; K474-K478 PolarHBondContact O-N 3.44Å; A475-K478 PolarHBondContact O-N 3.09Å; R476-K478 VanDerWaalsContact C-N 3.34Å; R476-K478 PolarHBondContact O-N 2.77Å; K478-Y480 VanDerWaalsContact C-N 3.25Å; K478-Y480 PolarHBondContact O-N 2.93Å; K478-F481 PolarHBondContact O-N 3.18Å; K478-F481 VanDerWaalsContact O-O 3.04Å
479	T	40	Very low	43.2	Very low	108 Å²	108	124.5 Å²	124.5	66%	0.663	64%	0.642	S	S	*	*	H	α-helix	trans	-72.2	-16.7	175.8	42.2	0	0	0	0	113.8	A475 R476 I477 F481	A475-T479 PolarHBondContact O-N 2.82Å; A475-T479 PolarHBondContact O-OG1 3.06Å; A475-T479 VanDerWaalsContact O-OG1 3.09Å; R476-T479 VanDerWaalsContact C-OG1 3.29Å; R476-T479 VanDerWaalsContact CA-OG1 3.25Å; R476-T479 WeakPolarHBondContact CA-OG1 3.34Å; R476-T479 PolarHBondContact O-N 3.17Å; R476-T479 VanDerWaalsContact O-N 3.08Å; R476-T479 PolarHBondContact O-OG1 2.7Å; I477-T479 VanDerWaalsContact C-N 3.33Å; I477-T479 PolarHBondContact O-N 3.11Å; T479-F481 VanDerWaalsContact C-N 3.34Å
480	Y	36.2	Very low	41.8	Very low	76 Å²	76	125.3 Å²	125.3	30%	0.298	65%	0.649	S	S	.	*	T	Hydrogen-bonded Turn	trans	-86.7	-2.3	173.4	-65.2	-68.8	0	0	0	113.7	R476 I477 K478	R476-Y480 HydrophobicContact CB-CE2 4.23Å; R476-Y480 PolarHBondContact NH2-OH 2.83Å; R476-Y480 WeakPolarHBondContact O-CD2 3.43Å; R476-Y480 VanDerWaalsContact O-CE2 3.27Å; R476-Y480 WeakPolarHBondContact O-CE2 3.42Å; R476-Y480 PolarHBondContact O-N 2.82Å; I477-Y480 PolarHBondContact O-N 3.21Å; K478-Y480 VanDerWaalsContact C-N 3.25Å; K478-Y480 PolarHBondContact O-N 2.93Å
481	F	33.3	Very low	40.5	Very low	161 Å²	161	128.7 Å²	128.7	71%	0.706	67%	0.667	S	S	*	*			trans	-134.5	100.6	176.2	-77	-86	0	0	0	110.8	K478 T479	K478-F481 PolarHBondContact O-N 3.18Å; K478-F481 VanDerWaalsContact O-O 3.04Å; T479-F481 VanDerWaalsContact C-N 3.34Å
482	K	40.6	Very low	38.9	Very low	196 Å²	196	125.8 Å²	125.8	85%	0.852	67%	0.674	S	S	*	*			trans	-86.8	120.9	164.3	-90.4	-176.2	176.9	176.3	0	109.6	G484	K482-G484 PolarHBondContact O-N 2.79Å
483	S	37.6	Very low	37.5	Very low	117 Å²	117	126.6 Å²	126.6	82%	0.818	69%	0.686	S	S	*	*			trans	-62.4	119.6	161.5	48.8	0	0	0	0	108.9	G485	S483-G485 PolarHBondContact O-N 2.76Å; S483-G485 VanDerWaalsContact O-N 3.11Å
484	G	32.1	Very low	36.3	Very low	83 Å²	83	130 Å²	130	86%	0.856	70%	0.699	S	S	*	*			trans	-61	112.6	173	0	0	0	0	0	109.8	K482	K482-G484 PolarHBondContact O-N 2.79Å
485	G	28.1	Very low	35.1	Very low	59 Å²	59	128.8 Å²	128.8	61%	0.608	70%	0.703	S	S	*	*			trans	-98.4	102.7	-178.7	0	0	0	0	0	111.1	S483	S483-G485 PolarHBondContact O-N 2.76Å; S483-G485 VanDerWaalsContact O-N 3.11Å
486	Y	29.9	Very low	33.5	Very low	239 Å²	239	135.6 Å²	135.6	94%	0.937	72%	0.722	S	S	*	*			trans	-144.3	119.7	155.6	-74	-74.9	0	0	0	109.7
487	S	29.6	Very low	32.3	Very low	114 Å²	114	137.9 Å²	137.9	80%	0.797	75%	0.746	S	S	*	*			trans	-85.3	131.1	170.5	51.1	0	0	0	0	109.7
488	Y	26.8	Very low	31.4	Very low	218 Å²	218	142 Å²	142	86%	0.855	76%	0.761	S	S	*	*			trans	-67.9	126.6	173.6	-148.9	-97.3	0	0	0	109.5	E490	Y488-E490 HydrophobicContact CD1-CG 4.5Å; Y488-E490 HydrophobicContact CE1-CG 4.4Å
489	C	29.7	Very low	30.6	Very low	120 Å²	120	140.2 Å²	140.2	81%	0.811	76%	0.764	S	S	*	*			trans	-129.8	122	164.8	-105.7	0	0	0	0	108.6	D491	C489-D491 PolarHBondContact O-N 2.78Å
490	E	30.2	Very low	29.9	Very low	167 Å²	167	145.5 Å²	145.5	78%	0.78	78%	0.778	S	S	*	*			trans	-68.2	115.8	167.6	-65	170.3	152.7	0	0	107.7	Y488	Y488-E490 HydrophobicContact CD1-CG 4.5Å; Y488-E490 HydrophobicContact CE1-CG 4.4Å
491	D	29.5	Very low	29.6	Very low	164 Å²	164	149.4 Å²	149.4	88%	0.877	80%	0.804	S	S	*	*			trans	141.6	122.6	161.4	-71.7	-22.9	0	0	0	111	C489	C489-D491 PolarHBondContact O-N 2.78Å
492	G	28.8	Very low	29.6	Very low	73 Å²	73	146.7 Å²	146.7	75%	0.753	81%	0.805	S	S	*	*			trans	-81.3	175.2	-160.2	0	0	0	0	0	119.2
493	I	28.5	Very low	29.1	Very low	156 Å²	156	142 Å²	142	80%	0.8	80%	0.798	S	S	*	*			trans	78.8	112.4	155	-49.2	177.6	0	0	0	117.8
494	E	25.7	Very low	28.9	Very low	167 Å²	167	147.2 Å²	147.2	78%	0.78	80%	0.801	S	S	*	*				153.6	134.8	101.4	-128.3	167.8	-142.4	0	0	115.5
495	T	26	Very low	28.9	Very low	106 Å²	106	150.6 Å²	150.6	65%	0.65	80%	0.799	S	S	*	*			trans	85.6	117.6	152.6	70.5	0	0	0	0	123.1
496	K	25.5	Very low	29	Very low	199 Å²	199	154.3 Å²	154.3	87%	0.865	80%	0.798	S	S	*	*			trans	69.4	118.3	132.9	-67	173.3	-176.8	175.1	0	118.6
497	S	27.6	Very low	29	Very low	103 Å²	103	146 Å²	146	72%	0.72	79%	0.785	S	S	*	*			trans	118.8	108.8	150	179.7	0	0	0	0	115.4
498	K	28.2	Very low	29.2	Very low	187 Å²	187	145.7 Å²	145.7	81%	0.813	78%	0.783	S	S	*	*			trans	61.7	125.1	139.8	-66	179.4	175.9	179.4	0	119.3
499	T	29.2	Very low	29.6	Very low	132 Å²	132	141.6 Å²	141.6	81%	0.81	78%	0.775	S	S	*	*			trans	64.6	90.6	151.5	55.2	0	0	0	0	117.2	N501	T499-N501 PolarHBondContact O-N 3.46Å
500	F	24.7	Very low	29.9	Very low	219 Å²	219	142.1 Å²	142.1	96%	0.961	77%	0.765	S	S	*	*			trans	-70.7	114.4	153.2	-108.4	-100.3	0	0	0	108.6
501	N	29.4	Very low	30.2	Very low	157 Å²	157	138.6 Å²	138.6	84%	0.84	76%	0.759	S	S	*	*			trans	-135.2	100.2	166.3	-144.5	11	0	0	0	106.1	T499	T499-N501 PolarHBondContact O-N 3.46Å
502	S	33.5	Very low	30.5	Very low	104 Å²	104	138.8 Å²	138.8	73%	0.727	75%	0.754	S	S	*	*			trans	-78.7	139	167.7	44.9	0	0	0	0	108.4
503	S	31.6	Very low	30.9	Very low	99 Å²	99	141.2 Å²	141.2	69%	0.692	74%	0.744	S	S	*	*			cis	-177.3	110.8	-7.7	35.2	0	0	0	0	105.7
504	Y	31.7	Very low	31.4	Very low	225 Å²	225	137.6 Å²	137.6	88%	0.882	73%	0.726	S	S	*	*			trans	-90.6	117.2	167.1	-87.1	-96	0	0	0	108.4	F506	Y504-F506 VanDerWaalsContact C-N 3.33Å
505	L	32.4	Very low	31.9	Very low	155 Å²	155	134.8 Å²	134.8	81%	0.812	72%	0.72	S	S	*	*	S	Bend	trans	-89.4	4.7	179	-130.1	119.6	0	0	0	113.8
506	F	30.7	Very low	32.4	Very low	136 Å²	136	137 Å²	137	60%	0.596	72%	0.723	S	S	*	*	S	Bend	trans	-137.1	127.8	166.9	-65.8	-80.9	0	0	0	107.6	Y504	Y504-F506 VanDerWaalsContact C-N 3.33Å
507	G	30.4	Very low	33	Very low	65 Å²	65	132.5 Å²	132.5	67%	0.67	71%	0.705	S	S	*	*	P	Polyproline II helix	trans	-52	153.9	-174.6	0	0	0	0	0	114.1
508	S	32.8	Very low	33.4	Very low	107 Å²	107	136.1 Å²	136.1	75%	0.748	71%	0.708	S	S	*	*	P	Polyproline II helix	trans	-65.8	129.7	179.4	51.7	0	0	0	0	112.7
509	I	36.3	Very low	33.8	Very low	132 Å²	132	131.8 Å²	131.8	68%	0.677	70%	0.701	S	S	*	*	P	Polyproline II helix	trans	-86.8	116.8	166.4	-63.1	172	0	0	0	107.7	S511 I514	I509-S511 PolarHBondContact O-N 2.97Å; I509-S511 VanDerWaalsContact O-N 3.1Å; I509-I514 HydrophobicContact CG2-CD1 4.42Å
510	E	36	Very low	34.1	Very low	132 Å²	132	133.7 Å²	133.7	62%	0.617	70%	0.698	S	S	*	*			trans	-71.5	99.7	170.3	-75.4	-176.5	176.5	0	0	109.5	E512	E510-E512 PolarHBondContact O-N 3.03Å; E510-E512 VanDerWaalsContact O-N 3.17Å
511	S	35.2	Very low	34.5	Very low	92 Å²	92	130.5 Å²	130.5	64%	0.643	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.2	5.9	-174.8	52.3	0	0	0	0	115.5	I509	I509-S511 PolarHBondContact O-N 2.97Å; I509-S511 VanDerWaalsContact O-N 3.1Å
512	E	35.8	Very low	34.6	Very low	168 Å²	168	131.5 Å²	131.5	79%	0.785	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.2	2.5	-171.3	-75.4	172	174.1	0	0	114.8	E510	E510-E512 PolarHBondContact O-N 3.03Å; E510-E512 VanDerWaalsContact O-N 3.17Å
513	K	38	Very low	34.5	Very low	125 Å²	125	134.1 Å²	134.1	54%	0.543	70%	0.695	S	S	.	*	S	Bend	trans	-116.3	-2.2	175.5	-83.5	177.7	179.6	163.1	0	115.6
514	I	38.5	Very low	34.3	Very low	79 Å²	79	135 Å²	135	41%	0.405	70%	0.696	S	S	.	*	S	Bend	trans	-94.6	-15.8	-172.7	-64.9	174.3	0	0	0	112.4	I509 F518	I509-I514 HydrophobicContact CG2-CD1 4.42Å; I514-F518 HydrophobicContact CG2-CE2 4.46Å; I514-F518 VanDerWaalsContact O-CD2 3.25Å; I514-F518 WeakPolarHBondContact O-CD2 3.31Å
515	V	36.3	Very low	34.2	Very low	109 Å²	109	131.5 Å²	131.5	66%	0.661	69%	0.692	S	S	*	*	S	Bend	trans	-96.7	-24.2	-176.9	-178.7	0	0	0	0	113	S519	V515-S519 PolarHBondContact O-OG 3.47Å
516	E	36.2	Very low	33.9	Very low	151 Å²	151	135.4 Å²	135.4	71%	0.706	70%	0.697	S	S	*	*	S	Bend	trans	-86.2	-17.3	-177.2	-72.7	-169	146.4	0	0	115.2
517	E	37.9	Very low	33.8	Very low	106 Å²	106	133.9 Å²	133.9	50%	0.495	70%	0.702	S	S	.	*	S	Bend	trans	-97.6	-19.3	180	-91	175.1	157	0	0	114.3	R476 S519	R476-E517 IonicContact CZ-OE1 3.93Å; R476-E517 IonicContact CZ-OE2 2.67Å; R476-E517 IonicContact NH1-OE1 3.83Å; R476-E517 PolarHBondContact NH1-OE1 3.41Å; R476-E517 IonicContact NH1-OE2 3.67Å; R476-E517 IonicContact NH2-OE1 2.75Å; R476-E517 PolarHBondContact NH2-OE1 2.91Å; R476-E517 IonicContact NH2-OE2 3.54Å; R476-E517 PolarHBondContact NH2-OE2 3.21Å; E517-S519 VanDerWaalsContact C-N 3.26Å; E517-S519 PolarHBondContact O-N 3.39Å
518	F	36.6	Very low	33.8	Very low	178 Å²	178	137.9 Å²	137.9	78%	0.781	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.2	-3.9	174.8	-80.9	-88.8	0	0	0	113.6	I514	I514-F518 HydrophobicContact CG2-CE2 4.46Å; I514-F518 VanDerWaalsContact O-CD2 3.25Å; I514-F518 WeakPolarHBondContact O-CD2 3.31Å
519	S	37.6	Very low	33.6	Very low	96 Å²	96	139.7 Å²	139.7	67%	0.671	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.1	9.9	-175.2	-53.9	0	0	0	0	114.1	V515 E517	V515-S519 PolarHBondContact O-OG 3.47Å; E517-S519 VanDerWaalsContact C-N 3.26Å; E517-S519 PolarHBondContact O-N 3.39Å
520	K	34.6	Very low	33.2	Very low	173 Å²	173	141.9 Å²	141.9	75%	0.752	72%	0.721	S	S	*	*	S	Bend	trans	-123.4	5.6	-166.4	-81	-176.2	-179.7	169.7	0	117.7
521	N	33.4	Very low	32.9	Very low	152 Å²	152	143.9 Å²	143.9	81%	0.813	73%	0.73	S	S	*	*			trans	-138.3	133.5	176	-80	-35.3	0	0	0	113.6
522	E	31.3	Very low	32.6	Very low	178 Å²	178	147.7 Å²	147.7	83%	0.832	74%	0.738	S	S	*	*			trans	82.7	96.2	166.8	-59.9	-178.9	176.8	0	0	116.4
523	I	31.2	Very low	32.1	Very low	158 Å²	158	147.3 Å²	147.3	81%	0.81	74%	0.741	S	S	*	*				62.3	94.5	61.9	-51.4	172.6	0	0	0	112.4
524	V	28	Very low	31.6	Very low	118 Å²	118	149.5 Å²	149.5	72%	0.715	75%	0.753	S	S	*	*				148.6	100.7	127.8	179.2	0	0	0	0	110
525	N	28.5	Very low	30.9	Very low	151 Å²	151	151.2 Å²	151.2	81%	0.807	76%	0.763	S	S	*	*				-169	102	114.7	-111.3	-30.2	0	0	0	111
526	R	25.8	Very low	30.4	Very low	238 Å²	238	154.4 Å²	154.4	90%	0.898	77%	0.768	S	S	*	*			trans	-81.7	112.6	166.8	-88.7	-179.9	171.2	179.3	-2.4	108.8
527	S	30.4	Very low	29.7	Very low	103 Å²	103	154.9 Å²	154.9	72%	0.72	77%	0.774	S	S	*	*			trans	-179	78	147.2	44.9	0	0	0	0	108.2
528	T	30.2	Very low	29.1	Very low	149 Å²	149	158 Å²	158	91%	0.914	79%	0.789	S	S	*	*				-164.6	98.3	107	8	0	0	0	0	109.2
529	I	27.4	Very low	28.5	Very low	146 Å²	146	156.5 Å²	156.5	75%	0.749	79%	0.788	S	S	*	*			trans	-113.5	111	161.2	-67.6	173.3	0	0	0	105.2
530	H	27.3	Very low	27.8	Very low	178 Å²	178	156 Å²	156	82%	0.824	79%	0.785	S	S	*	*			trans	168.8	104.4	139.8	-96.4	-57.5	0	0	0	109.8
531	Q	30.3	Very low	27.4	Very low	174 Å²	174	154.3 Å²	154.3	81%	0.813	78%	0.784	S	S	*	*				-175	111	125.7	-99.3	164.8	9.1	0	0	110.5
532	Q	29.7	Very low	27	Very low	172 Å²	172	154 Å²	154	80%	0.804	78%	0.781	S	S	*	*			trans	62.9	99.4	138.7	-63.6	169.2	-19	0	0	117.6
533	N	25.6	Very low	26.7	Very low	160 Å²	160	154.7 Å²	154.7	86%	0.856	78%	0.777	S	S	*	*				-4.3	102.1	75	-75.7	-10.6	0	0	0	116.6
534	E	26.3	Very low	26.3	Very low	170 Å²	170	152.9 Å²	152.9	79%	0.794	77%	0.769	S	S	*	*				-178.3	141.8	124.2	-108.8	-169.3	174.8	0	0	113.5
535	L	25.1	Very low	26.2	Very low	116 Å²	116	155.1 Å²	155.1	61%	0.607	78%	0.777	S	S	*	*			trans	86.9	115.3	142.7	-65.3	157.2	0	0	0	121.7
536	K	24.1	Very low	25.9	Very low	176 Å²	176	152.5 Å²	152.5	77%	0.765	77%	0.768	S	S	*	*				72	116.7	127.6	-72	174.9	178.6	171.1	0	118.3
537	L	23.2	Very low	25.8	Very low	160 Å²	160	148.4 Å²	148.4	84%	0.838	76%	0.764	S	S	*	*				55.8	118.8	82.5	-98.6	159.7	0	0	0	113.3
538	E	23.5	Very low	25.6	Very low	171 Å²	171	152.2 Å²	152.2	80%	0.799	77%	0.77	S	S	*	*			trans	111.5	142.2	156.1	-60.8	-169.9	163	0	0	117.4
539	L	24.7	Very low	25.3	Very low	148 Å²	148	152.6 Å²	152.6	78%	0.775	77%	0.765	S	S	*	*			trans	89.5	83.9	165.6	-53.1	163.4	0	0	0	113.7
540	S	23.7	Very low	25.1	Very low	86 Å²	86	150.6 Å²	150.6	60%	0.601	76%	0.764	S	S	*	*				56.3	129.2	57.7	90.8	0	0	0	0	113.9
541	N	24.6	Very low	24.9	Very low	136 Å²	136	147.5 Å²	147.5	73%	0.727	76%	0.757	S	S	*	*			trans	81.8	125.5	174.7	-41.3	-43.2	0	0	0	112.4
542	I	25.6	Very low	24.6	Very low	147 Å²	147	142.2 Å²	142.2	75%	0.754	75%	0.75	S	S	*	*				-164	126.4	53.2	-78.5	177.3	0	0	0	110.1
543	Y	24.9	Very low	24.3	Very low	191 Å²	191	139 Å²	139	75%	0.749	74%	0.741	S	S	*	*			trans	51.8	114.1	137.3	-72.8	-109.3	0	0	0	120.2
544	L	24.1	Very low	24.6	Very low	121 Å²	121	134.7 Å²	134.7	63%	0.634	72%	0.719	S	S	*	*				76.4	108.6	77.6	-79.9	161.8	0	0	0	113.7	P546	L544-P546 HydrophobicContact CD2-CG 4.16Å
545	N	24.3	Very low	24.6	Very low	165 Å²	165	131 Å²	131	88%	0.882	71%	0.707	S	S	*	*				-156.8	105.7	120.1	-102.3	-13.5	0	0	0	109.8
546	P	23.9	Very low	24.7	Very low	95 Å²	95	126.1 Å²	126.1	62%	0.617	68%	0.683	S	S	*	*			trans	-94.2	92.8	166.2	32.3	-18.6	0	0	0	107.2	L544	L544-P546 HydrophobicContact CD2-CG 4.16Å
547	D	23.7	Very low	24.7	Very low	153 Å²	153	123.4 Å²	123.4	82%	0.818	68%	0.684	S	S	*	*			trans	178.9	69.2	165.7	-89.1	-25.1	0	0	0	109.4
548	Q	25.6	Very low	25.1	Very low	183 Å²	183	126.3 Å²	126.3	86%	0.855	68%	0.683	S	S	*	*			trans	-147.1	87.6	151.8	-78.8	-153.2	-18.8	0	0	109.1	S550	Q548-S550 VanDerWaalsContact C-N 3.31Å; Q548-S550 PolarHBondContact O-N 3.16Å; Q548-S550 VanDerWaalsContact O-N 3.11Å
549	I	23.3	Very low	25.4	Very low	156 Å²	156	121.6 Å²	121.6	80%	0.8	66%	0.662	S	S	*	*			trans	-66.6	94	155.8	-63.5	166.2	0	0	0	105.6	V551	I549-V551 HydrophobicContact CG2-CG2 3.73Å; I549-V551 PolarHBondContact O-N 2.96Å
550	S	23.8	Very low	25.5	Very low	104 Å²	104	121.5 Å²	121.5	73%	0.727	66%	0.661	S	S	*	*			trans	-91.9	91.8	163.9	58.4	0	0	0	0	108.4	Q548 G552	Q548-S550 VanDerWaalsContact C-N 3.31Å; Q548-S550 PolarHBondContact O-N 3.16Å; Q548-S550 VanDerWaalsContact O-N 3.11Å; S550-G552 PolarHBondContact O-N 3.22Å
551	V	23.3	Very low	25.6	Very low	113 Å²	113	126 Å²	126	69%	0.685	67%	0.672	S	S	*	*			trans	-65.7	93.7	159.2	-170.2	0	0	0	0	105.9	I549 V553	I549-V551 HydrophobicContact CG2-CG2 3.73Å; I549-V551 PolarHBondContact O-N 2.96Å; V551-V553 HydrophobicContact CG1-CG2 3.94Å; V551-V553 PolarHBondContact O-N 3.27Å
552	G	23.6	Very low	25.8	Very low	64 Å²	64	125.1 Å²	125.1	66%	0.66	67%	0.672	S	S	*	*			trans	-70.3	78.7	174.6	0	0	0	0	0	110.7	S550 N554	S550-G552 PolarHBondContact O-N 3.22Å; G552-N554 PolarHBondContact O-N 3.5Å
553	V	24.3	Very low	25.8	Very low	103 Å²	103	125.7 Å²	125.7	62%	0.624	68%	0.676	S	S	*	*			trans	-67.9	97.1	169.9	-173.7	0	0	0	0	107.7	V551 T555	V551-V553 HydrophobicContact CG1-CG2 3.94Å; V551-V553 PolarHBondContact O-N 3.27Å; V553-T555 VanDerWaalsContact C-N 3.27Å; V553-T555 HydrophobicContact CG1-CG2 4.12Å; V553-T555 PolarHBondContact O-N 2.8Å; V553-T555 VanDerWaalsContact O-N 3.08Å
554	N	30.3	Very low	25.8	Very low	71 Å²	71	121.6 Å²	121.6	38%	0.38	67%	0.671	S	S	.	*			trans	-78.4	79	166.9	-94.2	-34.9	0	0	0	109.3	G552 R659	G552-N554 PolarHBondContact O-N 3.5Å; N554-R659 VanDerWaalsContact CG-NH2 3.33Å; N554-R659 PolarHBondContact ND2-NH1 3.07Å; N554-R659 PolarHBondContact ND2-NH2 3.16Å; N554-R659 PolarHBondContact OD1-NH1 3.15Å; N554-R659 PolarHBondContact OD1-NH2 3.31Å
555	T	27.6	Very low	25.9	Very low	91 Å²	91	123.1 Å²	123.1	56%	0.558	68%	0.68	S	S	*	*			trans	-95.9	134	153.5	41.2	0	0	0	0	108.2	V553	V553-T555 VanDerWaalsContact C-N 3.27Å; V553-T555 HydrophobicContact CG1-CG2 4.12Å; V553-T555 PolarHBondContact O-N 2.8Å; V553-T555 VanDerWaalsContact O-N 3.08Å
556	S	27.6	Very low	26	Very low	15 Å²	15	126 Å²	126	11%	0.105	68%	0.68	C	S	.	*			trans	-58.8	141.6	-178.4	77.3	0	0	0	0	111.2	R558 E559	S556-R558 PolarHBondContact O-N 2.79Å; S556-E559 PolarHBondContact OG-OE2 2.92Å
557	P	24	Very low	26.2	Very low	118 Å²	118	130.8 Å²	130.8	77%	0.766	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.1	23.8	175.9	-20.4	32.5	0	0	0	115.6
558	R	30.3	Very low	26.3	Very low	221 Å²	221	132.2 Å²	132.2	83%	0.834	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-128.6	11.6	-179.2	-115.9	179.3	178.2	-179.1	-1.3	115.1	S556	S556-R558 PolarHBondContact O-N 2.79Å
559	E	29.2	Very low	26.4	Very low	73 Å²	73	131.2 Å²	131.2	34%	0.341	70%	0.696	S	S	.	*	S	Bend	trans	-123	6.2	178.9	-64.7	-176.5	120.7	0	0	113.9	S556 E561 R749	S556-E559 PolarHBondContact OG-OE2 2.92Å; E559-E561 VanDerWaalsContact C-N 3.32Å; E559-R749 IonicContact OE1-CZ 2.76Å; E559-R749 IonicContact OE1-NH1 3.28Å; E559-R749 PolarHBondContact OE1-NH1 2.9Å; E559-R749 IonicContact OE1-NH2 3.04Å; E559-R749 PolarHBondContact OE1-NH2 2.89Å; E559-R749 IonicContact OE2-NH1 2.86Å; E559-R749 PolarHBondContact OE2-NH1 3.13Å; E559-R749 VanDerWaalsContact OE2-NH1 3.14Å
560	L	27.4	Very low	26.6	Very low	145 Å²	145	130.5 Å²	130.5	76%	0.759	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.5	5.3	172.5	-117.3	94.1	0	0	0	114.3
561	E	26.9	Very low	26.8	Very low	180 Å²	180	135.6 Å²	135.6	84%	0.841	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.3	7.5	177.8	-76.7	-176.3	158.5	0	0	114.2	E559	E559-E561 VanDerWaalsContact C-N 3.32Å
562	T	27.9	Very low	27	Very low	119 Å²	119	139.3 Å²	139.3	73%	0.73	70%	0.7	S	S	*	*	S	Bend	trans	-128.7	12.8	178.4	24.9	0	0	0	0	115.1
563	L	25.4	Very low	27.3	Very low	158 Å²	158	142.5 Å²	142.5	83%	0.827	70%	0.702	S	S	*	*	S	Bend	trans	-114.1	7.9	172.9	-88.2	157.7	0	0	0	113.8
564	T	25.8	Very low	27.4	Very low	105 Å²	105	144.3 Å²	144.3	64%	0.644	71%	0.708	S	S	*	*	S	Bend	trans	-103.6	69.3	166.2	43.1	0	0	0	0	109
565	N	26.1	Very low	27.4	Very low	153 Å²	153	147.4 Å²	147.4	82%	0.818	73%	0.725	S	S	*	*	S	Bend	trans	176.1	42.3	162.4	-88.8	-21.6	0	0	0	113.2
566	Y	26.9	Very low	27.7	Very low	225 Å²	225	149.4 Å²	149.4	88%	0.882	73%	0.732	S	S	*	*			trans	-156.1	68.3	166.5	-93.1	-75.2	0	0	0	110.5
567	H	26.6	Very low	27.7	Very low	197 Å²	197	155.9 Å²	155.9	91%	0.912	77%	0.766	S	S	*	*			trans	-156.3	67.1	157.3	-89.1	-59.8	0	0	0	109.3
568	E	25.6	Very low	28	Very low	183 Å²	183	159 Å²	159	86%	0.855	77%	0.77	S	S	*	*			trans	-107.2	90.1	149.5	-75.2	-168.4	166.2	0	0	106.5
569	D	29.7	Very low	27.6	Very low	162 Å²	162	155.4 Å²	155.4	87%	0.866	77%	0.766	S	S	*	*			trans	-167	95	131.4	-97.7	-25.6	0	0	0	109.4
570	N	26.8	Very low	27.6	Very low	140 Å²	140	160.6 Å²	160.6	75%	0.749	79%	0.79	S	S	*	*			trans	-53.1	142.7	162.9	-69.1	-67.1	0	0	0	110.4
571	R	26.8	Very low	27.4	Very low	211 Å²	211	160.4 Å²	160.4	80%	0.796	79%	0.789	S	S	*	*				164.9	141.6	102.3	-83.8	172.4	-158.1	-170.3	5.7	112.4
572	Y	29	Very low	27.3	Very low	191 Å²	191	158.7 Å²	158.7	75%	0.749	79%	0.785	S	S	*	*			trans	77.3	125.5	164.6	-59.4	-73.6	0	0	0	116.2
573	N	29.9	Very low	27.2	Very low	131 Å²	131	159.4 Å²	159.4	70%	0.701	78%	0.784	S	S	*	*			cis	-161.8	121.4	1.5	-99.6	-31	0	0	0	104.3
574	N	26.8	Very low	27.2	Very low	142 Å²	142	156.4 Å²	156.4	76%	0.759	78%	0.777	S	S	*	*				57.5	129.8	82.2	-87.5	2.3	0	0	0	117
575	N	30.2	Very low	27.1	Very low	135 Å²	135	158.5 Å²	158.5	72%	0.722	78%	0.784	S	S	*	*			trans	103.8	115.8	163.9	-55.3	-2.4	0	0	0	113.5
576	D	33.1	Very low	27.2	Very low	134 Å²	134	157.3 Å²	157.3	72%	0.717	78%	0.778	S	S	*	*			cis	-156.9	125	12.3	-71	-48.8	0	0	0	107.3
577	N	27.1	Very low	27.1	Very low	151 Å²	151	157.1 Å²	157.1	81%	0.807	78%	0.775	S	S	*	*				46.5	103.6	89.6	-72.1	-20	0	0	0	115.1
578	E	30.1	Very low	27.1	Very low	183 Å²	183	157.6 Å²	157.6	86%	0.855	78%	0.775	S	S	*	*				-172.8	128.3	101.5	-101.4	-177.3	175.5	0	0	112.5
579	L	23.3	Very low	27.1	Very low	145 Å²	145	158.6 Å²	158.6	76%	0.759	78%	0.777	S	S	*	*			trans	-97.6	127.4	176.6	-146.3	109.8	0	0	0	106.8	L581	L579-L581 HydrophobicContact CD2-CD1 4.24Å
580	H	29.4	Very low	26.8	Very low	182 Å²	182	156.5 Å²	156.5	84%	0.843	77%	0.77	S	S	*	*			trans	-143.3	111.8	155.6	-94.4	-63.8	0	0	0	111.3
581	L	22.9	Very low	26.8	Very low	141 Å²	141	157.7 Å²	157.7	74%	0.738	78%	0.776	S	S	*	*			trans	-63.8	140.3	164.9	-68.1	131	0	0	0	110.6	L579	L579-L581 HydrophobicContact CD2-CD1 4.24Å
582	L	24.3	Very low	26.6	Very low	145 Å²	145	156.3 Å²	156.3	76%	0.759	78%	0.779	S	S	*	*				156.3	128.5	116.8	-83.4	159.3	0	0	0	112.4
583	N	24.8	Very low	26.5	Very low	133 Å²	133	152 Å²	152	71%	0.711	78%	0.777	S	S	*	*			trans	80.7	110.1	140.8	-65.5	-4.3	0	0	0	121.4
584	S	25.8	Very low	26.3	Very low	96 Å²	96	155.7 Å²	155.7	67%	0.671	79%	0.787	S	S	*	*				36.4	102.2	126.8	63.8	0	0	0	0	118
585	D	25.2	Very low	26.3	Very low	148 Å²	148	157.1 Å²	157.1	79%	0.791	79%	0.794	S	S	*	*				169.2	149.4	119.5	-92.4	-34	0	0	0	110.4
586	N	28.2	Very low	26.1	Very low	128 Å²	128	157.3 Å²	157.3	68%	0.684	80%	0.8	S	S	*	*			trans	98.4	88.4	164.3	-54.5	-47.9	0	0	0	118.5
587	R	24.8	Very low	25.8	Very low	222 Å²	222	157 Å²	157	84%	0.838	81%	0.808	S	S	*	*				37.2	116.5	108.7	-59.3	179.7	-146.6	-170.9	5.8	117
588	F	25.3	Very low	25.9	Very low	207 Å²	207	153.1 Å²	153.1	91%	0.908	80%	0.804	S	S	*	*			trans	27.1	110.7	142.2	-79.6	-90.2	0	0	0	117.4
589	K	25.2	Very low	25.8	Very low	203 Å²	203	152.5 Å²	152.5	88%	0.883	81%	0.807	S	S	*	*			trans	-151.1	122.6	139.4	-108.4	169.5	-170.8	-177.8	0	111.4
590	T	24.6	Very low	25.9	Very low	119 Å²	119	148.6 Å²	148.6	73%	0.73	80%	0.801	S	S	*	*			trans	-36	135	161.4	47.3	0	0	0	0	114.2	E592	T590-E592 PolarHBondContact O-N 3.03Å
591	N	25.3	Very low	25.8	Very low	164 Å²	164	150.6 Å²	150.6	88%	0.877	80%	0.803	S	S	*	*			trans	-86.4	82.1	160.5	-87.7	-17	0	0	0	109.7
592	E	24.3	Very low	26	Very low	182 Å²	182	149.8 Å²	149.8	85%	0.85	80%	0.804	S	S	*	*			trans	-109.1	101	146	-80.9	-171.4	163.5	0	0	106.6	T590	T590-E592 PolarHBondContact O-N 3.03Å
593	S	26.6	Very low	26.2	Very low	101 Å²	101	147.9 Å²	147.9	71%	0.706	80%	0.803	S	S	*	*			trans	-169.5	75	159.8	60.9	0	0	0	0	111.3
594	F	25.8	Very low	26.5	Very low	208 Å²	208	147.6 Å²	147.6	91%	0.912	80%	0.801	S	S	*	*	S	Bend	trans	-111.6	138.4	137.9	-103	-95.4	0	0	0	105.6
595	L	26	Very low	26.7	Very low	173 Å²	173	149.8 Å²	149.8	91%	0.906	81%	0.805	S	S	*	*			trans	98.8	80.5	-177.2	-51.7	172	0	0	0	115.4
596	T	26	Very low	27	Very low	139 Å²	139	147 Å²	147	85%	0.853	80%	0.803	S	S	*	*			trans	-102.7	113.9	149.9	50.1	0	0	0	0	108.9
597	S	27.1	Very low	27.2	Very low	126 Å²	126	148.4 Å²	148.4	88%	0.881	80%	0.803	S	S	*	*				155.6	122.8	128.5	65.5	0	0	0	0	111.4
598	G	28.1	Very low	27.6	Very low	70 Å²	70	143.4 Å²	143.4	72%	0.722	79%	0.789	S	S	*	*			trans	116.5	96.8	153.6	0	0	0	0	0	117.1
599	N	28.1	Very low	28	Very low	171 Å²	171	141.9 Å²	141.9	91%	0.914	78%	0.782	S	S	*	*			trans	64.2	113.5	140.7	-62	-12.5	0	0	0	121.1
600	G	25.4	Very low	28.4	Very low	63 Å²	63	135 Å²	135	65%	0.649	76%	0.76	S	S	*	*				102.8	127.5	115.2	0	0	0	0	0	118.2
601	Y	28.2	Very low	28.7	Very low	224 Å²	224	133.6 Å²	133.6	88%	0.878	75%	0.746	S	S	*	*			trans	88.7	84.5	156.2	-55.5	-76	0	0	0	118.9
602	T	26.7	Very low	29.1	Very low	123 Å²	123	129.5 Å²	129.5	76%	0.755	73%	0.726	S	S	*	*				11.3	141	126	57.1	0	0	0	0	120.6
603	S	28.3	Very low	29.6	Very low	106 Å²	106	128.5 Å²	128.5	74%	0.741	72%	0.719	S	S	*	*			trans	77.8	88.7	160.4	76.9	0	0	0	0	118
604	D	31.1	Very low	29.8	Very low	127 Å²	127	130 Å²	130	68%	0.679	72%	0.715	S	S	*	*			trans	-171.9	13.6	141.8	-96.8	-22.5	0	0	0	115.9	A606 K607	D604-A606 PolarHBondContact O-N 3.15Å; D604-K607 PolarHBondContact O-N 2.98Å
605	N	29.6	Very low	30.1	Very low	141 Å²	141	125.4 Å²	125.4	75%	0.754	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.1	7.6	-171.9	-80.4	-12.6	0	0	0	117
606	A	33.4	Very low	30.4	Very low	90 Å²	90	126 Å²	126	74%	0.744	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91	-23.6	174.2	0	0	0	0	0	113.3	D604	D604-A606 PolarHBondContact O-N 3.15Å
607	K	32.4	Very low	30.6	Very low	158 Å²	158	126 Å²	126	69%	0.687	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.8	-25.2	176.6	-76.7	179.3	176.7	175.2	0	113.3	D604 S610 M611	D604-K607 PolarHBondContact O-N 2.98Å; K607-S610 PolarHBondContact O-OG 3.44Å; K607-M611 PolarHBondContact O-N 3.32Å
608	H	32.4	Very low	30.8	Very low	116 Å²	116	127.4 Å²	127.4	54%	0.537	68%	0.675	S	S	.	*	H	α-helix	trans	-73.2	-27.8	176.6	-105.5	-52.9	0	0	0	113.7	V612	H608-V612 WeakPolarHBondContact O-CB 3.43Å; H608-V612 WeakPolarHBondContact O-CG2 3.49Å; H608-V612 PolarHBondContact O-N 3.5Å
609	K	33.3	Very low	31.1	Very low	175 Å²	175	132 Å²	132	76%	0.761	68%	0.676	S	S	*	*	H	α-helix	trans	-76.3	-25.2	177.5	-107.9	179.2	178.5	177.5	0	113.9
610	S	33.7	Very low	31.8	Very low	60 Å²	60	133.2 Å²	133.2	42%	0.42	67%	0.673	S	S	.	*	H	α-helix	trans	-82.3	-37.3	170.7	62.9	0	0	0	0	111.6	K607 V612 K613 E614	K607-S610 PolarHBondContact O-OG 3.44Å; S610-V612 PolarHBondContact O-N 3.01Å; S610-K613 PolarHBondContact O-N 3.26Å; S610-E614 PolarHBondContact O-N 3.2Å
611	M	30.8	Very low	33	Very low	89 Å²	89	132.4 Å²	132.4	44%	0.438	66%	0.657	S	S	.	*	H	α-helix	trans	-66.8	-33.9	174.9	-82.5	178.8	61.3	0	0	113.8	K607 E614 Q615	K607-M611 PolarHBondContact O-N 3.32Å; M611-E614 PolarHBondContact O-N 2.84Å; M611-Q615 VanDerWaalsContact O-CB 3.3Å; M611-Q615 WeakPolarHBondContact O-CB 3.25Å; M611-Q615 WeakPolarHBondContact O-CG 3.25Å; M611-Q615 PolarHBondContact O-N 2.82Å
612	V	34.9	Very low	34.9	Very low	77 Å²	77	125 Å²	125	47%	0.467	63%	0.631	S	S	.	*	H	α-helix	trans	-73.5	-29.8	176.3	173	0	0	0	0	111.8	H608 S610 Y616	H608-V612 WeakPolarHBondContact O-CB 3.43Å; H608-V612 WeakPolarHBondContact O-CG2 3.49Å; H608-V612 PolarHBondContact O-N 3.5Å; S610-V612 PolarHBondContact O-N 3.01Å; V612-Y616 WeakPolarHBondContact O-CB 3.29Å; V612-Y616 PolarHBondContact O-N 3.3Å; V612-Y616 VanDerWaalsContact O-N 3.15Å
613	K	33.3	Very low	37.6	Very low	162 Å²	162	119.2 Å²	119.2	70%	0.704	60%	0.595	S	S	*	*	H	α-helix	trans	-74.9	-31.8	172.3	-116.1	179.6	177.5	-176.1	0	112.5	S610 N617	S610-K613 PolarHBondContact O-N 3.26Å; K613-N617 PolarHBondContact O-N 2.81Å
614	E	31.2	Very low	40.5	Very low	131 Å²	131	116.6 Å²	116.6	61%	0.612	57%	0.574	S	S	*	*	H	α-helix	trans	-78.8	-31.8	174.1	-77.3	175.6	160.6	0	0	113	S610 M611 Q618	S610-E614 PolarHBondContact O-N 3.2Å; M611-E614 PolarHBondContact O-N 2.84Å; E614-Q618 PolarHBondContact O-N 2.84Å
615	Q	31.8	Very low	43.2	Very low	113 Å²	113	113.9 Å²	113.9	53%	0.528	56%	0.56	S	S	.	*	H	α-helix	trans	-74.5	-29.3	173.3	-79.8	180	-25	0	0	113.2	M611 Q618	M611-Q615 VanDerWaalsContact O-CB 3.3Å; M611-Q615 WeakPolarHBondContact O-CB 3.25Å; M611-Q615 WeakPolarHBondContact O-CG 3.25Å; M611-Q615 PolarHBondContact O-N 2.82Å; Q615-Q618 PolarHBondContact O-N 3.19Å
616	Y	33.2	Very low	46.1	Very low	185 Å²	185	110.8 Å²	110.8	73%	0.725	54%	0.541	S	S	*	.	H	α-helix	trans	-72.5	-31.3	172.1	-119.1	-95	0	0	0	112.8	V612 Q618	V612-Y616 WeakPolarHBondContact O-CB 3.29Å; V612-Y616 PolarHBondContact O-N 3.3Å; V612-Y616 VanDerWaalsContact O-N 3.15Å; Y616-Q618 VanDerWaalsContact C-N 3.26Å; Y616-Q618 PolarHBondContact O-N 2.78Å
617	N	29.3	Very low	49	Very low	139 Å²	139	108.8 Å²	108.8	74%	0.743	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.8	-0.9	175.4	-79.3	-16.2	0	0	0	113.8	K613	K613-N617 PolarHBondContact O-N 2.81Å
618	Q	31	Very low	51.9	Low	155 Å²	155	105.5 Å²	105.5	72%	0.724	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.8	-8.6	178.4	-106.6	176.9	-4.2	0	0	114.2	E614 Q615 Y616 K620	E614-Q618 PolarHBondContact O-N 2.84Å; Q615-Q618 PolarHBondContact O-N 3.19Å; Y616-Q618 VanDerWaalsContact C-N 3.26Å; Y616-Q618 PolarHBondContact O-N 2.78Å; Q618-K620 PolarHBondContact O-N 3.15Å; Q618-K620 VanDerWaalsContact O-N 3.12Å
619	F	34.2	Very low	54.9	Low	168 Å²	168	101.1 Å²	101.1	74%	0.737	48%	0.484	S	S	*	.	S	Bend	trans	-79.7	92.3	163.5	-81.4	-84	0	0	0	108.5	C621	F619-C621 VanDerWaalsContact C-N 3.35Å; F619-C621 PolarHBondContact O-N 3.25Å
620	K	44.6	Very low	57.9	Low	195 Å²	195	95.5 Å²	95.5	85%	0.848	46%	0.463	S	S	*	.			trans	-56.8	98	177.7	-139	-178	-173.5	-170.7	0	109	Q618 Q622	Q618-K620 PolarHBondContact O-N 3.15Å; Q618-K620 VanDerWaalsContact O-N 3.12Å; K620-Q622 PolarHBondContact O-N 3.17Å
621	C	48.9	Very low	60.8	Low	47 Å²	47	92.7 Å²	92.7	32%	0.318	44%	0.443	S	S	.	.			trans	-45.5	122.3	170.3	-171.3	0	0	0	0	109.8	F619 V623 H925 M957	F619-C621 VanDerWaalsContact C-N 3.35Å; F619-C621 PolarHBondContact O-N 3.25Å; C621-V623 PolarHBondContact SG-O 3.34Å; C621-H925 PolarHBondContact SG-CE1 2.85Å; C621-H925 PolarHBondContact SG-NE2 2.82Å; C621-M957 HydrophobicContact CB-CE 4.17Å; C621-M957 VanDerWaalsContact O-CE 3.26Å; C621-M957 WeakPolarHBondContact O-CE 3.39Å
622	Q	69.7	Low	63.9	Low	69 Å²	69	94.9 Å²	94.9	32%	0.322	45%	0.446	S	S	.	.			trans	-90.1	-7.7	-171.9	-66	-171.7	7.3	0	0	113.6	K620 I919 M957	K620-Q622 PolarHBondContact O-N 3.17Å; Q622-I919 HydrophobicContact CB-CD1 4.41Å; Q622-M957 WeakPolarHBondContact O-CB 3.35Å; Q622-M957 PolarHBondContact O-N 3.48Å
623	V	83.6	Confident	66.6	Low	1 Å²	1	92.4 Å²	92.4	1%	0.006	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	164.5	-175.3	-56.5	0	0	0	0	110.6	C621 I919 A920 H925 I942 L954 K955	C621-V623 PolarHBondContact SG-O 3.34Å; V623-I919 HydrophobicContact CG1-CG2 3.75Å; V623-I919 HydrophobicContact CG2-CG2 4.22Å; V623-A920 HydrophobicContact CG2-CB 4.22Å; V623-H925 WeakPolarHBondContact CG2-NE2 3.3Å; V623-H925 PolarHBondContact O-NE2 2.91Å; V623-I942 HydrophobicContact CG1-CD1 3.97Å; V623-L954 HydrophobicContact CB-CB 4.16Å; V623-L954 HydrophobicContact CG2-CB 4.15Å; V623-L954 HydrophobicContact CG2-CD1 4.04Å; V623-K955 CarbonylContact C-O 3.47Å; V623-K955 WeakPolarHBondContact CA-O 3.06Å; V623-K955 WeakPolarHBondContact CB-O 3.28Å
624	T	87.6	Confident	69.3	Low	50 Å²	50	90.9 Å²	90.9	31%	0.307	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	146.4	171.6	54	0	0	0	0	109.4	E626 L954 K955 M957	T624-E626 PolarHBondContact O-N 2.9Å; T624-L954 CarbonylContact O-C 3.54Å; T624-L954 VanDerWaalsContact O-CA 3.28Å; T624-L954 WeakPolarHBondContact O-CA 3.34Å; T624-K955 PolarHBondContact N-O 2.84Å; T624-K955 PolarHBondContact O-N 3.05Å; T624-M957 HydrophobicContact CG2-CE 3.78Å; T624-M957 HydrophobicContact CG2-CG 4.18Å; T624-M957 HydrophobicContact CG2-SD 4.2Å
625	N	88.6	Confident	72.2	Confident	71 Å²	71	88.7 Å²	88.7	38%	0.38	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	118.8	173.2	-170.7	-7	0	0	0	108.9	L627 E628 V953 L954	N625-L627 PolarHBondContact OD1-N 2.98Å; N625-L627 PolarHBondContact OD1-O 3.4Å; N625-E628 PolarHBondContact ND2-OE2 2.8Å; N625-V953 PolarHBondContact OD1-O 3.39Å; N625-L954 HydrophobicContact CB-CD2 4.22Å
626	E	91.4	Very high	75	Confident	75 Å²	75	84.9 Å²	84.9	35%	0.35	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	-41.5	179.5	-178.8	173.6	-173	0	0	111.6	T624 R941 V953 K955	T624-E626 PolarHBondContact O-N 2.9Å; E626-R941 VanDerWaalsContact CD-NE 3.28Å; E626-R941 IonicContact OE1-CZ 3.91Å; E626-R941 VanDerWaalsContact OE1-CZ 3.26Å; E626-R941 IonicContact OE1-NE 2.76Å; E626-R941 PolarHBondContact OE1-NE 2.69Å; E626-R941 IonicContact OE1-NH2 2.86Å; E626-R941 PolarHBondContact OE1-NH2 3.38Å; E626-R941 WeakPolarHBondContact OE2-CD 3.26Å; E626-R941 WeakPolarHBondContact OE2-CG 3.5Å; E626-R941 IonicContact OE2-CZ 2.51Å; E626-R941 IonicContact OE2-NE 2.88Å; E626-R941 PolarHBondContact OE2-NE 2.81Å; E626-R941 IonicContact OE2-NH2 3.02Å; E626-V953 PolarHBondContact N-O 3.46Å; E626-K955 HydrophobicContact CB-CB 4.21Å
627	L	92.9	Very high	77.7	Confident	48 Å²	48	83.9 Å²	83.9	25%	0.251	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	143.3	-178.1	170.1	72.6	0	0	0	110	N625 F629 D670 V953	N625-L627 PolarHBondContact OD1-N 2.98Å; N625-L627 PolarHBondContact OD1-O 3.4Å; L627-F629 HydrophobicContact CD2-CD1 3.85Å; L627-F629 HydrophobicContact CD2-CE1 4.23Å; L627-F629 HydrophobicContact CG-CD1 4.07Å; L627-D670 VanDerWaalsContact CD2-O 3.27Å; L627-D670 WeakPolarHBondContact CD2-O 3.17Å; L627-V953 HydrophobicContact CB-CB 4.01Å; L627-V953 HydrophobicContact CB-CG2 4.16Å; L627-V953 HydrophobicContact CD2-CG2 4.1Å; L627-V953 HydrophobicContact CG-CG2 4.37Å; L627-V953 PolarHBondContact N-O 3.34Å; L627-V953 PolarHBondContact O-N 2.92Å
628	E	94.1	Very high	80.7	Confident	90 Å²	90	85.1 Å²	85.1	42%	0.421	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	130.7	169.6	-177.8	166.2	171.6	0	0	108.4	N625 V951 K952	N625-E628 PolarHBondContact ND2-OE2 2.8Å; E628-V951 WeakPolarHBondContact CA-O 3.39Å; E628-K952 HydrophobicContact CB-CG 4.39Å; E628-K952 HydrophobicContact CG-CG 3.93Å; E628-K952 VanDerWaalsContact OE1-CE 3.3Å; E628-K952 WeakPolarHBondContact OE1-CE 3.47Å; E628-K952 IonicContact OE1-NZ 3.55Å; E628-K952 PolarHBondContact OE1-NZ 3.38Å; E628-K952 WeakPolarHBondContact OE2-CE 3.44Å; E628-K952 IonicContact OE2-NZ 2.62Å; E628-K952 PolarHBondContact OE2-NZ 3.09Å
629	F	95.9	Very high	83.6	Confident	23 Å²	23	83 Å²	83	10%	0.101	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	162.2	177.2	67.2	-87.6	0	0	0	110.8	L627 I654 F667 V951 V953	L627-F629 HydrophobicContact CD2-CD1 3.85Å; L627-F629 HydrophobicContact CD2-CE1 4.23Å; L627-F629 HydrophobicContact CG-CD1 4.07Å; F629-I654 HydrophobicContact CE1-CD1 4.12Å; F629-I654 HydrophobicContact CZ-CD1 4.1Å; F629-F667 HydrophobicContact CD2-CD1 4.12Å; F629-F667 HydrophobicContact CD2-CE1 4.33Å; F629-F667 HydrophobicContact CE2-CB 4.14Å; F629-F667 AromaticContact CE2-CD1 3.66Å; F629-F667 HydrophobicContact CE2-CD1 3.66Å; F629-F667 HydrophobicContact CE2-CD2 4.07Å; F629-F667 HydrophobicContact CE2-CE1 4.06Å; F629-F667 HydrophobicContact CE2-CE2 4.42Å; F629-F667 AromaticContact CE2-CG 3.69Å; F629-F667 HydrophobicContact CE2-CG 3.69Å; F629-F667 HydrophobicContact CE2-CZ 4.43Å; F629-F667 HydrophobicContact CZ-CB 4.23Å; F629-F667 HydrophobicContact CZ-CG 4.23Å; F629-V951 HydrophobicContact CD1-CB 4.19Å; F629-V951 HydrophobicContact CD1-CG1 4.48Å; F629-V951 HydrophobicContact CD2-CB 4.23Å; F629-V951 HydrophobicContact CD2-CG2 4.44Å; F629-V951 HydrophobicContact CE1-CB 3.78Å; F629-V951 HydrophobicContact CE1-CG1 3.67Å; F629-V951 HydrophobicContact CE2-CB 3.81Å; F629-V951 HydrophobicContact CE2-CG1 4.27Å; F629-V951 HydrophobicContact CE2-CG2 3.86Å; F629-V951 HydrophobicContact CG-CB 4.41Å; F629-V951 HydrophobicContact CZ-CB 3.58Å; F629-V951 HydrophobicContact CZ-CG1 3.54Å; F629-V951 HydrophobicContact CZ-CG2 3.99Å; F629-V951 PolarHBondContact N-O 3.39Å; F629-V951 PolarHBondContact O-N 3.06Å; F629-V953 HydrophobicContact CE1-CG2 4.29Å
630	D	94.3	Very high	86.3	Confident	58 Å²	58	75 Å²	75	31%	0.31	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	126.8	-179	-170.8	-18.9	0	0	0	109.8	R632	D630-R632 VanDerWaalsContact CG-NE 3.29Å; D630-R632 PolarHBondContact O-N 3.09Å; D630-R632 VanDerWaalsContact OD1-CB 3.25Å; D630-R632 WeakPolarHBondContact OD1-CB 3.21Å; D630-R632 VanDerWaalsContact OD1-CG 3.31Å; D630-R632 WeakPolarHBondContact OD1-CG 3.3Å; D630-R632 IonicContact OD1-CZ 3.26Å; D630-R632 PolarHBondContact OD1-N 2.97Å; D630-R632 IonicContact OD1-NE 2.64Å; D630-R632 PolarHBondContact OD1-NE 3.28Å; D630-R632 IonicContact OD1-NH2 3.23Å; D630-R632 IonicContact OD2-CZ 3.59Å; D630-R632 IonicContact OD2-NE 3.76Å; D630-R632 PolarHBondContact OD2-NE 2.81Å; D630-R632 IonicContact OD2-NH2 2.8Å; D630-R632 PolarHBondContact OD2-NH2 2.81Å
631	A	95.1	Very high	88.7	Confident	0 Å²	0	68.9 Å²	68.9	0%	0	35%	0.351	C	S	.	.			trans	-78.9	0	179.1	0	0	0	0	0	113.5	V640 K665 F667 G949 V951	A631-V640 HydrophobicContact CB-CG1 4.24Å; A631-K665 VanDerWaalsContact O-CD 3.25Å; A631-K665 WeakPolarHBondContact O-CD 3.2Å; A631-K665 PolarHBondContact O-NZ 3.42Å; A631-F667 HydrophobicContact CB-CE2 4.12Å; A631-F667 HydrophobicContact CB-CZ 3.85Å; A631-G949 VanDerWaalsContact CB-O 3.22Å; A631-G949 WeakPolarHBondContact CB-O 3.38Å; A631-G949 PolarHBondContact N-O 3.11Å; A631-V951 HydrophobicContact CB-CG2 4.04Å
632	R	95.3	Very high	91	Very high	136 Å²	136	66.7 Å²	66.7	51%	0.513	34%	0.336	S	S	.	.			trans	-65.9	134.5	172.3	-75.7	176.9	-70.2	-167.1	-0.8	111.4	D630 D636 V640	D630-R632 VanDerWaalsContact CG-NE 3.29Å; D630-R632 PolarHBondContact O-N 3.09Å; D630-R632 VanDerWaalsContact OD1-CB 3.25Å; D630-R632 WeakPolarHBondContact OD1-CB 3.21Å; D630-R632 VanDerWaalsContact OD1-CG 3.31Å; D630-R632 WeakPolarHBondContact OD1-CG 3.3Å; D630-R632 IonicContact OD1-CZ 3.26Å; D630-R632 PolarHBondContact OD1-N 2.97Å; D630-R632 IonicContact OD1-NE 2.64Å; D630-R632 PolarHBondContact OD1-NE 3.28Å; D630-R632 IonicContact OD1-NH2 3.23Å; D630-R632 IonicContact OD2-CZ 3.59Å; D630-R632 IonicContact OD2-NE 3.76Å; D630-R632 PolarHBondContact OD2-NE 2.81Å; D630-R632 IonicContact OD2-NH2 2.8Å; D630-R632 PolarHBondContact OD2-NH2 2.81Å; R632-D636 VanDerWaalsContact CA-OD2 3.26Å; R632-D636 WeakPolarHBondContact CA-OD2 3.36Å; R632-V640 HydrophobicContact CB-CG2 4.33Å; R632-V640 HydrophobicContact CG-CB 4.35Å; R632-V640 HydrophobicContact CG-CG2 3.47Å; R632-V640 VanDerWaalsContact CG-CG2 3.47Å
633	V	92.5	Very high	92.2	Very high	25 Å²	25	63.5 Å²	63.5	15%	0.152	32%	0.321	C	S	.	.			trans	-126.2	161	171.7	-57.6	0	0	0	0	111	T635 D636 K665 F673	V633-T635 PolarHBondContact O-N 3.17Å; V633-D636 WeakPolarHBondContact CG2-OD1 3.4Å; V633-D636 PolarHBondContact N-OD1 3.36Å; V633-D636 PolarHBondContact N-OD2 3.34Å; V633-D636 WeakPolarHBondContact O-CB 3.34Å; V633-D636 PolarHBondContact O-N 3.07Å; V633-D636 VanDerWaalsContact O-OD1 3.11Å; V633-K665 HydrophobicContact CG2-CD 4.45Å; V633-F673 HydrophobicContact CG1-CB 4.19Å; V633-F673 HydrophobicContact CG1-CD1 4.07Å; V633-F673 HydrophobicContact CG1-CD2 3.54Å; V633-F673 HydrophobicContact CG1-CE1 4.31Å; V633-F673 HydrophobicContact CG1-CE2 3.81Å; V633-F673 HydrophobicContact CG1-CG 3.66Å; V633-F673 HydrophobicContact CG1-CZ 4.18Å; V633-F673 HydrophobicContact CG2-CE2 4.46Å; V633-F673 HydrophobicContact CG2-CZ 4.35Å
634	S	90.5	Very high	92.8	Very high	130 Å²	130	63.5 Å²	63.5	91%	0.909	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-14.5	-173.4	56.1	0	0	0	0	114.8
635	T	91.2	Very high	93.3	Very high	85 Å²	85	61.5 Å²	61.5	52%	0.521	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95	3.7	178.5	60.1	0	0	0	0	113.5	V633 R663	V633-T635 PolarHBondContact O-N 3.17Å; T635-R663 PolarHBondContact OG1-NH1 3.32Å
636	D	91.1	Very high	93.7	Very high	33 Å²	33	58.5 Å²	58.5	18%	0.176	29%	0.293	C	S	.	.			trans	-66.6	134	175.5	-60.9	4.7	0	0	0	111.2	R632 V633 V640 R663 K665	R632-D636 VanDerWaalsContact CA-OD2 3.26Å; R632-D636 WeakPolarHBondContact CA-OD2 3.36Å; V633-D636 WeakPolarHBondContact CG2-OD1 3.4Å; V633-D636 PolarHBondContact N-OD1 3.36Å; V633-D636 PolarHBondContact N-OD2 3.34Å; V633-D636 WeakPolarHBondContact O-CB 3.34Å; V633-D636 PolarHBondContact O-N 3.07Å; V633-D636 VanDerWaalsContact O-OD1 3.11Å; D636-V640 VanDerWaalsContact OD2-CG2 3.25Å; D636-V640 WeakPolarHBondContact OD2-CG2 3.31Å; D636-R663 VanDerWaalsContact CA-NH2 3.27Å; D636-R663 VanDerWaalsContact CG-NH2 3.28Å; D636-R663 IonicContact OD1-CZ 3.75Å; D636-R663 IonicContact OD1-NH1 3.06Å; D636-R663 IonicContact OD1-NH2 3.34Å; D636-R663 PolarHBondContact OD1-NH2 3.11Å; D636-K665 WeakPolarHBondContact OD1-CE 3.09Å; D636-K665 IonicContact OD1-NZ 3.57Å; D636-K665 PolarHBondContact OD1-NZ 2.89Å; D636-K665 IonicContact OD2-NZ 3.4Å; D636-K665 PolarHBondContact OD2-NZ 3.21Å
637	L	90.4	Very high	94	Very high	164 Å²	164	55.2 Å²	55.2	86%	0.859	28%	0.278	S	S	*	.	S	Bend	trans	-105.4	-15.2	175.9	-61	-179.8	0	0	0	112.1	N661	L637-N661 PolarHBondContact N-OD1 2.79Å
638	R	91.7	Very high	94.1	Very high	164 Å²	164	53.2 Å²	53.2	62%	0.619	27%	0.268	S	S	*	.	S	Bend	trans	-138.2	166.2	178.9	-61.8	-173.4	-176.3	167.7	-3	110	D660 N661	R638-D660 HydrophobicContact CB-CB 4.45Å; R638-D660 WeakPolarHBondContact CD-O 3.3Å; R638-N661 PolarHBondContact N-OD1 2.66Å; R638-N661 PolarHBondContact O-ND2 3.17Å; R638-N661 PolarHBondContact O-OD1 3.49Å
639	D	91.3	Very high	94	Very high	110 Å²	110	51.5 Å²	51.5	59%	0.588	26%	0.26	S	S	*	.			trans	-57.3	148.1	170.7	-67.5	-39.3	0	0	0	111	N661	D639-N661 PolarHBondContact O-ND2 3.02Å
640	V	92.6	Very high	93.7	Very high	1 Å²	1	54.2 Å²	54.2	1%	0.006	28%	0.282	C	S	.	.			trans	-77.9	127.7	-178.4	177.1	0	0	0	0	109.4	A631 R632 D636 P642 L948	A631-V640 HydrophobicContact CB-CG1 4.24Å; R632-V640 HydrophobicContact CB-CG2 4.33Å; R632-V640 HydrophobicContact CG-CB 4.35Å; R632-V640 HydrophobicContact CG-CG2 3.47Å; R632-V640 VanDerWaalsContact CG-CG2 3.47Å; D636-V640 VanDerWaalsContact OD2-CG2 3.25Å; D636-V640 WeakPolarHBondContact OD2-CG2 3.31Å; V640-P642 HydrophobicContact CG1-CB 4.4Å; V640-P642 WeakPolarHBondContact O-CD 3.43Å; V640-L948 CarbonylContact O-C 3.57Å; V640-L948 WeakPolarHBondContact O-CA 3.26Å
641	W	94.8	Very high	93.6	Very high	67 Å²	67	54.3 Å²	54.3	25%	0.254	28%	0.282	S	S	.	.			trans	-120.5	89.6	176.2	-159	-106.3	0	0	0	110.6	T643 D658 R659 D660 M931 A947	W641-T643 HydrophobicContact CG-CG2 4.46Å; W641-T643 PolarHBondContact O-N 3.17Å; W641-T643 VanDerWaalsContact O-N 3.09Å; W641-D658 PolarHBondContact N-OD1 2.63Å; W641-R659 HydrophobicContact CB-CB 4.47Å; W641-R659 PolarHBondContact O-N 3.41Å; W641-D660 HydrophobicContact CB-CB 4.01Å; W641-M931 HydrophobicContact CD2-CE 4.1Å; W641-M931 HydrophobicContact CG-CE 4.29Å; W641-M931 HydrophobicContact CZ2-CE 3.98Å; W641-M931 HydrophobicContact CZ2-SD 4.39Å; W641-A947 HydrophobicContact CH2-CB 4.36Å; W641-A947 HydrophobicContact CZ3-CB 4.24Å
642	P	95.8	Very high	93.6	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	78.5	-164.8	35.3	-35.9	0	0	0	112.9	V640 V656 V657 M931 T945 E946	V640-P642 HydrophobicContact CG1-CB 4.4Å; V640-P642 WeakPolarHBondContact O-CD 3.43Å; P642-V656 HydrophobicContact CB-CG1 3.74Å; P642-V657 CarbonylContact C-O 3.53Å; P642-V657 WeakPolarHBondContact CA-O 3.47Å; P642-M931 HydrophobicContact CG-SD 4.14Å; P642-T945 HydrophobicContact CB-CG2 3.92Å; P642-T945 HydrophobicContact CG-CG2 4.45Å; P642-T945 PolarHBondContact O-OG1 3.06Å; P642-E946 WeakPolarHBondContact CG-O 3.38Å
643	T	95.8	Very high	93.6	Very high	3 Å²	3	49.4 Å²	49.4	2%	0.018	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	-18.9	-172.5	51.4	0	0	0	0	114.7	W641 V657 R659 F691 Y798 M931	W641-T643 HydrophobicContact CG-CG2 4.46Å; W641-T643 PolarHBondContact O-N 3.17Å; W641-T643 VanDerWaalsContact O-N 3.09Å; T643-V657 PolarHBondContact N-O 3.41Å; T643-R659 HydrophobicContact CG2-CB 4.19Å; T643-F691 CarbonylContact C-O 3.51Å; T643-F691 WeakPolarHBondContact CB-O 3.4Å; T643-F691 PolarHBondContact OG1-O 2.96Å; T643-Y798 PolarHBondContact O-OH 3.33Å; T643-M931 HydrophobicContact CG2-CE 3.71Å
644	G	96.9	Very high	93.8	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	146.5	-177.4	0	0	0	0	0	111.2	V657 F691	G644-V657 PolarHBondContact O-N 3.03Å; G644-F691 PolarHBondContact N-O 2.86Å
645	L	97.3	Very high	94.2	Very high	9 Å²	9	42.3 Å²	42.3	5%	0.047	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	129.5	-176.9	-171.8	72	0	0	0	110.8	I654 Y655 V656 A932 T934 I943 T945	L645-I654 HydrophobicContact CD1-CG2 3.59Å; L645-Y655 WeakPolarHBondContact CA-O 3.31Å; L645-V656 HydrophobicContact CD1-CG2 3.76Å; L645-A932 HydrophobicContact CB-CB 3.59Å; L645-T934 HydrophobicContact CB-CG2 4.41Å; L645-T934 HydrophobicContact CD2-CG2 3.54Å; L645-T934 HydrophobicContact CG-CG2 3.63Å; L645-I943 HydrophobicContact CD1-CG2 4.46Å; L645-I943 HydrophobicContact CD2-CB 3.96Å; L645-I943 HydrophobicContact CD2-CG2 3.71Å; L645-I943 WeakPolarHBondContact CD2-O 3.36Å; L645-T945 HydrophobicContact CB-CG2 4.32Å; L645-T945 HydrophobicContact CD1-CG2 3.75Å; L645-T945 HydrophobicContact CD2-CG2 4.08Å; L645-T945 HydrophobicContact CG-CG2 4.27Å
646	A	97.4	Very high	94.5	Very high	7 Å²	7	38.2 Å²	38.2	6%	0.058	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	156.1	172.3	0	0	0	0	0	111.7	Y655 I693 L695	A646-Y655 PolarHBondContact N-O 3.46Å; A646-Y655 PolarHBondContact O-N 3.08Å; A646-I693 HydrophobicContact CB-CG2 3.93Å; A646-L695 HydrophobicContact CB-CD1 4.02Å; A646-L695 HydrophobicContact CB-CD2 4.46Å; A646-L695 HydrophobicContact CB-CG 3.8Å
647	V	96.5	Very high	94.8	Very high	6 Å²	6	36.7 Å²	36.7	4%	0.036	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	131.1	175.5	173.5	0	0	0	0	109.6	Q649 D653 I654 T934 D936 I943	V647-Q649 PolarHBondContact O-N 2.96Å; V647-Q649 VanDerWaalsContact O-N 3.09Å; V647-D653 WeakPolarHBondContact CA-O 3.48Å; V647-I654 HydrophobicContact CG2-CG1 4.46Å; V647-T934 HydrophobicContact CG2-CG2 3.71Å; V647-D936 HydrophobicContact CG1-CB 4.18Å; V647-I943 HydrophobicContact CG2-CD1 3.44Å; V647-I943 VanDerWaalsContact CG2-CD1 3.44Å
648	N	94.8	Very high	95	Very high	6 Å²	6	28.9 Å²	28.9	3%	0.032	14%	0.143	C	C	.	.			trans	-73.4	101.2	165.9	178.7	0.9	0	0	0	109.1	S650 N651 G652 D653 Y655 L695	N648-S650 VanDerWaalsContact CG-OG 3.3Å; N648-S650 PolarHBondContact ND2-OG 2.75Å; N648-S650 PolarHBondContact O-N 3.02Å; N648-S650 PolarHBondContact OD1-N 2.65Å; N648-S650 VanDerWaalsContact OD1-N 3.15Å; N648-S650 PolarHBondContact OD1-OG 2.81Å; N648-N651 VanDerWaalsContact CB-OD1 3.29Å; N648-N651 WeakPolarHBondContact CB-OD1 3.49Å; N648-N651 VanDerWaalsContact CG-OD1 3.28Å; N648-N651 PolarHBondContact ND2-OD1 2.78Å; N648-N651 PolarHBondContact O-N 2.64Å; N648-N651 PolarHBondContact O-OD1 3.36Å; N648-G652 WeakPolarHBondContact O-CA 3.49Å; N648-G652 PolarHBondContact O-N 2.91Å; N648-D653 HydrophobicContact CB-CB 4.5Å; N648-D653 PolarHBondContact N-O 3.21Å; N648-Y655 HydrophobicContact CB-CE2 4.09Å; N648-L695 HydrophobicContact CB-CD1 4.1Å
649	Q	92.3	Very high	95.2	Very high	54 Å²	54	22.6 Å²	22.6	25%	0.252	12%	0.119	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-14.1	-175.6	-58.4	-62	-38.1	0	0	114.4	V647 T935 Q938	V647-Q649 PolarHBondContact O-N 2.96Å; V647-Q649 VanDerWaalsContact O-N 3.09Å; Q649-T935 PolarHBondContact NE2-O 3.14Å; Q649-Q938 PolarHBondContact O-NE2 2.69Å; Q649-Q938 PolarHBondContact O-OE1 3.32Å
650	S	90.3	Very high	95.3	Very high	81 Å²	81	19.9 Å²	19.9	57%	0.566	11%	0.105	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.9	-29.9	179.1	64.7	0	0	0	0	114.5	N648	N648-S650 VanDerWaalsContact CG-OG 3.3Å; N648-S650 PolarHBondContact ND2-OG 2.75Å; N648-S650 PolarHBondContact O-N 3.02Å; N648-S650 PolarHBondContact OD1-N 2.65Å; N648-S650 VanDerWaalsContact OD1-N 3.15Å; N648-S650 PolarHBondContact OD1-OG 2.81Å
651	N	92.4	Very high	95.4	Very high	60 Å²	60	20.9 Å²	20.9	32%	0.321	11%	0.11	S	C	.	.	T	Hydrogen-bonded Turn	trans	-128.1	-20.7	-176.7	63.6	4.3	0	0	0	113.4	N648 D653 R939	N648-N651 VanDerWaalsContact CB-OD1 3.29Å; N648-N651 WeakPolarHBondContact CB-OD1 3.49Å; N648-N651 VanDerWaalsContact CG-OD1 3.28Å; N648-N651 PolarHBondContact ND2-OD1 2.78Å; N648-N651 PolarHBondContact O-N 2.64Å; N648-N651 PolarHBondContact O-OD1 3.36Å; N651-D653 VanDerWaalsContact ND2-CG 3.31Å; N651-D653 PolarHBondContact ND2-OD2 3.24Å; N651-D653 WeakPolarHBondContact OD1-CB 3.43Å; N651-D653 PolarHBondContact OD1-N 3.36Å; N651-R939 PolarHBondContact O-NH2 2.78Å
652	G	94.3	Very high	95.4	Very high	1 Å²	1	19.3 Å²	19.3	1%	0.01	11%	0.11	C	C	.	.			trans	91.6	7.6	-177.7	0	0	0	0	0	114.5	N648 H669	N648-G652 WeakPolarHBondContact O-CA 3.49Å; N648-G652 PolarHBondContact O-N 2.91Å; G652-H669 WeakPolarHBondContact O-CA 3.01Å; G652-H669 VanDerWaalsContact O-CB 3.28Å; G652-H669 WeakPolarHBondContact O-CB 3.3Å
653	D	95.9	Very high	95.4	Very high	31 Å²	31	19.8 Å²	19.8	17%	0.166	11%	0.111	C	C	.	.			trans	-64.8	136.9	178.4	-66.7	-14.2	0	0	0	110.7	V647 N648 N651 Y655 F667	V647-D653 WeakPolarHBondContact CA-O 3.48Å; N648-D653 HydrophobicContact CB-CB 4.5Å; N648-D653 PolarHBondContact N-O 3.21Å; N651-D653 VanDerWaalsContact ND2-CG 3.31Å; N651-D653 PolarHBondContact ND2-OD2 3.24Å; N651-D653 WeakPolarHBondContact OD1-CB 3.43Å; N651-D653 PolarHBondContact OD1-N 3.36Å; D653-Y655 HydrophobicContact CB-CE2 4.04Å; D653-F667 CarbonylContact C-O 3.49Å; D653-F667 WeakPolarHBondContact CA-O 3.37Å
654	I	97.3	Very high	95.5	Very high	2 Å²	2	19.6 Å²	19.6	1%	0.01	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	125	-174	-52.4	174.1	0	0	0	108.8	F629 L645 V647 V656 L666 F667 I943	F629-I654 HydrophobicContact CE1-CD1 4.12Å; F629-I654 HydrophobicContact CZ-CD1 4.1Å; L645-I654 HydrophobicContact CD1-CG2 3.59Å; V647-I654 HydrophobicContact CG2-CG1 4.46Å; I654-V656 HydrophobicContact CG2-CG2 4.17Å; I654-L666 CarbonylContact O-C 3.58Å; I654-L666 WeakPolarHBondContact O-CA 3.28Å; I654-F667 HydrophobicContact CB-CB 4.39Å; I654-F667 PolarHBondContact N-O 3.44Å; I654-F667 PolarHBondContact O-N 3.01Å; I654-I943 HydrophobicContact CD1-CD1 3.89Å; I654-I943 HydrophobicContact CD1-CG2 4.41Å; I654-I943 HydrophobicContact CG1-CD1 4.02Å; I654-I943 HydrophobicContact CG2-CG2 4.41Å
655	Y	97.5	Very high	95.4	Very high	4 Å²	4	19.6 Å²	19.6	2%	0.016	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	118.7	178.8	-69.3	-115.3	0	0	0	108.7	L645 A646 N648 D653 I664 L666 I693 L695 I702	L645-Y655 WeakPolarHBondContact CA-O 3.31Å; A646-Y655 PolarHBondContact N-O 3.46Å; A646-Y655 PolarHBondContact O-N 3.08Å; N648-Y655 HydrophobicContact CB-CE2 4.09Å; D653-Y655 HydrophobicContact CB-CE2 4.04Å; Y655-I664 HydrophobicContact CD1-CG2 4.09Å; Y655-L666 HydrophobicContact CD1-CD1 3.85Å; Y655-L666 HydrophobicContact CD1-CD2 4.21Å; Y655-L666 HydrophobicContact CD1-CG 3.7Å; Y655-L666 HydrophobicContact CE1-CD1 3.89Å; Y655-L666 HydrophobicContact CE1-CD2 3.48Å; Y655-L666 VanDerWaalsContact CE1-CD2 3.48Å; Y655-L666 HydrophobicContact CE1-CG 3.51Å; Y655-L666 HydrophobicContact CE2-CD2 4.45Å; Y655-L666 HydrophobicContact CE2-CG 4.4Å; Y655-L666 HydrophobicContact CG-CG 4.24Å; Y655-I693 HydrophobicContact CD1-CD1 4.29Å; Y655-I693 HydrophobicContact CG-CD1 4.48Å; Y655-L695 HydrophobicContact CD2-CD1 3.99Å; Y655-L695 HydrophobicContact CE2-CD1 4.17Å; Y655-L695 HydrophobicContact CG-CD1 4.46Å; Y655-I702 HydrophobicContact CD1-CD1 4.18Å; Y655-I702 HydrophobicContact CE1-CD1 3.63Å; Y655-I702 HydrophobicContact CE1-CG1 4.5Å
656	V	97.7	Very high	95.4	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	121	-178.8	-176.7	0	0	0	0	108.9	P642 L645 I654 D658 I664 K665 F667 T945 V951	P642-V656 HydrophobicContact CB-CG1 3.74Å; L645-V656 HydrophobicContact CD1-CG2 3.76Å; I654-V656 HydrophobicContact CG2-CG2 4.17Å; V656-D658 PolarHBondContact O-N 3.46Å; V656-I664 CarbonylContact O-C 3.51Å; V656-I664 WeakPolarHBondContact O-CA 3.09Å; V656-K665 PolarHBondContact N-O 3.04Å; V656-K665 PolarHBondContact O-N 3.5Å; V656-F667 HydrophobicContact CB-CE2 4.25Å; V656-F667 HydrophobicContact CG2-CD2 3.95Å; V656-F667 HydrophobicContact CG2-CE2 3.92Å; V656-T945 HydrophobicContact CG1-CG2 4.34Å; V656-V951 HydrophobicContact CG2-CG2 4.42Å
657	V	97.5	Very high	95.4	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	116.3	170.1	172.3	0	0	0	0	108.4	P642 T643 G644 I664 P690 I693	P642-V657 CarbonylContact C-O 3.53Å; P642-V657 WeakPolarHBondContact CA-O 3.47Å; T643-V657 PolarHBondContact N-O 3.41Å; G644-V657 PolarHBondContact O-N 3.03Å; V657-I664 HydrophobicContact CG2-CG1 4.07Å; V657-P690 HydrophobicContact CG1-CB 3.71Å; V657-P690 HydrophobicContact CG1-CG 3.88Å; V657-P690 WeakPolarHBondContact CG1-O 3.33Å; V657-I693 HydrophobicContact CG2-CB 3.6Å; V657-I693 HydrophobicContact CG2-CD1 4.41Å; V657-I693 HydrophobicContact CG2-CG2 3.6Å
658	D	95.7	Very high	95.4	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	94.4	171.4	-175.3	-10.4	0	0	0	108.4	W641 V656 D660 N661 S662 R663 K665	W641-D658 PolarHBondContact N-OD1 2.63Å; V656-D658 PolarHBondContact O-N 3.46Å; D658-D660 PolarHBondContact O-N 3.29Å; D658-N661 HydrophobicContact CB-CB 4.49Å; D658-N661 PolarHBondContact OD1-N 2.88Å; D658-N661 PolarHBondContact OD1-ND2 3.43Å; D658-N661 WeakPolarHBondContact OD2-CB 3.05Å; D658-N661 PolarHBondContact OD2-ND2 3.02Å; D658-S662 PolarHBondContact O-N 3.01Å; D658-S662 VanDerWaalsContact O-N 3.07Å; D658-R663 HydrophobicContact CB-CG 4.36Å; D658-R663 PolarHBondContact N-O 3.4Å; D658-R663 PolarHBondContact O-N 3.16Å; D658-R663 VanDerWaalsContact O-N 3.09Å; D658-K665 HydrophobicContact CB-CD 4.43Å; D658-K665 WeakPolarHBondContact OD2-CE 3.48Å; D658-K665 IonicContact OD2-NZ 3.75Å; D658-K665 PolarHBondContact OD2-NZ 3.45Å
659	R	95.3	Very high	95.4	Very high	32 Å²	32	23.7 Å²	23.7	12%	0.121	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-44.5	-172.1	176.6	173.8	170.8	-112	5.9	112.2	N554 W641 T643 S662 S689 P690	N554-R659 VanDerWaalsContact CG-NH2 3.33Å; N554-R659 PolarHBondContact ND2-NH1 3.07Å; N554-R659 PolarHBondContact ND2-NH2 3.16Å; N554-R659 PolarHBondContact OD1-NH1 3.15Å; N554-R659 PolarHBondContact OD1-NH2 3.31Å; W641-R659 HydrophobicContact CB-CB 4.47Å; W641-R659 PolarHBondContact O-N 3.41Å; T643-R659 HydrophobicContact CG2-CB 4.19Å; R659-S662 PolarHBondContact O-N 2.59Å; R659-S662 VanDerWaalsContact O-N 3.08Å; R659-S689 PolarHBondContact NE-OG 3.35Å; R659-P690 WeakPolarHBondContact CB-O 3.36Å; R659-P690 WeakPolarHBondContact CG-O 3.3Å
660	D	93.8	Very high	95.5	Very high	54 Å²	54	25.3 Å²	25.3	29%	0.289	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-28.6	-171.5	-79.7	9	0	0	0	112.4	R638 W641 D658 S662	R638-D660 HydrophobicContact CB-CB 4.45Å; R638-D660 WeakPolarHBondContact CD-O 3.3Å; W641-D660 HydrophobicContact CB-CB 4.01Å; D658-D660 PolarHBondContact O-N 3.29Å; D660-S662 VanDerWaalsContact C-N 3.3Å
661	N	94	Very high	95.8	Very high	21 Å²	21	22.1 Å²	22.1	11%	0.112	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.8	8.8	167.1	-65.5	-80.3	0	0	0	113.4	L637 R638 D639 D658 R663	L637-N661 PolarHBondContact N-OD1 2.79Å; R638-N661 PolarHBondContact N-OD1 2.66Å; R638-N661 PolarHBondContact O-ND2 3.17Å; R638-N661 PolarHBondContact O-OD1 3.49Å; D639-N661 PolarHBondContact O-ND2 3.02Å; D658-N661 HydrophobicContact CB-CB 4.49Å; D658-N661 PolarHBondContact OD1-N 2.88Å; D658-N661 PolarHBondContact OD1-ND2 3.43Å; D658-N661 WeakPolarHBondContact OD2-CB 3.05Å; D658-N661 PolarHBondContact OD2-ND2 3.02Å; N661-R663 HydrophobicContact CB-CG 4.33Å; N661-R663 PolarHBondContact O-N 3.39Å
662	S	95.5	Very high	96	Very high	35 Å²	35	23.2 Å²	23.2	25%	0.245	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.9	45.6	174.1	-54.8	0	0	0	0	114.8	D658 R659 D660 I688	D658-S662 PolarHBondContact O-N 3.01Å; D658-S662 VanDerWaalsContact O-N 3.07Å; R659-S662 PolarHBondContact O-N 2.59Å; R659-S662 VanDerWaalsContact O-N 3.08Å; D660-S662 VanDerWaalsContact C-N 3.3Å; S662-I688 WeakPolarHBondContact CB-O 3.28Å; S662-I688 PolarHBondContact OG-O 3.21Å
663	R	95.7	Very high	96.1	Very high	9 Å²	9	27 Å²	27	3%	0.034	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.7	175.6	-176.7	66.5	-172.7	160.8	175.7	-11.7	113.7	T635 D636 D658 N661 D679	T635-R663 PolarHBondContact OG1-NH1 3.32Å; D636-R663 VanDerWaalsContact CA-NH2 3.27Å; D636-R663 VanDerWaalsContact CG-NH2 3.28Å; D636-R663 IonicContact OD1-CZ 3.75Å; D636-R663 IonicContact OD1-NH1 3.06Å; D636-R663 IonicContact OD1-NH2 3.34Å; D636-R663 PolarHBondContact OD1-NH2 3.11Å; D658-R663 HydrophobicContact CB-CG 4.36Å; D658-R663 PolarHBondContact N-O 3.4Å; D658-R663 PolarHBondContact O-N 3.16Å; D658-R663 VanDerWaalsContact O-N 3.09Å; N661-R663 HydrophobicContact CB-CG 4.33Å; N661-R663 PolarHBondContact O-N 3.39Å; R663-D679 HydrophobicContact CB-CB 3.96Å; R663-D679 WeakPolarHBondContact CD-OD2 3.47Å
664	I	96.8	Very high	96.1	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	129.8	171.5	-63.3	158.7	0	0	0	108.5	Y655 V656 V657 L666 S676 L677 L687 I693 V704	Y655-I664 HydrophobicContact CD1-CG2 4.09Å; V656-I664 CarbonylContact O-C 3.51Å; V656-I664 WeakPolarHBondContact O-CA 3.09Å; V657-I664 HydrophobicContact CG2-CG1 4.07Å; I664-L666 HydrophobicContact CG2-CD1 4.12Å; I664-S676 CarbonylContact O-C 3.31Å; I664-S676 WeakPolarHBondContact O-CA 3.42Å; I664-S676 WeakPolarHBondContact O-CB 3.38Å; I664-L677 HydrophobicContact CB-CD1 3.8Å; I664-L677 HydrophobicContact CB-CG 4Å; I664-L677 HydrophobicContact CD1-CD1 3.59Å; I664-L677 HydrophobicContact CG1-CD1 4.2Å; I664-L677 HydrophobicContact CG2-CD1 4.47Å; I664-L677 HydrophobicContact CG2-CG 4.42Å; I664-L677 PolarHBondContact N-O 3.13Å; I664-L677 PolarHBondContact O-N 3.3Å; I664-L687 HydrophobicContact CD1-CD1 3.87Å; I664-L687 HydrophobicContact CG1-CD1 4.06Å; I664-I693 HydrophobicContact CD1-CD1 3.77Å; I664-I693 HydrophobicContact CG1-CD1 4.21Å; I664-I693 HydrophobicContact CG2-CD1 3.81Å; I664-V704 HydrophobicContact CD1-CB 4.26Å; I664-V704 HydrophobicContact CD1-CG1 3.91Å; I664-V704 HydrophobicContact CD1-CG2 3.32Å
665	K	96	Very high	96	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	134.7	177.5	-66.1	176.6	179.5	172.2	0	109.8	A631 V633 D636 V656 D658 F667 F673	A631-K665 VanDerWaalsContact O-CD 3.25Å; A631-K665 WeakPolarHBondContact O-CD 3.2Å; A631-K665 PolarHBondContact O-NZ 3.42Å; V633-K665 HydrophobicContact CG2-CD 4.45Å; D636-K665 WeakPolarHBondContact OD1-CE 3.09Å; D636-K665 IonicContact OD1-NZ 3.57Å; D636-K665 PolarHBondContact OD1-NZ 2.89Å; D636-K665 IonicContact OD2-NZ 3.4Å; D636-K665 PolarHBondContact OD2-NZ 3.21Å; V656-K665 PolarHBondContact N-O 3.04Å; V656-K665 PolarHBondContact O-N 3.5Å; D658-K665 HydrophobicContact CB-CD 4.43Å; D658-K665 WeakPolarHBondContact OD2-CE 3.48Å; D658-K665 IonicContact OD2-NZ 3.75Å; D658-K665 PolarHBondContact OD2-NZ 3.45Å; K665-F667 HydrophobicContact CB-CD2 4.39Å; K665-F667 HydrophobicContact CB-CE2 3.51Å; K665-F667 HydrophobicContact CB-CZ 3.99Å; K665-F667 HydrophobicContact CD-CE2 4.47Å; K665-F667 HydrophobicContact CD-CZ 4.28Å; K665-F673 HydrophobicContact CB-CE2 4.11Å; K665-F673 HydrophobicContact CG-CE2 4.22Å
666	L	96.6	Very high	95.8	Very high	8 Å²	8	32.8 Å²	32.8	4%	0.042	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	132.9	-180	-75.4	68.2	0	0	0	108.9	I654 Y655 I664 I674 S675 L677	I654-L666 CarbonylContact O-C 3.58Å; I654-L666 WeakPolarHBondContact O-CA 3.28Å; Y655-L666 HydrophobicContact CD1-CD1 3.85Å; Y655-L666 HydrophobicContact CD1-CD2 4.21Å; Y655-L666 HydrophobicContact CD1-CG 3.7Å; Y655-L666 HydrophobicContact CE1-CD1 3.89Å; Y655-L666 HydrophobicContact CE1-CD2 3.48Å; Y655-L666 VanDerWaalsContact CE1-CD2 3.48Å; Y655-L666 HydrophobicContact CE1-CG 3.51Å; Y655-L666 HydrophobicContact CE2-CD2 4.45Å; Y655-L666 HydrophobicContact CE2-CG 4.4Å; Y655-L666 HydrophobicContact CG-CG 4.24Å; I664-L666 HydrophobicContact CG2-CD1 4.12Å; L666-I674 HydrophobicContact CB-CB 4.14Å; L666-I674 PolarHBondContact O-N 2.89Å; L666-S675 PolarHBondContact N-O 3.2Å; L666-L677 HydrophobicContact CD1-CD2 3.82Å; L666-L677 HydrophobicContact CD1-CG 4.15Å
667	F	97.6	Very high	95.6	Very high	4 Å²	4	33 Å²	33	2%	0.018	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	147.8	175.6	-58.8	-95.2	0	0	0	109.4	F629 A631 D653 I654 V656 K665 T672 F673	F629-F667 HydrophobicContact CD2-CD1 4.12Å; F629-F667 HydrophobicContact CD2-CE1 4.33Å; F629-F667 HydrophobicContact CE2-CB 4.14Å; F629-F667 AromaticContact CE2-CD1 3.66Å; F629-F667 HydrophobicContact CE2-CD1 3.66Å; F629-F667 HydrophobicContact CE2-CD2 4.07Å; F629-F667 HydrophobicContact CE2-CE1 4.06Å; F629-F667 HydrophobicContact CE2-CE2 4.42Å; F629-F667 AromaticContact CE2-CG 3.69Å; F629-F667 HydrophobicContact CE2-CG 3.69Å; F629-F667 HydrophobicContact CE2-CZ 4.43Å; F629-F667 HydrophobicContact CZ-CB 4.23Å; F629-F667 HydrophobicContact CZ-CG 4.23Å; A631-F667 HydrophobicContact CB-CE2 4.12Å; A631-F667 HydrophobicContact CB-CZ 3.85Å; D653-F667 CarbonylContact C-O 3.49Å; D653-F667 WeakPolarHBondContact CA-O 3.37Å; I654-F667 HydrophobicContact CB-CB 4.39Å; I654-F667 PolarHBondContact N-O 3.44Å; I654-F667 PolarHBondContact O-N 3.01Å; V656-F667 HydrophobicContact CB-CE2 4.25Å; V656-F667 HydrophobicContact CG2-CD2 3.95Å; V656-F667 HydrophobicContact CG2-CE2 3.92Å; K665-F667 HydrophobicContact CB-CD2 4.39Å; K665-F667 HydrophobicContact CB-CE2 3.51Å; K665-F667 HydrophobicContact CB-CZ 3.99Å; K665-F667 HydrophobicContact CD-CE2 4.47Å; K665-F667 HydrophobicContact CD-CZ 4.28Å; F667-T672 CarbonylContact C-O 3.49Å; F667-T672 VanDerWaalsContact CA-O 3.23Å; F667-T672 WeakPolarHBondContact CA-O 3.43Å; F667-F673 HydrophobicContact CD1-CB 4.03Å; F667-F673 HydrophobicContact CD1-CD2 4.36Å; F667-F673 HydrophobicContact CE1-CB 3.87Å; F667-F673 AromaticContact CE1-CD2 3.88Å; F667-F673 HydrophobicContact CE1-CD2 3.88Å; F667-F673 HydrophobicContact CE1-CG 4.37Å; F667-F673 AromaticContact CZ-CD2 3.99Å; F667-F673 HydrophobicContact CZ-CD2 3.99Å
668	T	96.9	Very high	95.3	Very high	33 Å²	33	33.2 Å²	33.2	20%	0.202	19%	0.185	C	C	.	.			trans	-65.2	164.8	167.9	50.9	0	0	0	0	110.3	D670 G671 T672 I674	T668-D670 WeakPolarHBondContact CB-OD1 3.32Å; T668-D670 PolarHBondContact O-N 3.17Å; T668-D670 PolarHBondContact OG1-OD1 2.73Å; T668-G671 PolarHBondContact O-N 2.95Å; T668-T672 PolarHBondContact N-O 3.43Å; T668-T672 WeakPolarHBondContact OG1-CA 3.22Å; T668-T672 WeakPolarHBondContact OG1-CB 3.29Å; T668-T672 PolarHBondContact OG1-N 2.82Å; T668-T672 PolarHBondContact OG1-O 3.39Å; T668-I674 HydrophobicContact CG2-CD1 3.7Å; T668-I674 HydrophobicContact CG2-CG1 3.67Å
669	H	94.8	Very high	94.9	Very high	69 Å²	69	35.2 Å²	35.2	32%	0.319	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-9.1	178.2	70	60.9	0	0	0	114.9	G652 R939 R941	G652-H669 WeakPolarHBondContact O-CA 3.01Å; G652-H669 VanDerWaalsContact O-CB 3.28Å; G652-H669 WeakPolarHBondContact O-CB 3.3Å; H669-R939 PolarHBondContact CD2-NH2 2.92Å; H669-R941 PolarHBondContact O-NH1 3.27Å
670	D	94.7	Very high	94.1	Very high	87 Å²	87	38.5 Å²	38.5	47%	0.465	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-110.1	9.4	176.3	68.1	-15.3	0	0	0	113.1	L627 T668	L627-D670 VanDerWaalsContact CD2-O 3.27Å; L627-D670 WeakPolarHBondContact CD2-O 3.17Å; T668-D670 WeakPolarHBondContact CB-OD1 3.32Å; T668-D670 PolarHBondContact O-N 3.17Å; T668-D670 PolarHBondContact OG1-OD1 2.73Å
671	G	95.4	Very high	93.1	Very high	14 Å²	14	38.2 Å²	38.2	14%	0.144	23%	0.229	C	C	.	.	S	Bend	trans	89.2	9	170.7	0	0	0	0	0	115.5	T668	T668-G671 PolarHBondContact O-N 2.95Å
672	T	97	Very high	92.2	Very high	84 Å²	84	43.9 Å²	43.9	52%	0.515	26%	0.255	S	S	.	.			trans	-80	129	175.9	-52.7	0	0	0	0	110.4	F667 T668 I674	F667-T672 CarbonylContact C-O 3.49Å; F667-T672 VanDerWaalsContact CA-O 3.23Å; F667-T672 WeakPolarHBondContact CA-O 3.43Å; T668-T672 PolarHBondContact N-O 3.43Å; T668-T672 WeakPolarHBondContact OG1-CA 3.22Å; T668-T672 WeakPolarHBondContact OG1-CB 3.29Å; T668-T672 PolarHBondContact OG1-N 2.82Å; T668-T672 PolarHBondContact OG1-O 3.39Å; T672-I674 PolarHBondContact O-N 3.12Å
673	F	96.7	Very high	91.3	Very high	79 Å²	79	49.7 Å²	49.7	35%	0.346	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	130.8	177.2	178.4	-107.3	0	0	0	111.9	V633 K665 F667 S675	V633-F673 HydrophobicContact CG1-CB 4.19Å; V633-F673 HydrophobicContact CG1-CD1 4.07Å; V633-F673 HydrophobicContact CG1-CD2 3.54Å; V633-F673 HydrophobicContact CG1-CE1 4.31Å; V633-F673 HydrophobicContact CG1-CE2 3.81Å; V633-F673 HydrophobicContact CG1-CG 3.66Å; V633-F673 HydrophobicContact CG1-CZ 4.18Å; V633-F673 HydrophobicContact CG2-CE2 4.46Å; V633-F673 HydrophobicContact CG2-CZ 4.35Å; K665-F673 HydrophobicContact CB-CE2 4.11Å; K665-F673 HydrophobicContact CG-CE2 4.22Å; F667-F673 HydrophobicContact CD1-CB 4.03Å; F667-F673 HydrophobicContact CD1-CD2 4.36Å; F667-F673 HydrophobicContact CE1-CB 3.87Å; F667-F673 AromaticContact CE1-CD2 3.88Å; F667-F673 HydrophobicContact CE1-CD2 3.88Å; F667-F673 HydrophobicContact CE1-CG 4.37Å; F667-F673 AromaticContact CZ-CD2 3.99Å; F667-F673 HydrophobicContact CZ-CD2 3.99Å; F673-S675 WeakPolarHBondContact CE2-O 3.44Å; F673-S675 WeakPolarHBondContact CZ-O 3.43Å
674	I	95.5	Very high	90.4	Very high	77 Å²	77	53.1 Å²	53.1	40%	0.395	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	-60.6	179.3	-57.5	171.9	0	0	0	110	L666 T668 T672	L666-I674 HydrophobicContact CB-CB 4.14Å; L666-I674 PolarHBondContact O-N 2.89Å; T668-I674 HydrophobicContact CG2-CD1 3.7Å; T668-I674 HydrophobicContact CG2-CG1 3.67Å; T672-I674 PolarHBondContact O-N 3.12Å
675	S	94.5	Very high	89.6	Confident	48 Å²	48	56 Å²	56	34%	0.336	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-167.4	172.8	-172.8	60.3	0	0	0	0	111.5	L666 F673	L666-S675 PolarHBondContact N-O 3.2Å; F673-S675 WeakPolarHBondContact CE2-O 3.44Å; F673-S675 WeakPolarHBondContact CZ-O 3.43Å
676	S	94.5	Very high	89.3	Confident	34 Å²	34	61.5 Å²	61.5	24%	0.238	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	157	166.2	57.6	0	0	0	0	111.5	I664 D679	I664-S676 CarbonylContact O-C 3.31Å; I664-S676 WeakPolarHBondContact O-CA 3.42Å; I664-S676 WeakPolarHBondContact O-CB 3.38Å; S676-D679 PolarHBondContact OG-OD2 3.03Å
677	L	93.5	Very high	89.2	Confident	6 Å²	6	61.5 Å²	61.5	3%	0.031	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	158.9	173.5	66.5	83	0	0	0	111.6	I664 L666 D679 I702 F715	I664-L677 HydrophobicContact CB-CD1 3.8Å; I664-L677 HydrophobicContact CB-CG 4Å; I664-L677 HydrophobicContact CD1-CD1 3.59Å; I664-L677 HydrophobicContact CG1-CD1 4.2Å; I664-L677 HydrophobicContact CG2-CD1 4.47Å; I664-L677 HydrophobicContact CG2-CG 4.42Å; I664-L677 PolarHBondContact N-O 3.13Å; I664-L677 PolarHBondContact O-N 3.3Å; L666-L677 HydrophobicContact CD1-CD2 3.82Å; L666-L677 HydrophobicContact CD1-CG 4.15Å; L677-D679 VanDerWaalsContact C-N 3.31Å; L677-D679 PolarHBondContact O-N 3.34Å; L677-I702 HydrophobicContact CD2-CD1 3.67Å; L677-F715 HydrophobicContact CD1-CD1 4.39Å; L677-F715 HydrophobicContact CD1-CD2 4.34Å; L677-F715 HydrophobicContact CD1-CG 4.21Å
678	G	90	Very high	89	Confident	3 Å²	3	65 Å²	65	3%	0.031	36%	0.357	C	S	.	.	S	Bend	trans	84.1	-6.5	179.9	0	0	0	0	0	115.4	R686 L687	G678-R686 CarbonylContact O-C 3.59Å; G678-R686 WeakPolarHBondContact O-CA 3.13Å; G678-L687 PolarHBondContact O-N 3.17Å
679	D	88.8	Confident	88.9	Confident	43 Å²	43	64 Å²	64	23%	0.23	35%	0.351	C	S	.	.	S	Bend	trans	-92.4	-18.6	172.6	49.3	2.7	0	0	0	113.4	R663 S676 L677 R686	R663-D679 HydrophobicContact CB-CB 3.96Å; R663-D679 WeakPolarHBondContact CD-OD2 3.47Å; S676-D679 PolarHBondContact OG-OD2 3.03Å; L677-D679 VanDerWaalsContact C-N 3.31Å; L677-D679 PolarHBondContact O-N 3.34Å; D679-R686 WeakPolarHBondContact O-CD 3.48Å; D679-R686 PolarHBondContact O-NE 3.5Å
680	T	78.9	Confident	89	Confident	101 Å²	101	60.8 Å²	60.8	62%	0.62	34%	0.336	S	S	*	.	S	Bend	trans	-105.5	163.6	-177.3	54.4	0	0	0	0	112.5
681	G	72.7	Confident	89.1	Confident	48 Å²	48	56.8 Å²	56.8	50%	0.495	32%	0.315	S	S	.	.	S	Bend	trans	98.7	-171	-177.6	0	0	0	0	0	114.4	R686	G681-R686 PolarHBondContact O-NE 3.47Å; G681-R686 PolarHBondContact O-NH2 3.09Å
682	E	74	Confident	89.3	Confident	140 Å²	140	56.8 Å²	56.8	65%	0.654	31%	0.311	S	S	*	.			trans	-63.4	150.8	175	-67.2	-167.1	169.8	0	0	110.7	T684 D685 R686	E682-T684 WeakPolarHBondContact CB-OG1 3.28Å; E682-T684 PolarHBondContact O-N 3.49Å; E682-D685 PolarHBondContact O-N 3.28Å; E682-R686 PolarHBondContact O-N 3.09Å
683	M	76.2	Confident	89.3	Confident	157 Å²	157	53 Å²	53	77%	0.773	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-25.9	-178.6	-172.4	177.8	68	0	0	112.8	D685 R709	M683-D685 VanDerWaalsContact C-N 3.28Å; M683-D685 PolarHBondContact O-N 3.34Å; M683-R709 PolarHBondContact O-NH2 3.49Å
684	T	77.9	Confident	89.3	Confident	80 Å²	80	50 Å²	50	49%	0.491	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-26.6	174.2	41.3	0	0	0	0	113.3	E682 R713	E682-T684 WeakPolarHBondContact CB-OG1 3.28Å; E682-T684 PolarHBondContact O-N 3.49Å; T684-R713 PolarHBondContact O-NH1 3.28Å
685	D	79.6	Confident	89.4	Confident	61 Å²	61	47.2 Å²	47.2	33%	0.326	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.2	-14.8	-175	-68	-35	0	0	0	114.9	E682 M683 R713	E682-D685 PolarHBondContact O-N 3.28Å; M683-D685 VanDerWaalsContact C-N 3.28Å; M683-D685 PolarHBondContact O-N 3.34Å; D685-R713 IonicContact OD1-NH2 2.78Å; D685-R713 PolarHBondContact OD1-NH2 3Å
686	R	89.9	Confident	89.3	Confident	116 Å²	116	45 Å²	45	44%	0.438	25%	0.246	S	C	.	.	S	Bend	trans	-70.7	146.4	178.7	-65.4	-179.3	-164.8	-165.1	-0.2	112.4	G678 D679 G681 E682 R709	G678-R686 CarbonylContact O-C 3.59Å; G678-R686 WeakPolarHBondContact O-CA 3.13Å; D679-R686 WeakPolarHBondContact O-CD 3.48Å; D679-R686 PolarHBondContact O-NE 3.5Å; G681-R686 PolarHBondContact O-NE 3.47Å; G681-R686 PolarHBondContact O-NH2 3.09Å; E682-R686 PolarHBondContact O-N 3.09Å; R686-R709 PolarHBondContact O-NE 3.39Å; R686-R709 PolarHBondContact O-NH2 3.05Å
687	L	94.4	Very high	88.8	Confident	8 Å²	8	46 Å²	46	4%	0.042	25%	0.254	C	S	.	.			trans	-69.1	149.6	168.7	-62.7	170.4	0	0	0	110	I664 G678 P690 V704 D706 R713 F715	I664-L687 HydrophobicContact CD1-CD1 3.87Å; I664-L687 HydrophobicContact CG1-CD1 4.06Å; G678-L687 PolarHBondContact O-N 3.17Å; L687-P690 HydrophobicContact CB-CB 4.28Å; L687-P690 HydrophobicContact CB-CG 4.04Å; L687-P690 HydrophobicContact CD1-CB 3.94Å; L687-P690 HydrophobicContact CD1-CG 4.09Å; L687-P690 HydrophobicContact CD2-CB 4.3Å; L687-P690 HydrophobicContact CG-CB 4.4Å; L687-V704 HydrophobicContact CD1-CG1 4.39Å; L687-V704 HydrophobicContact CD2-CG1 4.06Å; L687-D706 WeakPolarHBondContact CA-OD2 3.35Å; L687-R713 HydrophobicContact CD2-CB 4.21Å; L687-R713 HydrophobicContact CD2-CG 3.91Å; L687-F715 HydrophobicContact CD2-CE2 3.99Å; L687-F715 HydrophobicContact CD2-CZ 4.07Å; L687-F715 HydrophobicContact CG-CE2 4.42Å; L687-F715 HydrophobicContact CG-CZ 4.19Å
688	I	94.1	Very high	88.3	Confident	78 Å²	78	50.7 Å²	50.7	40%	0.4	29%	0.287	S	S	.	.	S	Bend	trans	-113.3	-56	176	-61.6	178.1	0	0	0	110.3	S662 D706 Q708 R709	S662-I688 WeakPolarHBondContact CB-O 3.28Å; S662-I688 PolarHBondContact OG-O 3.21Å; I688-D706 PolarHBondContact N-OD2 3.49Å; I688-Q708 HydrophobicContact CB-CB 4.2Å; I688-Q708 HydrophobicContact CB-CG 4.44Å; I688-Q708 HydrophobicContact CG2-CB 3.73Å; I688-Q708 HydrophobicContact CG2-CG 3.58Å; I688-R709 HydrophobicContact CB-CG 4.19Å; I688-R709 HydrophobicContact CD1-CG 3.67Å; I688-R709 HydrophobicContact CG1-CG 3.95Å
689	S	94.8	Very high	88.1	Confident	12 Å²	12	55.6 Å²	55.6	8%	0.084	30%	0.304	C	S	.	.	S	Bend	trans	-138.9	69.5	175	173.7	0	0	0	0	108.4	R659 F691 D706 Y707	R659-S689 PolarHBondContact NE-OG 3.35Å; S689-F691 PolarHBondContact O-N 3.24Å; S689-D706 PolarHBondContact N-OD1 3.21Å; S689-Y707 PolarHBondContact O-N 2.99Å
690	P	96.8	Very high	88.2	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.9	137.4	175.1	30.2	-32.9	0	0	0	108.5	V657 R659 L687 V704 S705	V657-P690 HydrophobicContact CG1-CB 3.71Å; V657-P690 HydrophobicContact CG1-CG 3.88Å; V657-P690 WeakPolarHBondContact CG1-O 3.33Å; R659-P690 WeakPolarHBondContact CB-O 3.36Å; R659-P690 WeakPolarHBondContact CG-O 3.3Å; L687-P690 HydrophobicContact CB-CB 4.28Å; L687-P690 HydrophobicContact CB-CG 4.04Å; L687-P690 HydrophobicContact CD1-CB 3.94Å; L687-P690 HydrophobicContact CD1-CG 4.09Å; L687-P690 HydrophobicContact CD2-CB 4.3Å; L687-P690 HydrophobicContact CG-CB 4.4Å; P690-V704 HydrophobicContact CB-CG1 3.78Å; P690-S705 CarbonylContact C-O 3.46Å; P690-S705 WeakPolarHBondContact CA-O 3.39Å
691	F	96.9	Very high	88.9	Confident	4 Å²	4	51 Å²	51	2%	0.018	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	-60.9	-171	-167.4	-85.5	0	0	0	110.3	T643 G644 S689 S705 R734 Y797 Y798	T643-F691 CarbonylContact C-O 3.51Å; T643-F691 WeakPolarHBondContact CB-O 3.4Å; T643-F691 PolarHBondContact OG1-O 2.96Å; G644-F691 PolarHBondContact N-O 2.86Å; S689-F691 PolarHBondContact O-N 3.24Å; F691-S705 PolarHBondContact N-O 3.05Å; F691-R734 HydrophobicContact CD1-CB 3.79Å; F691-R734 HydrophobicContact CD1-CG 4.09Å; F691-R734 HydrophobicContact CD2-CG 4.49Å; F691-R734 HydrophobicContact CE1-CB 3.72Å; F691-R734 HydrophobicContact CE1-CG 3.96Å; F691-R734 HydrophobicContact CE2-CG 4.36Å; F691-R734 HydrophobicContact CG-CB 4.48Å; F691-R734 HydrophobicContact CG-CG 4.37Å; F691-R734 HydrophobicContact CZ-CB 4.34Å; F691-R734 HydrophobicContact CZ-CG 4.1Å; F691-Y797 HydrophobicContact CE1-CE1 4.45Å; F691-Y797 AromaticContact CZ-CE1 3.91Å; F691-Y797 HydrophobicContact CZ-CE1 3.91Å; F691-Y797 AromaticContact CZ-CE2 3.86Å; F691-Y797 HydrophobicContact CZ-CE2 3.86Å; F691-Y797 AromaticContact CZ-CZ 3.47Å; F691-Y797 VanDerWaalsContact CZ-CZ 3.47Å; F691-Y797 WeakPolarHBondContact CZ-OH 3.41Å; F691-Y798 HydrophobicContact CE1-CE1 4.02Å; F691-Y798 HydrophobicContact CE1-CE2 4.45Å; F691-Y798 AromaticContact CE1-CZ 3.77Å
692	D	97.8	Very high	90	Very high	13 Å²	13	48.7 Å²	48.7	7%	0.07	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	162.8	-179.1	-165.6	21.9	0	0	0	111.4	V704 S705 R734 G735 V736 Y798	D692-V704 WeakPolarHBondContact O-CA 3.3Å; D692-S705 WeakPolarHBondContact CB-OG 3.47Å; D692-S705 PolarHBondContact N-OG 3.34Å; D692-S705 PolarHBondContact O-N 3Å; D692-S705 PolarHBondContact O-OG 3.1Å; D692-R734 WeakPolarHBondContact CB-O 3.27Å; D692-G735 VanDerWaalsContact OD2-CA 3.32Å; D692-G735 WeakPolarHBondContact OD2-CA 3.41Å; D692-V736 HydrophobicContact CB-CG1 4.09Å; D692-V736 PolarHBondContact OD2-N 3.18Å; D692-Y798 HydrophobicContact CB-CD1 4.42Å; D692-Y798 HydrophobicContact CB-CE1 4.05Å; D692-Y798 WeakPolarHBondContact OD2-CD1 3.45Å
693	I	98	Very high	91.1	Very high	5 Å²	5	42.1 Å²	42.1	3%	0.026	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	140.5	-172.5	-171.3	172.9	0	0	0	111.3	A646 Y655 V657 I664 L695 I702 F703 V704	A646-I693 HydrophobicContact CB-CG2 3.93Å; Y655-I693 HydrophobicContact CD1-CD1 4.29Å; Y655-I693 HydrophobicContact CG-CD1 4.48Å; V657-I693 HydrophobicContact CG2-CB 3.6Å; V657-I693 HydrophobicContact CG2-CD1 4.41Å; V657-I693 HydrophobicContact CG2-CG2 3.6Å; I664-I693 HydrophobicContact CD1-CD1 3.77Å; I664-I693 HydrophobicContact CG1-CD1 4.21Å; I664-I693 HydrophobicContact CG2-CD1 3.81Å; I693-L695 HydrophobicContact CG1-CD2 4.42Å; I693-I702 HydrophobicContact CD1-CG2 3.64Å; I693-I702 HydrophobicContact CG1-CG2 3.78Å; I693-F703 WeakPolarHBondContact CA-O 3.35Å; I693-V704 HydrophobicContact CG1-CG2 4.37Å
694	T	97.5	Very high	92.1	Very high	17 Å²	17	34.6 Å²	34.6	10%	0.104	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	156.3	170	-168.3	0	0	0	0	110.6	F703 V736 Y738 L743	T694-F703 HydrophobicContact CG2-CB 3.82Å; T694-F703 HydrophobicContact CG2-CD2 4.14Å; T694-F703 HydrophobicContact CG2-CG 4.37Å; T694-F703 PolarHBondContact N-O 3.08Å; T694-F703 PolarHBondContact O-N 2.77Å; T694-V736 HydrophobicContact CG2-CB 4.48Å; T694-V736 HydrophobicContact CG2-CG1 4.13Å; T694-V736 HydrophobicContact CG2-CG2 3.87Å; T694-Y738 PolarHBondContact OG1-N 2.63Å; T694-Y738 VanDerWaalsContact OG1-N 3.07Å; T694-L743 HydrophobicContact CG2-CD1 3.77Å
695	L	95.9	Very high	93	Very high	18 Å²	18	30.8 Å²	30.8	9%	0.094	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	139	-172.3	-51.4	179	0	0	0	110.5	A646 N648 Y655 I693 I702 F717	A646-L695 HydrophobicContact CB-CD1 4.02Å; A646-L695 HydrophobicContact CB-CD2 4.46Å; A646-L695 HydrophobicContact CB-CG 3.8Å; N648-L695 HydrophobicContact CB-CD1 4.1Å; Y655-L695 HydrophobicContact CD2-CD1 3.99Å; Y655-L695 HydrophobicContact CE2-CD1 4.17Å; Y655-L695 HydrophobicContact CG-CD1 4.46Å; I693-L695 HydrophobicContact CG1-CD2 4.42Å; L695-I702 HydrophobicContact CD2-CB 4.04Å; L695-I702 HydrophobicContact CD2-CG1 3.82Å; L695-I702 HydrophobicContact CD2-CG2 3.78Å; L695-F717 HydrophobicContact CB-CE1 4.37Å; L695-F717 HydrophobicContact CD2-CE1 4.16Å
696	S	92.5	Very high	93.8	Very high	1 Å²	1	27.9 Å²	27.9	1%	0.007	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	90.5	163.1	-174.6	0	0	0	0	108.9	S698 R699 G700 I701 Y738	S696-S698 PolarHBondContact O-N 2.91Å; S696-R699 CarbonylContact O-C 3.51Å; S696-R699 PolarHBondContact O-N 2.89Å; S696-R699 VanDerWaalsContact O-N 3.08Å; S696-R699 WeakPolarHBondContact OG-CB 3.18Å; S696-G700 PolarHBondContact O-N 2.84Å; S696-I701 PolarHBondContact N-O 3.49Å; S696-I701 PolarHBondContact O-N 3.33Å; S696-Y738 VanDerWaalsContact CB-CE1 3.48Å; S696-Y738 WeakPolarHBondContact OG-CE1 3.49Å
697	S	84.2	Confident	93.9	Very high	56 Å²	56	23.1 Å²	23.1	39%	0.392	13%	0.133	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-33.2	178.2	-62.9	0	0	0	0	112.7	R699	S697-R699 VanDerWaalsContact C-N 3.35Å
698	S	83.8	Confident	93.8	Very high	104 Å²	104	27 Å²	27	73%	0.727	15%	0.151	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72	-25.7	178	57.1	0	0	0	0	114	S696	S696-S698 PolarHBondContact O-N 2.91Å
699	R	85	Confident	93.7	Very high	105 Å²	105	25.2 Å²	25.2	40%	0.396	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.9	-12.2	178.5	-66.3	-174.5	163.5	80.9	7.6	114.1	S696 S697 I701 Y738	S696-R699 CarbonylContact O-C 3.51Å; S696-R699 PolarHBondContact O-N 2.89Å; S696-R699 VanDerWaalsContact O-N 3.08Å; S696-R699 WeakPolarHBondContact OG-CB 3.18Å; S697-R699 VanDerWaalsContact C-N 3.35Å; R699-I701 VanDerWaalsContact C-N 3.35Å; R699-I701 HydrophobicContact CB-CD1 3.9Å; R699-I701 HydrophobicContact CB-CG1 3.89Å; R699-Y738 PolarHBondContact NH1-OH 3.27Å
700	G	91.6	Very high	93.6	Very high	23 Å²	23	26.5 Å²	26.5	24%	0.237	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.8	31.4	-175.2	0	0	0	0	0	113.7	S696	S696-G700 PolarHBondContact O-N 2.84Å
701	I	93.6	Very high	93.5	Very high	25 Å²	25	27 Å²	27	13%	0.128	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	136.1	-175.8	-53.8	178.4	0	0	0	110.3	S696 R699 F703 L714 F715	S696-I701 PolarHBondContact N-O 3.49Å; S696-I701 PolarHBondContact O-N 3.33Å; R699-I701 VanDerWaalsContact C-N 3.35Å; R699-I701 HydrophobicContact CB-CD1 3.9Å; R699-I701 HydrophobicContact CB-CG1 3.89Å; I701-F703 HydrophobicContact CB-CE2 4.03Å; I701-F703 HydrophobicContact CB-CZ 4.06Å; I701-F703 HydrophobicContact CD1-CZ 4.47Å; I701-F703 HydrophobicContact CG2-CD1 4.3Å; I701-F703 HydrophobicContact CG2-CD2 4.24Å; I701-F703 HydrophobicContact CG2-CE1 3.88Å; I701-F703 HydrophobicContact CG2-CE2 3.8Å; I701-F703 HydrophobicContact CG2-CG 4.47Å; I701-F703 HydrophobicContact CG2-CZ 3.6Å; I701-L714 HydrophobicContact CG2-CB 4.25Å; I701-L714 HydrophobicContact CG2-CD2 4.17Å; I701-L714 HydrophobicContact CG2-CG 4.2Å; I701-F715 CarbonylContact C-O 3.59Å
702	I	95.9	Very high	93.5	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	123.1	169.2	-49.9	179.1	0	0	0	107.7	Y655 L677 I693 L695 V704 L714 F715 S716 F717	Y655-I702 HydrophobicContact CD1-CD1 4.18Å; Y655-I702 HydrophobicContact CE1-CD1 3.63Å; Y655-I702 HydrophobicContact CE1-CG1 4.5Å; L677-I702 HydrophobicContact CD2-CD1 3.67Å; I693-I702 HydrophobicContact CD1-CG2 3.64Å; I693-I702 HydrophobicContact CG1-CG2 3.78Å; L695-I702 HydrophobicContact CD2-CB 4.04Å; L695-I702 HydrophobicContact CD2-CG1 3.82Å; L695-I702 HydrophobicContact CD2-CG2 3.78Å; I702-V704 HydrophobicContact CG2-CG2 3.81Å; I702-L714 WeakPolarHBondContact O-CA 2.98Å; I702-F715 HydrophobicContact CB-CB 4.17Å; I702-F715 HydrophobicContact CD1-CB 4.33Å; I702-F715 PolarHBondContact N-O 3.42Å; I702-F715 PolarHBondContact O-N 2.63Å; I702-S716 WeakPolarHBondContact CD1-O 3.3Å; I702-F717 HydrophobicContact CD1-CD1 4.06Å; I702-F717 HydrophobicContact CG1-CD1 3.58Å; I702-F717 HydrophobicContact CG1-CE1 3.87Å
703	F	96.4	Very high	93.3	Very high	1 Å²	1	26.8 Å²	26.8	0%	0.004	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	130	172.1	-57.5	-88	0	0	0	109.1	I693 T694 I701 I712 L714 V736 Y738 L743 I758	I693-F703 WeakPolarHBondContact CA-O 3.35Å; T694-F703 HydrophobicContact CG2-CB 3.82Å; T694-F703 HydrophobicContact CG2-CD2 4.14Å; T694-F703 HydrophobicContact CG2-CG 4.37Å; T694-F703 PolarHBondContact N-O 3.08Å; T694-F703 PolarHBondContact O-N 2.77Å; I701-F703 HydrophobicContact CB-CE2 4.03Å; I701-F703 HydrophobicContact CB-CZ 4.06Å; I701-F703 HydrophobicContact CD1-CZ 4.47Å; I701-F703 HydrophobicContact CG2-CD1 4.3Å; I701-F703 HydrophobicContact CG2-CD2 4.24Å; I701-F703 HydrophobicContact CG2-CE1 3.88Å; I701-F703 HydrophobicContact CG2-CE2 3.8Å; I701-F703 HydrophobicContact CG2-CG 4.47Å; I701-F703 HydrophobicContact CG2-CZ 3.6Å; F703-I712 HydrophobicContact CB-CG2 4.08Å; F703-I712 HydrophobicContact CD1-CG2 4.29Å; F703-L714 HydrophobicContact CD1-CD1 4.33Å; F703-L714 HydrophobicContact CD1-CD2 4.35Å; F703-L714 HydrophobicContact CD1-CG 3.89Å; F703-L714 HydrophobicContact CE1-CD2 3.9Å; F703-L714 HydrophobicContact CE1-CG 3.95Å; F703-V736 HydrophobicContact CB-CG2 4.49Å; F703-Y738 HydrophobicContact CE2-CD2 4.26Å; F703-Y738 HydrophobicContact CE2-CG 4.29Å; F703-L743 HydrophobicContact CB-CD1 4.12Å; F703-L743 HydrophobicContact CD1-CD1 4.17Å; F703-L743 HydrophobicContact CD1-CD2 3.73Å; F703-L743 HydrophobicContact CD2-CD1 4.02Å; F703-L743 HydrophobicContact CE1-CD2 4.13Å; F703-L743 HydrophobicContact CE2-CD1 4.5Å; F703-L743 HydrophobicContact CG-CD1 3.84Å; F703-L743 HydrophobicContact CG-CD2 4.21Å; F703-I758 HydrophobicContact CE1-CG2 4.25Å; F703-I758 HydrophobicContact CZ-CD1 3.94Å; F703-I758 HydrophobicContact CZ-CG2 4.26Å
704	V	97.2	Very high	93.1	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	122.4	-176.8	-171.4	0	0	0	0	108.4	I664 L687 P690 D692 I693 I702 D706 I712 R713 F715	I664-V704 HydrophobicContact CD1-CB 4.26Å; I664-V704 HydrophobicContact CD1-CG1 3.91Å; I664-V704 HydrophobicContact CD1-CG2 3.32Å; L687-V704 HydrophobicContact CD1-CG1 4.39Å; L687-V704 HydrophobicContact CD2-CG1 4.06Å; P690-V704 HydrophobicContact CB-CG1 3.78Å; D692-V704 WeakPolarHBondContact O-CA 3.3Å; I693-V704 HydrophobicContact CG1-CG2 4.37Å; I702-V704 HydrophobicContact CG2-CG2 3.81Å; V704-D706 PolarHBondContact O-N 2.83Å; V704-I712 CarbonylContact O-C 3.54Å; V704-I712 VanDerWaalsContact O-CA 3.31Å; V704-I712 WeakPolarHBondContact O-CA 3.07Å; V704-R713 HydrophobicContact CB-CB 4.39Å; V704-R713 PolarHBondContact N-O 3.23Å; V704-R713 PolarHBondContact O-N 3.16Å; V704-F715 HydrophobicContact CG2-CD2 3.94Å; V704-F715 HydrophobicContact CG2-CE2 4.06Å
705	S	96.9	Very high	92.9	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78	122.4	169.1	55.9	0	0	0	0	109.5	P690 F691 D692 R734	P690-S705 CarbonylContact C-O 3.46Å; P690-S705 WeakPolarHBondContact CA-O 3.39Å; F691-S705 PolarHBondContact N-O 3.05Å; D692-S705 WeakPolarHBondContact CB-OG 3.47Å; D692-S705 PolarHBondContact N-OG 3.34Å; D692-S705 PolarHBondContact O-N 3Å; D692-S705 PolarHBondContact O-OG 3.1Å; S705-R734 WeakPolarHBondContact CB-O 3.33Å; S705-R734 PolarHBondContact OG-O 3.3Å
706	D	95.5	Very high	92.8	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	103.6	173.9	-169.3	-37.5	0	0	0	109.1	L687 I688 S689 V704 Q708 R709 D710 E711 R713	L687-D706 WeakPolarHBondContact CA-OD2 3.35Å; I688-D706 PolarHBondContact N-OD2 3.49Å; S689-D706 PolarHBondContact N-OD1 3.21Å; V704-D706 PolarHBondContact O-N 2.83Å; D706-Q708 VanDerWaalsContact C-N 3.32Å; D706-Q708 PolarHBondContact O-N 3.48Å; D706-Q708 PolarHBondContact OD1-N 3.48Å; D706-R709 HydrophobicContact CB-CB 3.92Å; D706-R709 HydrophobicContact CB-CG 4.27Å; D706-R709 PolarHBondContact O-N 3.41Å; D706-R709 PolarHBondContact OD1-N 3.21Å; D706-R709 VanDerWaalsContact OD1-N 3.1Å; D706-R709 WeakPolarHBondContact OD2-CD 3.42Å; D706-R709 IonicContact OD2-NE 2.83Å; D706-D710 PolarHBondContact O-N 2.93Å; D706-E711 PolarHBondContact N-O 3.26Å; D706-E711 PolarHBondContact O-N 3.12Å; D706-R713 HydrophobicContact CB-CG 4.36Å
707	Y	92.5	Very high	92.7	Very high	15 Å²	15	29.8 Å²	29.8	6%	0.059	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-41.8	-173.2	176.7	-91.7	0	0	0	111.9	S689 H732 R734	S689-Y707 PolarHBondContact O-N 2.99Å; Y707-H732 HydrophobicContact CD2-CB 4.12Å; Y707-H732 HydrophobicContact CE2-CB 3.55Å; Y707-H732 AromaticContact CE2-CD2 3.75Å; Y707-H732 AromaticContact CE2-CG 3.51Å; Y707-H732 AromaticContact CZ-CD2 3.62Å; Y707-H732 AromaticContact CZ-CG 3.75Å; Y707-H732 AromaticContact CZ-NE2 3.89Å; Y707-H732 PolarHBondContact OH-CD2 2.97Å; Y707-H732 PolarHBondContact OH-CE1 3.04Å; Y707-H732 VanDerWaalsContact OH-CE1 3.23Å; Y707-H732 PolarHBondContact OH-ND1 3.05Å; Y707-H732 PolarHBondContact OH-NE2 2.78Å; Y707-R734 HydrophobicContact CD2-CG 4.09Å; Y707-R734 HydrophobicContact CE2-CG 4.44Å
708	Q	92.2	Very high	92.9	Very high	91 Å²	91	31.3 Å²	31.3	43%	0.425	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.2	-27.5	-176.9	-172.2	66.5	18.7	0	0	111.8	I688 D706 D710	I688-Q708 HydrophobicContact CB-CB 4.2Å; I688-Q708 HydrophobicContact CB-CG 4.44Å; I688-Q708 HydrophobicContact CG2-CB 3.73Å; I688-Q708 HydrophobicContact CG2-CG 3.58Å; D706-Q708 VanDerWaalsContact C-N 3.32Å; D706-Q708 PolarHBondContact O-N 3.48Å; D706-Q708 PolarHBondContact OD1-N 3.48Å; Q708-D710 VanDerWaalsContact C-N 3.32Å
709	R	91.7	Very high	93.1	Very high	40 Å²	40	27.6 Å²	27.6	15%	0.151	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-10.2	173.9	-68.4	-174.3	169.2	-81.5	-3.8	113.6	M683 R686 I688 D706 E711 K729	M683-R709 PolarHBondContact O-NH2 3.49Å; R686-R709 PolarHBondContact O-NE 3.39Å; R686-R709 PolarHBondContact O-NH2 3.05Å; I688-R709 HydrophobicContact CB-CG 4.19Å; I688-R709 HydrophobicContact CD1-CG 3.67Å; I688-R709 HydrophobicContact CG1-CG 3.95Å; D706-R709 HydrophobicContact CB-CB 3.92Å; D706-R709 HydrophobicContact CB-CG 4.27Å; D706-R709 PolarHBondContact O-N 3.41Å; D706-R709 PolarHBondContact OD1-N 3.21Å; D706-R709 VanDerWaalsContact OD1-N 3.1Å; D706-R709 WeakPolarHBondContact OD2-CD 3.42Å; D706-R709 IonicContact OD2-NE 2.83Å; R709-E711 HydrophobicContact CB-CG 3.69Å; R709-E711 WeakPolarHBondContact CD-OE1 3.48Å; R709-E711 PolarHBondContact O-N 2.84Å; R709-K729 WeakPolarHBondContact O-CD 3.35Å; R709-K729 WeakPolarHBondContact O-CE 3.45Å; R709-K729 PolarHBondContact O-NZ 3.49Å
710	D	94.3	Very high	93.3	Very high	39 Å²	39	31.1 Å²	31.1	21%	0.209	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.1	39.5	-176.5	-83.7	-32.7	0	0	0	112	D706 Q708 K729 L730 H732	D706-D710 PolarHBondContact O-N 2.93Å; Q708-D710 VanDerWaalsContact C-N 3.32Å; D710-K729 HydrophobicContact CB-CB 4.09Å; D710-K729 HydrophobicContact CB-CD 4.01Å; D710-K729 HydrophobicContact CB-CG 4.49Å; D710-K729 WeakPolarHBondContact O-CA 3.29Å; D710-L730 VanDerWaalsContact CB-O 3.29Å; D710-L730 WeakPolarHBondContact CB-O 3.47Å; D710-L730 VanDerWaalsContact CG-O 3.29Å; D710-L730 PolarHBondContact O-N 3.27Å; D710-H732 PolarHBondContact OD1-N 3.42Å
711	E	94.5	Very high	93.3	Very high	11 Å²	11	32.1 Å²	32.1	5%	0.051	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	163.9	-177.9	68.9	-162.8	-164.8	0	0	113	D706 R709 R713 I724 K729	D706-E711 PolarHBondContact N-O 3.26Å; D706-E711 PolarHBondContact O-N 3.12Å; R709-E711 HydrophobicContact CB-CG 3.69Å; R709-E711 WeakPolarHBondContact CD-OE1 3.48Å; R709-E711 PolarHBondContact O-N 2.84Å; E711-R713 HydrophobicContact CG-CG 4.32Å; E711-R713 WeakPolarHBondContact OE1-CD 3.36Å; E711-R713 IonicContact OE1-NE 3.21Å; E711-R713 IonicContact OE1-NH1 3.9Å; E711-R713 PolarHBondContact OE1-NH1 3.19Å; E711-I724 HydrophobicContact CG-CG2 4.36Å; E711-K729 IonicContact OE2-NZ 3.97Å; E711-K729 PolarHBondContact OE2-NZ 3.37Å
712	I	95.3	Very high	93.1	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	120	164.5	-55.6	-53.6	0	0	0	108.2	F703 V704 L714 I724 L725 L730 P733 V736 L743 V745	F703-I712 HydrophobicContact CB-CG2 4.08Å; F703-I712 HydrophobicContact CD1-CG2 4.29Å; V704-I712 CarbonylContact O-C 3.54Å; V704-I712 VanDerWaalsContact O-CA 3.31Å; V704-I712 WeakPolarHBondContact O-CA 3.07Å; I712-L714 HydrophobicContact CG2-CD1 4.43Å; I712-I724 WeakPolarHBondContact O-CA 3.41Å; I712-L725 HydrophobicContact CB-CB 3.81Å; I712-L725 HydrophobicContact CB-CD2 4.14Å; I712-L725 HydrophobicContact CG1-CD2 3.99Å; I712-L725 HydrophobicContact CG2-CB 4.3Å; I712-L725 PolarHBondContact O-N 3.33Å; I712-L730 HydrophobicContact CD1-CD1 4.21Å; I712-L730 HydrophobicContact CG1-CD1 3.81Å; I712-P733 HydrophobicContact CD1-CB 4.11Å; I712-V736 HydrophobicContact CD1-CG2 4.46Å; I712-L743 HydrophobicContact CG2-CD2 4.4Å; I712-V745 HydrophobicContact CD1-CG1 3.8Å; I712-V745 HydrophobicContact CD1-CG2 4.14Å; I712-V745 HydrophobicContact CG1-CG1 4.14Å; I712-V745 HydrophobicContact CG1-CG2 3.87Å
713	R	94	Very high	92.8	Very high	12 Å²	12	36.9 Å²	36.9	5%	0.045	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	140.8	175.2	-62.8	-67.1	-54.4	-170.8	-0.2	110.3	T684 D685 L687 V704 D706 E711 F715 S721	T684-R713 PolarHBondContact O-NH1 3.28Å; D685-R713 IonicContact OD1-NH2 2.78Å; D685-R713 PolarHBondContact OD1-NH2 3Å; L687-R713 HydrophobicContact CD2-CB 4.21Å; L687-R713 HydrophobicContact CD2-CG 3.91Å; V704-R713 HydrophobicContact CB-CB 4.39Å; V704-R713 PolarHBondContact N-O 3.23Å; V704-R713 PolarHBondContact O-N 3.16Å; D706-R713 HydrophobicContact CB-CG 4.36Å; E711-R713 HydrophobicContact CG-CG 4.32Å; E711-R713 WeakPolarHBondContact OE1-CD 3.36Å; E711-R713 IonicContact OE1-NE 3.21Å; E711-R713 IonicContact OE1-NH1 3.9Å; E711-R713 PolarHBondContact OE1-NH1 3.19Å; R713-F715 HydrophobicContact CB-CD2 4.39Å; R713-F715 HydrophobicContact CB-CE2 3.6Å; R713-F715 HydrophobicContact CB-CZ 4.22Å; R713-S721 PolarHBondContact NH2-OG 3.33Å
714	L	94.1	Very high	92.6	Very high	23 Å²	23	40.1 Å²	40.1	12%	0.12	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	136.9	176.9	-70.5	71	0	0	0	109.8	I701 I702 F703 I712 S721 Q722 G723 L725	I701-L714 HydrophobicContact CG2-CB 4.25Å; I701-L714 HydrophobicContact CG2-CD2 4.17Å; I701-L714 HydrophobicContact CG2-CG 4.2Å; I702-L714 WeakPolarHBondContact O-CA 2.98Å; F703-L714 HydrophobicContact CD1-CD1 4.33Å; F703-L714 HydrophobicContact CD1-CD2 4.35Å; F703-L714 HydrophobicContact CD1-CG 3.89Å; F703-L714 HydrophobicContact CE1-CD2 3.9Å; F703-L714 HydrophobicContact CE1-CG 3.95Å; I712-L714 HydrophobicContact CG2-CD1 4.43Å; L714-S721 PolarHBondContact O-OG 3.08Å; L714-Q722 HydrophobicContact CB-CB 3.9Å; L714-Q722 PolarHBondContact O-N 2.83Å; L714-G723 PolarHBondContact N-O 3.49Å; L714-L725 HydrophobicContact CD1-CB 4.06Å; L714-L725 VanDerWaalsContact CD1-N 3.28Å
715	F	94.2	Very high	92.2	Very high	5 Å²	5	40.9 Å²	40.9	2%	0.022	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	155	172.3	-58.2	-95.1	0	0	0	110.4	L677 L687 I701 I702 V704 R713 R720	L677-F715 HydrophobicContact CD1-CD1 4.39Å; L677-F715 HydrophobicContact CD1-CD2 4.34Å; L677-F715 HydrophobicContact CD1-CG 4.21Å; L687-F715 HydrophobicContact CD2-CE2 3.99Å; L687-F715 HydrophobicContact CD2-CZ 4.07Å; L687-F715 HydrophobicContact CG-CE2 4.42Å; L687-F715 HydrophobicContact CG-CZ 4.19Å; I701-F715 CarbonylContact C-O 3.59Å; I702-F715 HydrophobicContact CB-CB 4.17Å; I702-F715 HydrophobicContact CD1-CB 4.33Å; I702-F715 PolarHBondContact N-O 3.42Å; I702-F715 PolarHBondContact O-N 2.63Å; V704-F715 HydrophobicContact CG2-CD2 3.94Å; V704-F715 HydrophobicContact CG2-CE2 4.06Å; R713-F715 HydrophobicContact CB-CD2 4.39Å; R713-F715 HydrophobicContact CB-CE2 3.6Å; R713-F715 HydrophobicContact CB-CZ 4.22Å; F715-R720 CarbonylContact C-O 3.49Å; F715-R720 WeakPolarHBondContact CA-O 3.25Å
716	S	92.6	Very high	91.6	Very high	19 Å²	19	41.1 Å²	41.1	13%	0.133	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	164.7	163.5	27	0	0	0	0	111.4	I702 D718 G719 R720 Q722	I702-S716 WeakPolarHBondContact CD1-O 3.3Å; S716-D718 WeakPolarHBondContact CB-OD1 3.47Å; S716-D718 PolarHBondContact O-N 3.05Å; S716-D718 PolarHBondContact OG-OD1 3.11Å; S716-G719 PolarHBondContact O-N 3Å; S716-R720 PolarHBondContact N-O 3.11Å; S716-R720 PolarHBondContact OG-O 2.95Å; S716-Q722 VanDerWaalsContact CB-NE2 3.3Å
717	F	91.3	Very high	90.8	Very high	56 Å²	56	49.5 Å²	49.5	25%	0.246	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-18.3	173.6	-64.9	-18.4	0	0	0	114.4	L695 I702 G719	L695-F717 HydrophobicContact CB-CE1 4.37Å; L695-F717 HydrophobicContact CD2-CE1 4.16Å; I702-F717 HydrophobicContact CD1-CD1 4.06Å; I702-F717 HydrophobicContact CG1-CD1 3.58Å; I702-F717 HydrophobicContact CG1-CE1 3.87Å; F717-G719 VanDerWaalsContact C-N 3.26Å
718	D	88.6	Confident	90.4	Very high	89 Å²	89	55.1 Å²	55.1	48%	0.476	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.5	2.4	171.5	69.9	-7.5	0	0	0	113.6	S716 R720	S716-D718 WeakPolarHBondContact CB-OD1 3.47Å; S716-D718 PolarHBondContact O-N 3.05Å; S716-D718 PolarHBondContact OG-OD1 3.11Å; D718-R720 WeakPolarHBondContact OD1-CG 3.37Å; D718-R720 PolarHBondContact OD1-N 3.29Å; D718-R720 VanDerWaalsContact OD2-CD 3.24Å; D718-R720 WeakPolarHBondContact OD2-CD 3.23Å; D718-R720 IonicContact OD2-CZ 3Å; D718-R720 IonicContact OD2-NE 3.07Å; D718-R720 PolarHBondContact OD2-NE 3.21Å; D718-R720 IonicContact OD2-NH1 3.13Å; D718-R720 PolarHBondContact OD2-NH1 3.13Å; D718-R720 VanDerWaalsContact OD2-NH1 3.13Å; D718-R720 IonicContact OD2-NH2 3.61Å
719	G	87.1	Confident	90.2	Very high	26 Å²	26	55.6 Å²	55.6	27%	0.268	28%	0.278	S	S	.	.	S	Bend	trans	86.5	2	177.1	0	0	0	0	0	115.5	S716 F717	S716-G719 PolarHBondContact O-N 3Å; F717-G719 VanDerWaalsContact C-N 3.26Å
720	R	90.2	Very high	90.2	Very high	179 Å²	179	53.9 Å²	53.9	68%	0.675	27%	0.272	S	S	*	.			trans	-76.6	138.9	177.7	-59.6	174.9	-172.3	151.8	6.1	111.2	F715 S716 D718	F715-R720 CarbonylContact C-O 3.49Å; F715-R720 WeakPolarHBondContact CA-O 3.25Å; S716-R720 PolarHBondContact N-O 3.11Å; S716-R720 PolarHBondContact OG-O 2.95Å; D718-R720 WeakPolarHBondContact OD1-CG 3.37Å; D718-R720 PolarHBondContact OD1-N 3.29Å; D718-R720 VanDerWaalsContact OD2-CD 3.24Å; D718-R720 WeakPolarHBondContact OD2-CD 3.23Å; D718-R720 IonicContact OD2-CZ 3Å; D718-R720 IonicContact OD2-NE 3.07Å; D718-R720 PolarHBondContact OD2-NE 3.21Å; D718-R720 IonicContact OD2-NH1 3.13Å; D718-R720 PolarHBondContact OD2-NH1 3.13Å; D718-R720 VanDerWaalsContact OD2-NH1 3.13Å; D718-R720 IonicContact OD2-NH2 3.61Å
721	S	91.1	Very high	90	Very high	44 Å²	44	56.1 Å²	56.1	31%	0.308	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	135.9	175.1	-162.7	0	0	0	0	111	R713 L714	R713-S721 PolarHBondContact NH2-OG 3.33Å; L714-S721 PolarHBondContact O-OG 3.08Å
722	Q	89.8	Confident	89.8	Confident	94 Å²	94	56.8 Å²	56.8	44%	0.439	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	0.8	177.1	-64.4	-171	-3	0	0	112.8	L714 S716	L714-Q722 HydrophobicContact CB-CB 3.9Å; L714-Q722 PolarHBondContact O-N 2.83Å; S716-Q722 VanDerWaalsContact CB-NE2 3.3Å
723	G	89.9	Confident	89.8	Confident	30 Å²	30	56.8 Å²	56.8	31%	0.309	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	109.5	-146.4	179.1	0	0	0	0	0	113.6	L714	L714-G723 PolarHBondContact N-O 3.49Å
724	I	91.7	Very high	89.9	Confident	69 Å²	69	57.3 Å²	57.3	35%	0.354	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	149.9	-174.5	65.1	-180	0	0	0	110.9	E711 I712 T726	E711-I724 HydrophobicContact CG-CG2 4.36Å; I712-I724 WeakPolarHBondContact O-CA 3.41Å; I724-T726 WeakPolarHBondContact CD1-O 3.49Å
725	L	89.3	Confident	90	Very high	16 Å²	16	56.2 Å²	56.2	8%	0.084	28%	0.279	C	S	.	.	S	Bend	trans	-67.6	-40.8	-178.7	-177.7	73.2	0	0	0	112.8	I712 L714 L743 V745 Y756 I758 N763	I712-L725 HydrophobicContact CB-CB 3.81Å; I712-L725 HydrophobicContact CB-CD2 4.14Å; I712-L725 HydrophobicContact CG1-CD2 3.99Å; I712-L725 HydrophobicContact CG2-CB 4.3Å; I712-L725 PolarHBondContact O-N 3.33Å; L714-L725 HydrophobicContact CD1-CB 4.06Å; L714-L725 VanDerWaalsContact CD1-N 3.28Å; L725-L743 HydrophobicContact CD1-CD2 3.91Å; L725-L743 HydrophobicContact CD2-CD2 3.59Å; L725-L743 HydrophobicContact CG-CD2 4.36Å; L725-V745 HydrophobicContact CD2-CG2 4.25Å; L725-Y756 HydrophobicContact CD2-CD1 4.06Å; L725-Y756 HydrophobicContact CD2-CD2 3.65Å; L725-Y756 HydrophobicContact CD2-CE1 4.33Å; L725-Y756 HydrophobicContact CD2-CE2 3.94Å; L725-Y756 HydrophobicContact CD2-CG 3.72Å; L725-Y756 HydrophobicContact CG-CD1 4.33Å; L725-Y756 HydrophobicContact CG-CG 4.34Å; L725-I758 HydrophobicContact CD1-CG2 4.19Å; L725-N763 PolarHBondContact O-OD1 2.91Å; L725-N763 VanDerWaalsContact O-OD1 3.14Å
726	T	83.5	Confident	90.1	Very high	6 Å²	6	56.1 Å²	56.1	4%	0.037	28%	0.279	C	S	.	.			trans	-129.3	143.5	-172.3	59	0	0	0	0	111.3	I724 N728 Y756 N763	I724-T726 WeakPolarHBondContact CD1-O 3.49Å; T726-N728 VanDerWaalsContact C-N 3.34Å; T726-N728 PolarHBondContact OG1-O 3.41Å; T726-Y756 HydrophobicContact CG2-CD1 4.12Å; T726-Y756 HydrophobicContact CG2-CE1 3.31Å; T726-N763 WeakPolarHBondContact CG2-O 3.45Å
727	K	78.1	Confident	90.3	Very high	176 Å²	176	55.6 Å²	55.6	77%	0.765	28%	0.275	S	S	*	.	S	Bend	trans	-70.7	-33.7	171.1	-68.3	-177.4	178.5	177	0	112.1
728	N	84.2	Confident	90.4	Very high	133 Å²	133	54.7 Å²	54.7	71%	0.711	27%	0.27	S	S	*	.	S	Bend	trans	-84.7	141.8	177.8	-67.6	-28.3	0	0	0	110.4	T726 L730	T726-N728 VanDerWaalsContact C-N 3.34Å; T726-N728 PolarHBondContact OG1-O 3.41Å; N728-L730 PolarHBondContact O-N 2.86Å
729	K	88.1	Confident	90.5	Very high	101 Å²	101	51.1 Å²	51.1	44%	0.439	26%	0.255	S	S	.	.			trans	-65.7	131.4	172.6	-67.3	-62.7	-173.5	177.6	0	110.6	R709 D710 E711	R709-K729 WeakPolarHBondContact O-CD 3.35Å; R709-K729 WeakPolarHBondContact O-CE 3.45Å; R709-K729 PolarHBondContact O-NZ 3.49Å; D710-K729 HydrophobicContact CB-CB 4.09Å; D710-K729 HydrophobicContact CB-CD 4.01Å; D710-K729 HydrophobicContact CB-CG 4.49Å; D710-K729 WeakPolarHBondContact O-CA 3.29Å; E711-K729 IonicContact OE2-NZ 3.97Å; E711-K729 PolarHBondContact OE2-NZ 3.37Å
730	L	91.5	Very high	90.3	Very high	4 Å²	4	53.8 Å²	53.8	2%	0.021	26%	0.262	C	S	.	.			trans	-73.2	174.7	168.3	-57.4	177.7	0	0	0	109.1	D710 I712 N728 P733 V745 E747 Y756	D710-L730 VanDerWaalsContact CB-O 3.29Å; D710-L730 WeakPolarHBondContact CB-O 3.47Å; D710-L730 VanDerWaalsContact CG-O 3.29Å; D710-L730 PolarHBondContact O-N 3.27Å; I712-L730 HydrophobicContact CD1-CD1 4.21Å; I712-L730 HydrophobicContact CG1-CD1 3.81Å; N728-L730 PolarHBondContact O-N 2.86Å; L730-P733 HydrophobicContact CB-CB 4.22Å; L730-P733 HydrophobicContact CB-CG 4.21Å; L730-P733 HydrophobicContact CD1-CB 3.95Å; L730-P733 HydrophobicContact CD1-CG 4.43Å; L730-V745 HydrophobicContact CD1-CG1 3.94Å; L730-E747 HydrophobicContact CB-CG 4.42Å; L730-Y756 VanDerWaalsContact CD2-OH 3.29Å; L730-Y756 WeakPolarHBondContact CD2-OH 3.46Å
731	K	91.1	Very high	90.1	Very high	85 Å²	85	45.9 Å²	45.9	37%	0.37	24%	0.236	S	C	.	.	S	Bend	trans	-121.1	103.7	176.7	-66.1	-64.5	179	-171	0	110.2	E747 R749 R750	K731-E747 PolarHBondContact N-OE2 3.22Å; K731-E747 CarbonylContact O-C 3.59Å; K731-E747 WeakPolarHBondContact O-CA 3.33Å; K731-R749 HydrophobicContact CB-CB 4.14Å; K731-R750 HydrophobicContact CB-CG 3.92Å; K731-R750 HydrophobicContact CG-CG 4.12Å
732	H	91.3	Very high	90.1	Very high	26 Å²	26	45.2 Å²	45.2	12%	0.12	23%	0.229	C	C	.	.	S	Bend	trans	52.3	62.1	-175.4	-66.5	173.3	0	0	0	112	Y707 D710 R734 S748 R749	Y707-H732 HydrophobicContact CD2-CB 4.12Å; Y707-H732 HydrophobicContact CE2-CB 3.55Å; Y707-H732 AromaticContact CE2-CD2 3.75Å; Y707-H732 AromaticContact CE2-CG 3.51Å; Y707-H732 AromaticContact CZ-CD2 3.62Å; Y707-H732 AromaticContact CZ-CG 3.75Å; Y707-H732 AromaticContact CZ-NE2 3.89Å; Y707-H732 PolarHBondContact OH-CD2 2.97Å; Y707-H732 PolarHBondContact OH-CE1 3.04Å; Y707-H732 VanDerWaalsContact OH-CE1 3.23Å; Y707-H732 PolarHBondContact OH-ND1 3.05Å; Y707-H732 PolarHBondContact OH-NE2 2.78Å; D710-H732 PolarHBondContact OD1-N 3.42Å; H732-R734 PolarHBondContact O-N 3.41Å; H732-S748 WeakPolarHBondContact CB-OG 3.48Å; H732-S748 PolarHBondContact O-N 3.11Å; H732-S748 VanDerWaalsContact O-N 3.15Å; H732-R749 HydrophobicContact CB-CB 3.97Å; H732-R749 PolarHBondContact CE1-NH1 2.97Å
733	P	95.1	Very high	90.3	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.5	121.8	173.7	29	-33.1	0	0	0	109.4	I712 L730 V745 V746	I712-P733 HydrophobicContact CD1-CB 4.11Å; L730-P733 HydrophobicContact CB-CB 4.22Å; L730-P733 HydrophobicContact CB-CG 4.21Å; L730-P733 HydrophobicContact CD1-CB 3.95Å; L730-P733 HydrophobicContact CD1-CG 4.43Å; P733-V745 HydrophobicContact CB-CG1 4.22Å; P733-V746 VanDerWaalsContact CA-O 3.3Å; P733-V746 WeakPolarHBondContact CA-O 3.42Å
734	R	95.2	Very high	90.5	Very high	23 Å²	23	39.3 Å²	39.3	9%	0.087	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	-105.6	178.5	-72.2	-174.4	173.7	163.9	-2.3	110	F691 D692 S705 Y707 H732 V736 V746 E795 Y797	F691-R734 HydrophobicContact CD1-CB 3.79Å; F691-R734 HydrophobicContact CD1-CG 4.09Å; F691-R734 HydrophobicContact CD2-CG 4.49Å; F691-R734 HydrophobicContact CE1-CB 3.72Å; F691-R734 HydrophobicContact CE1-CG 3.96Å; F691-R734 HydrophobicContact CE2-CG 4.36Å; F691-R734 HydrophobicContact CG-CB 4.48Å; F691-R734 HydrophobicContact CG-CG 4.37Å; F691-R734 HydrophobicContact CZ-CB 4.34Å; F691-R734 HydrophobicContact CZ-CG 4.1Å; D692-R734 WeakPolarHBondContact CB-O 3.27Å; S705-R734 WeakPolarHBondContact CB-O 3.33Å; S705-R734 PolarHBondContact OG-O 3.3Å; Y707-R734 HydrophobicContact CD2-CG 4.09Å; Y707-R734 HydrophobicContact CE2-CG 4.44Å; H732-R734 PolarHBondContact O-N 3.41Å; R734-V736 PolarHBondContact O-N 3.36Å; R734-V746 PolarHBondContact N-O 2.77Å; R734-E795 IonicContact NH1-OE2 2.77Å; R734-E795 PolarHBondContact NH1-OE2 3.41Å; R734-Y797 WeakPolarHBondContact CB-O 3.36Å; R734-Y797 VanDerWaalsContact NH1-CD2 3.3Å; R734-Y797 VanDerWaalsContact NH1-CE2 3.28Å
735	G	96	Very high	90.7	Very high	0 Å²	0	36 Å²	36	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-54	135.1	179.3	0	0	0	0	0	112.9	D692 V746 Y797	D692-G735 VanDerWaalsContact OD2-CA 3.32Å; D692-G735 WeakPolarHBondContact OD2-CA 3.41Å; G735-V746 PolarHBondContact O-N 3.24Å; G735-Y797 VanDerWaalsContact CA-O 3.24Å; G735-Y797 WeakPolarHBondContact CA-O 3.33Å; G735-Y797 PolarHBondContact N-O 3.46Å
736	V	97.2	Very high	91	Very high	3 Å²	3	35.3 Å²	35.3	2%	0.018	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	129.8	173.8	65.6	0	0	0	0	109.8	D692 T694 F703 I712 R734 L743 A744 V745	D692-V736 HydrophobicContact CB-CG1 4.09Å; D692-V736 PolarHBondContact OD2-N 3.18Å; T694-V736 HydrophobicContact CG2-CB 4.48Å; T694-V736 HydrophobicContact CG2-CG1 4.13Å; T694-V736 HydrophobicContact CG2-CG2 3.87Å; F703-V736 HydrophobicContact CB-CG2 4.49Å; I712-V736 HydrophobicContact CD1-CG2 4.46Å; R734-V736 PolarHBondContact O-N 3.36Å; V736-L743 HydrophobicContact CG2-CD1 3.65Å; V736-L743 HydrophobicContact CG2-CD2 4.36Å; V736-L743 HydrophobicContact CG2-CG 4.03Å; V736-A744 WeakPolarHBondContact CA-O 2.94Å; V736-V745 HydrophobicContact CG2-CG2 4.21Å
737	C	96	Very high	91.4	Very high	8 Å²	8	35 Å²	35	5%	0.054	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	136.3	176.6	-179.6	0	0	0	0	109.8	L743 A744 V799 E800 F801	C737-L743 WeakPolarHBondContact O-CA 3.35Å; C737-A744 PolarHBondContact N-O 3.41Å; C737-A744 PolarHBondContact O-N 3.35Å; C737-V799 HydrophobicContact CB-CG1 4.1Å; C737-V799 VanDerWaalsContact CB-O 3.25Å; C737-V799 WeakPolarHBondContact CB-O 3.27Å; C737-E800 PolarHBondContact SG-OE2 3.23Å; C737-F801 HydrophobicContact CB-CD2 4.21Å; C737-F801 VanDerWaalsContact O-CE2 3.26Å; C737-F801 WeakPolarHBondContact O-CE2 3.18Å
738	Y	94.1	Very high	92	Very high	36 Å²	36	26.6 Å²	26.6	14%	0.141	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	124.4	174.8	176.9	-99.1	0	0	0	109.2	T694 S696 R699 F703 L742 L743 I758	T694-Y738 PolarHBondContact OG1-N 2.63Å; T694-Y738 VanDerWaalsContact OG1-N 3.07Å; S696-Y738 VanDerWaalsContact CB-CE1 3.48Å; S696-Y738 WeakPolarHBondContact OG-CE1 3.49Å; R699-Y738 PolarHBondContact NH1-OH 3.27Å; F703-Y738 HydrophobicContact CE2-CD2 4.26Å; F703-Y738 HydrophobicContact CE2-CG 4.29Å; Y738-L742 VanDerWaalsContact CD2-O 3.24Å; Y738-L742 WeakPolarHBondContact CD2-O 3.45Å; Y738-L743 HydrophobicContact CD2-CB 4.38Å; Y738-L743 HydrophobicContact CD2-CD1 4.25Å; Y738-L743 HydrophobicContact CG-CD1 4.49Å; Y738-I758 HydrophobicContact CD2-CD1 4.01Å; Y738-I758 HydrophobicContact CE2-CD1 3.24Å; Y738-I758 HydrophobicContact CE2-CG1 3.9Å
739	G	89.7	Confident	92.1	Very high	15 Å²	15	25.5 Å²	25.5	16%	0.155	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-165.4	156.6	-178.2	0	0	0	0	0	110.5	G741 L742	G739-G741 PolarHBondContact O-N 2.63Å; G739-L742 PolarHBondContact N-O 3.05Å; G739-L742 PolarHBondContact O-N 3.23Å
740	I	84.3	Confident	92	Very high	82 Å²	82	25.9 Å²	25.9	42%	0.421	12%	0.119	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.4	25.7	175.9	65.7	164	0	0	0	115.6	L742 F801 D803 L824	I740-L742 VanDerWaalsContact C-N 3.33Å; I740-L742 HydrophobicContact CD1-CD1 4.47Å; I740-F801 HydrophobicContact CD1-CD1 3.93Å; I740-F801 HydrophobicContact CD1-CE1 3.93Å; I740-F801 HydrophobicContact CG1-CD1 3.9Å; I740-F801 HydrophobicContact CG1-CE1 3.93Å; I740-F801 HydrophobicContact CG1-CG 4.48Å; I740-D803 HydrophobicContact CG2-CB 4.01Å; I740-L824 HydrophobicContact CD1-CD1 3.25Å; I740-L824 HydrophobicContact CD1-CG 4.47Å
741	G	85.4	Confident	91.8	Very high	13 Å²	13	29.6 Å²	29.6	13%	0.134	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	83.9	-0.9	-177.4	0	0	0	0	0	115.5	G739	G739-G741 PolarHBondContact O-N 2.63Å
742	L	90.6	Very high	91.7	Very high	30 Å²	30	26.6 Å²	26.6	16%	0.157	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	155.6	178.3	-61.8	178.3	0	0	0	111.3	Y738 G739 I740 Y756 D757 V766 F801	Y738-L742 VanDerWaalsContact CD2-O 3.24Å; Y738-L742 WeakPolarHBondContact CD2-O 3.45Å; G739-L742 PolarHBondContact N-O 3.05Å; G739-L742 PolarHBondContact O-N 3.23Å; I740-L742 VanDerWaalsContact C-N 3.33Å; I740-L742 HydrophobicContact CD1-CD1 4.47Å; L742-Y756 CarbonylContact C-O 3.6Å; L742-Y756 WeakPolarHBondContact CA-O 3.22Å; L742-D757 HydrophobicContact CD2-CB 3.75Å; L742-V766 HydrophobicContact CD2-CG2 4.17Å; L742-F801 HydrophobicContact CB-CE1 4.28Å; L742-F801 HydrophobicContact CB-CZ 3.71Å; L742-F801 WeakPolarHBondContact O-CE2 3.49Å
743	L	93.8	Very high	91.8	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	116.8	169.6	-173.5	76.4	0	0	0	108.7	T694 F703 I712 L725 V736 C737 Y738 V745 L755 Y756 I758	T694-L743 HydrophobicContact CG2-CD1 3.77Å; F703-L743 HydrophobicContact CB-CD1 4.12Å; F703-L743 HydrophobicContact CD1-CD1 4.17Å; F703-L743 HydrophobicContact CD1-CD2 3.73Å; F703-L743 HydrophobicContact CD2-CD1 4.02Å; F703-L743 HydrophobicContact CE1-CD2 4.13Å; F703-L743 HydrophobicContact CE2-CD1 4.5Å; F703-L743 HydrophobicContact CG-CD1 3.84Å; F703-L743 HydrophobicContact CG-CD2 4.21Å; I712-L743 HydrophobicContact CG2-CD2 4.4Å; L725-L743 HydrophobicContact CD1-CD2 3.91Å; L725-L743 HydrophobicContact CD2-CD2 3.59Å; L725-L743 HydrophobicContact CG-CD2 4.36Å; V736-L743 HydrophobicContact CG2-CD1 3.65Å; V736-L743 HydrophobicContact CG2-CD2 4.36Å; V736-L743 HydrophobicContact CG2-CG 4.03Å; C737-L743 WeakPolarHBondContact O-CA 3.35Å; Y738-L743 HydrophobicContact CD2-CB 4.38Å; Y738-L743 HydrophobicContact CD2-CD1 4.25Å; Y738-L743 HydrophobicContact CG-CD1 4.49Å; L743-V745 HydrophobicContact CD2-CG2 4.17Å; L743-V745 HydrophobicContact CG-CG2 4.22Å; L743-L755 WeakPolarHBondContact O-CA 3.4Å; L743-Y756 PolarHBondContact N-O 3.47Å; L743-Y756 PolarHBondContact O-N 3.2Å; L743-I758 HydrophobicContact CB-CG2 4.03Å
744	A	95.2	Very high	91.7	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	130.9	172.8	0	0	0	0	0	109.7	V736 C737 I753 L755 V799 F801 L809	V736-A744 WeakPolarHBondContact CA-O 2.94Å; C737-A744 PolarHBondContact N-O 3.41Å; C737-A744 PolarHBondContact O-N 3.35Å; A744-I753 HydrophobicContact CB-CG2 4.07Å; A744-L755 HydrophobicContact CB-CD2 3.59Å; A744-V799 HydrophobicContact CB-CG1 4.04Å; A744-V799 HydrophobicContact CB-CG2 4.01Å; A744-F801 HydrophobicContact CB-CD2 4.49Å; A744-F801 HydrophobicContact CB-CE2 3.66Å; A744-F801 HydrophobicContact CB-CZ 3.7Å; A744-L809 HydrophobicContact CB-CD2 3.92Å
745	V	95.8	Very high	91.5	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	119.7	179.4	-178.6	0	0	0	0	109.6	I712 L725 L730 P733 V736 L743 E747 I753 S754 Y756	I712-V745 HydrophobicContact CD1-CG1 3.8Å; I712-V745 HydrophobicContact CD1-CG2 4.14Å; I712-V745 HydrophobicContact CG1-CG1 4.14Å; I712-V745 HydrophobicContact CG1-CG2 3.87Å; L725-V745 HydrophobicContact CD2-CG2 4.25Å; L730-V745 HydrophobicContact CD1-CG1 3.94Å; P733-V745 HydrophobicContact CB-CG1 4.22Å; V736-V745 HydrophobicContact CG2-CG2 4.21Å; L743-V745 HydrophobicContact CD2-CG2 4.17Å; L743-V745 HydrophobicContact CG-CG2 4.22Å; V745-E747 PolarHBondContact O-N 3.45Å; V745-I753 CarbonylContact O-C 3.59Å; V745-I753 VanDerWaalsContact O-CA 3.31Å; V745-I753 WeakPolarHBondContact O-CA 3.31Å; V745-S754 PolarHBondContact N-O 2.98Å; V745-S754 PolarHBondContact O-N 3.45Å; V745-Y756 HydrophobicContact CB-CE2 4.2Å; V745-Y756 HydrophobicContact CG2-CD2 3.97Å; V745-Y756 HydrophobicContact CG2-CE2 3.97Å
746	V	95.3	Very high	91.3	Very high	0 Å²	0	25 Å²	25	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	118.6	173.6	177.6	0	0	0	0	109.6	P733 R734 G735 I753 P796 V799	P733-V746 VanDerWaalsContact CA-O 3.3Å; P733-V746 WeakPolarHBondContact CA-O 3.42Å; R734-V746 PolarHBondContact N-O 2.77Å; G735-V746 PolarHBondContact O-N 3.24Å; V746-I753 HydrophobicContact CG2-CG1 4.32Å; V746-P796 HydrophobicContact CG1-CB 3.67Å; V746-P796 HydrophobicContact CG1-CG 3.78Å; V746-P796 VanDerWaalsContact CG1-O 3.25Å; V746-P796 WeakPolarHBondContact CG1-O 3.38Å; V746-V799 HydrophobicContact CG2-CB 3.66Å; V746-V799 HydrophobicContact CG2-CG1 3.73Å
747	E	92.3	Very high	91	Very high	0 Å²	0	26 Å²	26	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	85.5	170.8	-63.3	-172.2	-108	0	0	108.7	L730 K731 V745 R749 R750 H751 H752 S754	L730-E747 HydrophobicContact CB-CG 4.42Å; K731-E747 PolarHBondContact N-OE2 3.22Å; K731-E747 CarbonylContact O-C 3.59Å; K731-E747 WeakPolarHBondContact O-CA 3.33Å; V745-E747 PolarHBondContact O-N 3.45Å; E747-R749 PolarHBondContact O-N 2.88Å; E747-R749 VanDerWaalsContact O-N 3.12Å; E747-R750 HydrophobicContact CB-CB 4.12Å; E747-R750 PolarHBondContact O-N 3.26Å; E747-R750 IonicContact OE1-NH1 2.62Å; E747-R750 WeakPolarHBondContact OE2-CD 3.47Å; E747-R750 IonicContact OE2-CZ 3.07Å; E747-R750 IonicContact OE2-NE 3.97Å; E747-R750 IonicContact OE2-NH1 3.92Å; E747-R750 PolarHBondContact OE2-NH1 3.41Å; E747-H751 PolarHBondContact O-N 2.96Å; E747-H751 VanDerWaalsContact O-N 3.15Å; E747-H752 VanDerWaalsContact CD-NE2 3.3Å; E747-H752 PolarHBondContact N-O 3.35Å; E747-H752 IonicContact OE1-CD2 2.75Å; E747-H752 IonicContact OE1-CE1 2.77Å; E747-H752 IonicContact OE1-NE2 3.09Å; E747-H752 PolarHBondContact OE1-NE2 3.12Å; E747-H752 IonicContact OE2-NE2 3.36Å; E747-S754 WeakPolarHBondContact OE1-CB 3.4Å; E747-S754 PolarHBondContact OE1-OG 3.04Å
748	S	88.8	Confident	90.4	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	13%	0.129	C	C	.	.	G	3₁₀ helix	trans	-60.2	-34.5	-164.2	81.5	0	0	0	0	112.8	H732 H751 P796	H732-S748 WeakPolarHBondContact CB-OG 3.48Å; H732-S748 PolarHBondContact O-N 3.11Å; H732-S748 VanDerWaalsContact O-N 3.15Å; S748-H751 PolarHBondContact O-N 2.85Å; S748-H751 VanDerWaalsContact O-N 3.17Å; S748-H751 PolarHBondContact O-ND1 2.88Å; S748-P796 VanDerWaalsContact CB-O 3.29Å; S748-P796 WeakPolarHBondContact CB-O 3.41Å
749	R	86.4	Confident	89.8	Confident	109 Å²	109	33 Å²	33	41%	0.411	15%	0.149	S	C	.	.	G	3₁₀ helix	trans	-76.5	-20.5	179.5	-166.4	179	178.7	116.4	10.8	114	E559 K731 H732 E747 H751	E559-R749 IonicContact OE1-CZ 2.76Å; E559-R749 IonicContact OE1-NH1 3.28Å; E559-R749 PolarHBondContact OE1-NH1 2.9Å; E559-R749 IonicContact OE1-NH2 3.04Å; E559-R749 PolarHBondContact OE1-NH2 2.89Å; E559-R749 IonicContact OE2-NH1 2.86Å; E559-R749 PolarHBondContact OE2-NH1 3.13Å; E559-R749 VanDerWaalsContact OE2-NH1 3.14Å; K731-R749 HydrophobicContact CB-CB 4.14Å; H732-R749 HydrophobicContact CB-CB 3.97Å; H732-R749 PolarHBondContact CE1-NH1 2.97Å; E747-R749 PolarHBondContact O-N 2.88Å; E747-R749 VanDerWaalsContact O-N 3.12Å; R749-H751 VanDerWaalsContact C-N 3.33Å
750	R	86.1	Confident	89.1	Confident	109 Å²	109	34.8 Å²	34.8	41%	0.411	16%	0.159	S	C	.	.	G	3₁₀ helix	trans	-91.7	-2.2	170.7	-74.6	179.1	-179.3	161.3	-3.5	111.9	K731 E747 H752	K731-R750 HydrophobicContact CB-CG 3.92Å; K731-R750 HydrophobicContact CG-CG 4.12Å; E747-R750 HydrophobicContact CB-CB 4.12Å; E747-R750 PolarHBondContact O-N 3.26Å; E747-R750 IonicContact OE1-NH1 2.62Å; E747-R750 WeakPolarHBondContact OE2-CD 3.47Å; E747-R750 IonicContact OE2-CZ 3.07Å; E747-R750 IonicContact OE2-NE 3.97Å; E747-R750 IonicContact OE2-NH1 3.92Å; E747-R750 PolarHBondContact OE2-NH1 3.41Å; R750-H752 WeakPolarHBondContact CD-CE1 3.37Å; R750-H752 PolarHBondContact O-N 3.17Å
751	H	88.2	Confident	88.3	Confident	82 Å²	82	38.3 Å²	38.3	38%	0.38	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.5	33.7	-177.6	-51.4	-65.3	0	0	0	112.6	E747 S748 R749 P770 T794 E795	E747-H751 PolarHBondContact O-N 2.96Å; E747-H751 VanDerWaalsContact O-N 3.15Å; S748-H751 PolarHBondContact O-N 2.85Å; S748-H751 VanDerWaalsContact O-N 3.17Å; S748-H751 PolarHBondContact O-ND1 2.88Å; R749-H751 VanDerWaalsContact C-N 3.33Å; H751-P770 WeakPolarHBondContact O-CD 3.39Å; H751-T794 PolarHBondContact CE1-O 3.29Å; H751-T794 PolarHBondContact ND1-O 3.07Å; H751-E795 IonicContact CE1-OE1 2.91Å
752	H	89.9	Confident	87.2	Confident	23 Å²	23	41.7 Å²	41.7	11%	0.106	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	172	-178.5	73.2	-150	0	0	0	113.1	E747 R750 S754 Q768 I769	E747-H752 VanDerWaalsContact CD-NE2 3.3Å; E747-H752 PolarHBondContact N-O 3.35Å; E747-H752 IonicContact OE1-CD2 2.75Å; E747-H752 IonicContact OE1-CE1 2.77Å; E747-H752 IonicContact OE1-NE2 3.09Å; E747-H752 PolarHBondContact OE1-NE2 3.12Å; E747-H752 IonicContact OE2-NE2 3.36Å; R750-H752 WeakPolarHBondContact CD-CE1 3.37Å; R750-H752 PolarHBondContact O-N 3.17Å; H752-S754 PolarHBondContact NE2-OG 2.8Å; H752-Q768 PolarHBondContact CE1-NE2 2.8Å; H752-I769 CarbonylContact C-O 3.54Å; H752-I769 VanDerWaalsContact C-O 3.31Å; H752-I769 WeakPolarHBondContact CA-O 3.44Å; H752-I769 VanDerWaalsContact CB-O 3.28Å; H752-I769 WeakPolarHBondContact CB-O 3.48Å
753	I	92.6	Very high	86.6	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	120.4	175.5	-56.2	148.7	0	0	0	106.4	A744 V745 V746 L755 Q768 I769 L793 V799 V811	A744-I753 HydrophobicContact CB-CG2 4.07Å; V745-I753 CarbonylContact O-C 3.59Å; V745-I753 VanDerWaalsContact O-CA 3.31Å; V745-I753 WeakPolarHBondContact O-CA 3.31Å; V746-I753 HydrophobicContact CG2-CG1 4.32Å; I753-L755 HydrophobicContact CG2-CD2 3.91Å; I753-Q768 CarbonylContact O-C 3.55Å; I753-Q768 VanDerWaalsContact O-CA 3.25Å; I753-Q768 WeakPolarHBondContact O-CA 3.42Å; I753-I769 HydrophobicContact CB-CB 4.4Å; I753-I769 HydrophobicContact CD1-CB 4.45Å; I753-I769 HydrophobicContact CD1-CG2 4.39Å; I753-I769 PolarHBondContact N-O 3.14Å; I753-I769 PolarHBondContact O-N 2.81Å; I753-L793 HydrophobicContact CD1-CD1 3.75Å; I753-L793 HydrophobicContact CG1-CD1 3.99Å; I753-V799 HydrophobicContact CG2-CG2 4.39Å; I753-V811 HydrophobicContact CD1-CB 4.29Å; I753-V811 HydrophobicContact CD1-CG1 4.12Å; I753-V811 HydrophobicContact CD1-CG2 3.26Å; I753-V811 HydrophobicContact CG1-CG2 4.38Å
754	S	92.4	Very high	86.2	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	125.6	175.1	-76.8	0	0	0	0	109.2	V745 E747 H752 Y756 Q768	V745-S754 PolarHBondContact N-O 2.98Å; V745-S754 PolarHBondContact O-N 3.45Å; E747-S754 WeakPolarHBondContact OE1-CB 3.4Å; E747-S754 PolarHBondContact OE1-OG 3.04Å; H752-S754 PolarHBondContact NE2-OG 2.8Å; S754-Y756 VanDerWaalsContact CB-CE2 3.46Å; S754-Q768 PolarHBondContact OG-NE2 2.92Å
755	L	92.2	Very high	85.8	Confident	3 Å²	3	48.2 Å²	48.2	2%	0.016	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	127.4	175.6	-53.5	-173	0	0	0	109.3	L743 A744 I753 P765 V766 H767 I769 F801 L809 L824	L743-L755 WeakPolarHBondContact O-CA 3.4Å; A744-L755 HydrophobicContact CB-CD2 3.59Å; I753-L755 HydrophobicContact CG2-CD2 3.91Å; L755-P765 CarbonylContact O-C 3.52Å; L755-P765 WeakPolarHBondContact O-CA 3.46Å; L755-P765 WeakPolarHBondContact O-CB 3.4Å; L755-V766 HydrophobicContact CB-CG2 4.19Å; L755-V766 VanDerWaalsContact O-CG2 3.31Å; L755-V766 WeakPolarHBondContact O-CG2 3.33Å; L755-V766 PolarHBondContact O-N 3.21Å; L755-H767 HydrophobicContact CB-CB 4.32Å; L755-H767 HydrophobicContact CD1-CB 4.19Å; L755-H767 HydrophobicContact CG-CB 4.47Å; L755-H767 PolarHBondContact N-O 3.01Å; L755-H767 PolarHBondContact O-N 3.11Å; L755-I769 HydrophobicContact CD1-CD1 4.21Å; L755-F801 HydrophobicContact CD2-CZ 4.49Å; L755-L809 HydrophobicContact CD1-CD1 4.07Å; L755-L809 HydrophobicContact CD2-CD1 3.69Å; L755-L809 HydrophobicContact CG-CD1 4.47Å; L755-L824 HydrophobicContact CD1-CD2 3.65Å
756	Y	92.1	Very high	85.3	Confident	11 Å²	11	51.9 Å²	51.9	4%	0.043	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	132.5	178.1	-64	-93.5	0	0	0	109.6	L725 T726 L730 L742 L743 V745 S754 P765	L725-Y756 HydrophobicContact CD2-CD1 4.06Å; L725-Y756 HydrophobicContact CD2-CD2 3.65Å; L725-Y756 HydrophobicContact CD2-CE1 4.33Å; L725-Y756 HydrophobicContact CD2-CE2 3.94Å; L725-Y756 HydrophobicContact CD2-CG 3.72Å; L725-Y756 HydrophobicContact CG-CD1 4.33Å; L725-Y756 HydrophobicContact CG-CG 4.34Å; T726-Y756 HydrophobicContact CG2-CD1 4.12Å; T726-Y756 HydrophobicContact CG2-CE1 3.31Å; L730-Y756 VanDerWaalsContact CD2-OH 3.29Å; L730-Y756 WeakPolarHBondContact CD2-OH 3.46Å; L742-Y756 CarbonylContact C-O 3.6Å; L742-Y756 WeakPolarHBondContact CA-O 3.22Å; L743-Y756 PolarHBondContact N-O 3.47Å; L743-Y756 PolarHBondContact O-N 3.2Å; V745-Y756 HydrophobicContact CB-CE2 4.2Å; V745-Y756 HydrophobicContact CG2-CD2 3.97Å; V745-Y756 HydrophobicContact CG2-CE2 3.97Å; S754-Y756 VanDerWaalsContact CB-CE2 3.46Å; Y756-P765 HydrophobicContact CD1-CB 4.42Å; Y756-P765 HydrophobicContact CE1-CB 4.03Å; Y756-P765 HydrophobicContact CE1-CG 4.4Å; Y756-P765 VanDerWaalsContact CE1-N 3.34Å; Y756-P765 HydrophobicContact CE2-CB 4.43Å
757	D	89.2	Confident	84.8	Confident	24 Å²	24	54.6 Å²	54.6	13%	0.128	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	108.3	165.1	-168.8	-23.6	0	0	0	108.4	L742 R759 C760 V766	L742-D757 HydrophobicContact CD2-CB 3.75Å; D757-R759 PolarHBondContact O-N 3.01Å; D757-R759 VanDerWaalsContact O-N 3.17Å; D757-R759 WeakPolarHBondContact OD1-CB 3.35Å; D757-R759 WeakPolarHBondContact OD1-CG 3.34Å; D757-R759 IonicContact OD1-CZ 3.14Å; D757-R759 PolarHBondContact OD1-N 2.97Å; D757-R759 IonicContact OD1-NE 3.84Å; D757-R759 PolarHBondContact OD1-NE 3.43Å; D757-R759 IonicContact OD1-NH2 3.1Å; D757-R759 IonicContact OD2-CZ 3.83Å; D757-R759 IonicContact OD2-NE 3.23Å; D757-R759 PolarHBondContact OD2-NE 2.83Å; D757-R759 IonicContact OD2-NH2 2.74Å; D757-R759 PolarHBondContact OD2-NH2 3.43Å; D757-C760 HydrophobicContact CB-CB 4.26Å; D757-C760 WeakPolarHBondContact O-CB 3.44Å; D757-C760 PolarHBondContact O-N 3.07Å; D757-V766 HydrophobicContact CB-CG1 3.74Å; D757-V766 HydrophobicContact CB-CG2 4.45Å
758	I	83.5	Confident	84.6	Confident	39 Å²	39	57.7 Å²	57.7	20%	0.2	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-4.5	-178.5	63.3	166.9	0	0	0	113.1	F703 L725 Y738 L743	F703-I758 HydrophobicContact CE1-CG2 4.25Å; F703-I758 HydrophobicContact CZ-CD1 3.94Å; F703-I758 HydrophobicContact CZ-CG2 4.26Å; L725-I758 HydrophobicContact CD1-CG2 4.19Å; Y738-I758 HydrophobicContact CD2-CD1 4.01Å; Y738-I758 HydrophobicContact CE2-CD1 3.24Å; Y738-I758 HydrophobicContact CE2-CG1 3.9Å; L743-I758 HydrophobicContact CB-CG2 4.03Å
759	R	81.8	Confident	84.3	Confident	152 Å²	152	57.7 Å²	57.7	57%	0.574	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.3	-16.2	169.7	-58.3	167	-68.2	-174.8	3.9	111.8	D757	D757-R759 PolarHBondContact O-N 3.01Å; D757-R759 VanDerWaalsContact O-N 3.17Å; D757-R759 WeakPolarHBondContact OD1-CB 3.35Å; D757-R759 WeakPolarHBondContact OD1-CG 3.34Å; D757-R759 IonicContact OD1-CZ 3.14Å; D757-R759 PolarHBondContact OD1-N 2.97Å; D757-R759 IonicContact OD1-NE 3.84Å; D757-R759 PolarHBondContact OD1-NE 3.43Å; D757-R759 IonicContact OD1-NH2 3.1Å; D757-R759 IonicContact OD2-CZ 3.83Å; D757-R759 IonicContact OD2-NE 3.23Å; D757-R759 PolarHBondContact OD2-NE 2.83Å; D757-R759 IonicContact OD2-NH2 2.74Å; D757-R759 PolarHBondContact OD2-NH2 3.43Å
760	C	75.4	Confident	83.3	Confident	53 Å²	53	54.7 Å²	54.7	36%	0.358	28%	0.282	S	S	.	.	S	Bend	trans	-97.1	128.4	-179.8	-63.3	0	0	0	0	110.5	D757 T762	D757-C760 HydrophobicContact CB-CB 4.26Å; D757-C760 WeakPolarHBondContact O-CB 3.44Å; D757-C760 PolarHBondContact O-N 3.07Å; C760-T762 HydrophobicContact CB-CG2 4.3Å; C760-T762 PolarHBondContact O-N 3.39Å
761	D	66.8	Low	81.7	Confident	157 Å²	157	53.2 Å²	53.2	84%	0.84	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.6	12.1	177.6	-64.8	-30	0	0	0	113.9	N763	D761-N763 VanDerWaalsContact C-N 3.26Å; D761-N763 PolarHBondContact O-N 2.89Å
762	T	64.1	Low	79.7	Confident	84 Å²	84	55.7 Å²	55.7	52%	0.515	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.2	-18.7	-171.7	59.8	0	0	0	0	112.7	C760 S764	C760-T762 HydrophobicContact CB-CG2 4.3Å; C760-T762 PolarHBondContact O-N 3.39Å; T762-S764 VanDerWaalsContact CB-OG 3.28Å; T762-S764 WeakPolarHBondContact CB-OG 3.49Å; T762-S764 PolarHBondContact O-N 3.05Å; T762-S764 PolarHBondContact OG1-O 2.86Å; T762-S764 PolarHBondContact OG1-OG 3.06Å; T762-S764 VanDerWaalsContact OG1-OG 3.14Å
763	N	77.4	Confident	77.1	Confident	71 Å²	71	63.8 Å²	63.8	38%	0.38	34%	0.336	S	S	.	.			trans	48.8	23.5	-173.2	-66.2	-31.6	0	0	0	112.9	L725 T726 D761	L725-N763 PolarHBondContact O-OD1 2.91Å; L725-N763 VanDerWaalsContact O-OD1 3.14Å; T726-N763 WeakPolarHBondContact CG2-O 3.45Å; D761-N763 VanDerWaalsContact C-N 3.26Å; D761-N763 PolarHBondContact O-N 2.89Å
764	S	84.8	Confident	73.9	Confident	54 Å²	54	66.8 Å²	66.8	38%	0.378	37%	0.367	S	S	.	.	S	Bend	trans	-126.9	145.4	-175.9	65.8	0	0	0	0	109.2	T762 V766	T762-S764 VanDerWaalsContact CB-OG 3.28Å; T762-S764 WeakPolarHBondContact CB-OG 3.49Å; T762-S764 PolarHBondContact O-N 3.05Å; T762-S764 PolarHBondContact OG1-O 2.86Å; T762-S764 PolarHBondContact OG1-OG 3.06Å; T762-S764 VanDerWaalsContact OG1-OG 3.14Å; S764-V766 PolarHBondContact O-N 2.88Å
765	P	86.5	Confident	71	Confident	42 Å²	42	73.3 Å²	73.3	27%	0.273	40%	0.402	S	S	.	.			trans	-63.8	132.9	178	26.7	-33	0	0	0	110.3	L755 Y756 H767 Q768	L755-P765 CarbonylContact O-C 3.52Å; L755-P765 WeakPolarHBondContact O-CA 3.46Å; L755-P765 WeakPolarHBondContact O-CB 3.4Å; Y756-P765 HydrophobicContact CD1-CB 4.42Å; Y756-P765 HydrophobicContact CE1-CB 4.03Å; Y756-P765 HydrophobicContact CE1-CG 4.4Å; Y756-P765 VanDerWaalsContact CE1-N 3.34Å; Y756-P765 HydrophobicContact CE2-CB 4.43Å; P765-H767 VanDerWaalsContact C-N 3.29Å; P765-Q768 HydrophobicContact CB-CG 4.15Å; P765-Q768 HydrophobicContact CG-CG 4.13Å
766	V	86.7	Confident	67.8	Low	76 Å²	76	78.7 Å²	78.7	46%	0.461	45%	0.447	S	S	.	.	S	Bend	trans	-72.7	-26.8	172.9	-65.8	0	0	0	0	111.5	L742 L755 D757 S764	L742-V766 HydrophobicContact CD2-CG2 4.17Å; L755-V766 HydrophobicContact CB-CG2 4.19Å; L755-V766 VanDerWaalsContact O-CG2 3.31Å; L755-V766 WeakPolarHBondContact O-CG2 3.33Å; L755-V766 PolarHBondContact O-N 3.21Å; D757-V766 HydrophobicContact CB-CG1 3.74Å; D757-V766 HydrophobicContact CB-CG2 4.45Å; S764-V766 PolarHBondContact O-N 2.88Å
767	H	84.6	Confident	64.7	Low	57 Å²	57	81.1 Å²	81.1	26%	0.264	48%	0.475	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.4	158.1	177.8	-166	59.5	0	0	0	110.9	L755 P765 G827	L755-H767 HydrophobicContact CB-CB 4.32Å; L755-H767 HydrophobicContact CD1-CB 4.19Å; L755-H767 HydrophobicContact CG-CB 4.47Å; L755-H767 PolarHBondContact N-O 3.01Å; L755-H767 PolarHBondContact O-N 3.11Å; P765-H767 VanDerWaalsContact C-N 3.29Å; H767-G827 WeakPolarHBondContact NE2-CA 3.43Å
768	Q	86.4	Confident	61.8	Low	66 Å²	66	88.7 Å²	88.7	31%	0.308	51%	0.51	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	141	177.5	-68.8	-177	-43	0	0	110.1	H752 I753 S754 P765 V771	H752-Q768 PolarHBondContact CE1-NE2 2.8Å; I753-Q768 CarbonylContact O-C 3.55Å; I753-Q768 VanDerWaalsContact O-CA 3.25Å; I753-Q768 WeakPolarHBondContact O-CA 3.42Å; S754-Q768 PolarHBondContact OG-NE2 2.92Å; P765-Q768 HydrophobicContact CB-CG 4.15Å; P765-Q768 HydrophobicContact CG-CG 4.13Å; Q768-V771 WeakPolarHBondContact O-CG2 3.44Å
769	I	83.3	Confident	59.1	Low	0 Å²	0	96.1 Å²	96.1	0%	0	54%	0.543	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	121	-177.1	-60.6	175.1	0	0	0	108	H752 I753 L755 L809 Y822	H752-I769 CarbonylContact C-O 3.54Å; H752-I769 VanDerWaalsContact C-O 3.31Å; H752-I769 WeakPolarHBondContact CA-O 3.44Å; H752-I769 VanDerWaalsContact CB-O 3.28Å; H752-I769 WeakPolarHBondContact CB-O 3.48Å; I753-I769 HydrophobicContact CB-CB 4.4Å; I753-I769 HydrophobicContact CD1-CB 4.45Å; I753-I769 HydrophobicContact CD1-CG2 4.39Å; I753-I769 PolarHBondContact N-O 3.14Å; I753-I769 PolarHBondContact O-N 2.81Å; L755-I769 HydrophobicContact CD1-CD1 4.21Å; I769-L809 HydrophobicContact CD1-CD1 3.7Å; I769-Y822 HydrophobicContact CG2-CD1 3.38Å; I769-Y822 HydrophobicContact CG2-CD2 4.22Å; I769-Y822 HydrophobicContact CG2-CE1 3.89Å; I769-Y822 HydrophobicContact CG2-CG 3.59Å
770	P	65.9	Low	56.6	Low	45 Å²	45	95.9 Å²	95.9	29%	0.292	55%	0.554	S	S	.	*	S	Bend	cis	-92.3	133.1	19.6	33.6	-30.2	0	0	0	111.3	H751 D772	H751-P770 WeakPolarHBondContact O-CD 3.39Å; P770-D772 PolarHBondContact O-N 2.94Å
771	V	52.9	Low	54.4	Low	78 Å²	78	101.3 Å²	101.3	47%	0.473	58%	0.579	S	S	.	*			trans	-77	92.1	172.6	-173.9	0	0	0	0	108.3	Q768	Q768-V771 WeakPolarHBondContact O-CG2 3.44Å
772	D	46.2	Very low	52.6	Low	134 Å²	134	99 Å²	99	72%	0.717	58%	0.575	S	S	*	*			trans	-113.2	90.3	159.3	-108.5	-25.5	0	0	0	108.3	P770	P770-D772 PolarHBondContact O-N 2.94Å
773	K	33.7	Very low	50.9	Low	193 Å²	193	101.8 Å²	101.8	84%	0.839	59%	0.587	S	S	*	*			trans	-111.3	85.8	169.8	-74.4	-172.1	179.6	177.5	0	108.8
774	G	27	Very low	48.5	Very low	64 Å²	64	108.2 Å²	108.2	66%	0.66	61%	0.611	S	S	*	*			trans	-171.4	124.9	169.6	0	0	0	0	0	111.8
775	L	29.9	Very low	45.7	Very low	137 Å²	137	112.9 Å²	112.9	72%	0.717	63%	0.625	S	S	*	*			trans	88.5	57.6	179.4	-50.6	170	0	0	0	117.2	G777 F785	L775-G777 PolarHBondContact O-N 3.47Å; L775-F785 HydrophobicContact CD1-CE1 3.65Å; L775-F785 HydrophobicContact CD1-CZ 3.81Å
776	A	25.8	Very low	42.8	Very low	116 Å²	116	118.5 Å²	118.5	96%	0.959	65%	0.651	S	S	*	*			trans	-79.4	99.8	139.5	0	0	0	0	0	107.5
777	G	27.9	Very low	40	Very low	62 Å²	62	122 Å²	122	64%	0.639	66%	0.661	S	S	*	*			trans	-176.5	95.6	-178.5	0	0	0	0	0	112.6	L775	L775-G777 PolarHBondContact O-N 3.47Å
778	E	28.2	Very low	37.9	Very low	183 Å²	183	122.4 Å²	122.4	86%	0.855	67%	0.665	S	S	*	*			trans	54	114.8	156.4	-62.8	-176.5	170.7	0	0	119.7	N780	E778-N780 PolarHBondContact O-N 3.25Å
779	E	27	Very low	36.2	Very low	194 Å²	194	123.6 Å²	123.6	91%	0.907	68%	0.68	S	S	*	*			trans	-46	105.3	162	-63.2	177.3	161	0	0	111
780	N	29.3	Very low	35	Very low	148 Å²	148	130.5 Å²	130.5	79%	0.791	71%	0.706	S	S	*	*			trans	-140.6	110.9	155.8	-86.8	-44.3	0	0	0	109.8	E778 S782	E778-N780 PolarHBondContact O-N 3.25Å; N780-S782 PolarHBondContact O-N 3.19Å
781	N	27.9	Very low	35.2	Very low	167 Å²	167	130.6 Å²	130.6	89%	0.893	71%	0.706	S	S	*	*	S	Bend	trans	-49.4	116.7	172.3	-74.4	-41.6	0	0	0	111.1
782	S	29.2	Very low	36.2	Very low	107 Å²	107	128.2 Å²	128.2	75%	0.748	69%	0.694	S	S	*	*	S	Bend	trans	162.4	5.4	135.5	64.4	0	0	0	0	115.6	N780	N780-S782 PolarHBondContact O-N 3.19Å
783	N	28.1	Very low	38	Very low	144 Å²	144	122.1 Å²	122.1	77%	0.77	66%	0.662	S	S	*	*			trans	-126.2	104.7	175.6	-76.3	-26.5	0	0	0	111.7	F785	N783-F785 PolarHBondContact O-N 2.93Å
784	K	27.2	Very low	40.5	Very low	205 Å²	205	115.8 Å²	115.8	89%	0.891	64%	0.639	S	S	*	*			trans	-57.6	102.5	174.3	-135.3	174	-175.1	175.8	0	108.8	I786	K784-I786 PolarHBondContact O-N 2.9Å; K784-I786 VanDerWaalsContact O-N 3.11Å
785	F	25.6	Very low	43.4	Very low	153 Å²	153	115.1 Å²	115.1	67%	0.671	62%	0.619	S	S	*	*			trans	-56.7	116	168.5	-78	-88.8	0	0	0	108.3	L775 N783 F787	L775-F785 HydrophobicContact CD1-CE1 3.65Å; L775-F785 HydrophobicContact CD1-CZ 3.81Å; N783-F785 PolarHBondContact O-N 2.93Å; F785-F787 HydrophobicContact CB-CD2 4.39Å; F785-F787 PolarHBondContact O-N 2.61Å
786	I	25.2	Very low	46.3	Very low	160 Å²	160	108.6 Å²	108.6	82%	0.821	59%	0.585	S	S	*	*			trans	-73.3	83.9	170	-57.8	175.3	0	0	0	106	K784 N788	K784-I786 PolarHBondContact O-N 2.9Å; K784-I786 VanDerWaalsContact O-N 3.11Å; I786-N788 PolarHBondContact O-N 3.26Å
787	F	28.5	Very low	49.6	Very low	150 Å²	150	103.4 Å²	103.4	66%	0.658	54%	0.541	S	S	*	.			trans	-57.8	117.8	161.1	-93.6	-86.2	0	0	0	107.1	F785 S789	F785-F787 HydrophobicContact CB-CD2 4.39Å; F785-F787 PolarHBondContact O-N 2.61Å; F787-S789 VanDerWaalsContact C-N 3.31Å; F787-S789 PolarHBondContact O-N 3.05Å
788	N	41.7	Very low	52.9	Low	65 Å²	65	100.8 Å²	100.8	35%	0.348	51%	0.511	S	S	.	.			trans	-72.3	91.7	177.6	-144.2	-4.6	0	0	0	107.4	I786 R790 T791	I786-N788 PolarHBondContact O-N 3.26Å; N788-R790 PolarHBondContact O-N 2.93Å; N788-T791 PolarHBondContact O-N 3.28Å; N788-T791 PolarHBondContact O-OG1 3.44Å; N788-T791 VanDerWaalsContact O-OG1 3.05Å
789	S	49.2	Very low	56.1	Low	91 Å²	91	92.3 Å²	92.3	64%	0.636	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-14.4	-168.8	61.5	0	0	0	0	115.3	F787	F787-S789 VanDerWaalsContact C-N 3.31Å; F787-S789 PolarHBondContact O-N 3.05Å
790	R	58.7	Low	59.4	Low	145 Å²	145	84.9 Å²	84.9	55%	0.547	44%	0.437	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-28.7	175.8	-68.5	-173.4	177.6	-176.2	-0.6	113.7	N788 K820	N788-R790 PolarHBondContact O-N 2.93Å; R790-K820 WeakPolarHBondContact O-CE 3.38Å
791	T	69.8	Low	62.4	Low	47 Å²	47	78.5 Å²	78.5	29%	0.288	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.9	-33	-174.8	61.7	0	0	0	0	113.3	N788 Y822 F829	N788-T791 PolarHBondContact O-N 3.28Å; N788-T791 PolarHBondContact O-OG1 3.44Å; N788-T791 VanDerWaalsContact O-OG1 3.05Å; T791-Y822 PolarHBondContact O-OH 3.44Å; T791-F829 HydrophobicContact CG2-CB 4.27Å; T791-F829 HydrophobicContact CG2-CD1 3.71Å; T791-F829 HydrophobicContact CG2-CE1 4.16Å; T791-F829 HydrophobicContact CG2-CG 3.98Å
792	A	73.5	Confident	65.2	Low	27 Å²	27	70.7 Å²	70.7	22%	0.223	36%	0.361	C	S	.	.	S	Bend	trans	-74.1	140.6	178.7	0	0	0	0	0	111	K820	A792-K820 PolarHBondContact O-NZ 2.72Å
793	L	85.1	Confident	67.2	Low	7 Å²	7	71.2 Å²	71.2	4%	0.037	36%	0.355	C	S	.	.			trans	-75.2	131.4	169.5	-64.4	175.1	0	0	0	109	I753 P796 V811 K820 Y822	I753-L793 HydrophobicContact CD1-CD1 3.75Å; I753-L793 HydrophobicContact CG1-CD1 3.99Å; L793-P796 HydrophobicContact CB-CB 4.23Å; L793-P796 HydrophobicContact CB-CG 3.96Å; L793-P796 HydrophobicContact CD1-CB 3.96Å; L793-P796 HydrophobicContact CD1-CG 4Å; L793-P796 HydrophobicContact CD2-CB 4.18Å; L793-P796 HydrophobicContact CG-CB 4.35Å; L793-P796 HydrophobicContact CG-CG 4.46Å; L793-V811 HydrophobicContact CD2-CG1 4.08Å; L793-K820 HydrophobicContact CD2-CD 3.91Å; L793-Y822 HydrophobicContact CD2-CE2 3.78Å; L793-Y822 VanDerWaalsContact CD2-OH 3.3Å; L793-Y822 WeakPolarHBondContact CD2-OH 3.2Å; L793-Y822 HydrophobicContact CG-CE2 4.37Å
794	T	85.3	Confident	68.7	Low	59 Å²	59	65.6 Å²	65.6	36%	0.362	33%	0.325	S	S	.	.	S	Bend	trans	-98	-57.6	179.6	-51.9	0	0	0	0	110.7	H751 D813 A815	H751-T794 PolarHBondContact CE1-O 3.29Å; H751-T794 PolarHBondContact ND1-O 3.07Å; T794-D813 PolarHBondContact N-OD2 3.34Å; T794-A815 HydrophobicContact CG2-CB 3.74Å
795	E	87.5	Confident	69.9	Low	50 Å²	50	58.1 Å²	58.1	23%	0.234	31%	0.306	C	S	.	.	S	Bend	trans	-139.8	77.9	169.6	-83.4	-70.2	151.8	0	0	107.5	R734 H751 Y797 D813 W814 A815	R734-E795 IonicContact NH1-OE2 2.77Å; R734-E795 PolarHBondContact NH1-OE2 3.41Å; H751-E795 IonicContact CE1-OE1 2.91Å; E795-Y797 PolarHBondContact O-N 3.21Å; E795-D813 PolarHBondContact N-OD1 3.3Å; E795-W814 HydrophobicContact CB-CB 4.25Å; E795-W814 HydrophobicContact CB-CE3 4.25Å; E795-W814 HydrophobicContact CG-CE3 4.42Å; E795-W814 WeakPolarHBondContact O-CB 3.49Å; E795-W814 PolarHBondContact O-N 2.95Å; E795-A815 HydrophobicContact CB-CB 3.67Å; E795-A815 HydrophobicContact CG-CB 3.76Å
796	P	92.7	Very high	71.5	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.8	140.7	179.5	27.7	-31.8	0	0	0	109.4	V746 S748 L793 V811 T812	V746-P796 HydrophobicContact CG1-CB 3.67Å; V746-P796 HydrophobicContact CG1-CG 3.78Å; V746-P796 VanDerWaalsContact CG1-O 3.25Å; V746-P796 WeakPolarHBondContact CG1-O 3.38Å; S748-P796 VanDerWaalsContact CB-O 3.29Å; S748-P796 WeakPolarHBondContact CB-O 3.41Å; L793-P796 HydrophobicContact CB-CB 4.23Å; L793-P796 HydrophobicContact CB-CG 3.96Å; L793-P796 HydrophobicContact CD1-CB 3.96Å; L793-P796 HydrophobicContact CD1-CG 4Å; L793-P796 HydrophobicContact CD2-CB 4.18Å; L793-P796 HydrophobicContact CG-CB 4.35Å; L793-P796 HydrophobicContact CG-CG 4.46Å; P796-V811 HydrophobicContact CB-CG1 3.84Å; P796-T812 CarbonylContact C-O 3.56Å; P796-T812 WeakPolarHBondContact CA-O 3.14Å
797	Y	94.1	Very high	74	Confident	8 Å²	8	44.8 Å²	44.8	3%	0.031	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	-72.2	-167.7	-147.9	-119.2	0	0	0	111.5	F691 R734 G735 E795 T812 W814 Y847	F691-Y797 HydrophobicContact CE1-CE1 4.45Å; F691-Y797 AromaticContact CZ-CE1 3.91Å; F691-Y797 HydrophobicContact CZ-CE1 3.91Å; F691-Y797 AromaticContact CZ-CE2 3.86Å; F691-Y797 HydrophobicContact CZ-CE2 3.86Å; F691-Y797 AromaticContact CZ-CZ 3.47Å; F691-Y797 VanDerWaalsContact CZ-CZ 3.47Å; F691-Y797 WeakPolarHBondContact CZ-OH 3.41Å; R734-Y797 WeakPolarHBondContact CB-O 3.36Å; R734-Y797 VanDerWaalsContact NH1-CD2 3.3Å; R734-Y797 VanDerWaalsContact NH1-CE2 3.28Å; G735-Y797 VanDerWaalsContact CA-O 3.24Å; G735-Y797 WeakPolarHBondContact CA-O 3.33Å; G735-Y797 PolarHBondContact N-O 3.46Å; E795-Y797 PolarHBondContact O-N 3.21Å; Y797-T812 PolarHBondContact N-O 3.49Å; Y797-W814 HydrophobicContact CD2-CB 4.17Å; Y797-W814 HydrophobicContact CG-CB 4.28Å; Y797-Y847 AromaticContact CD1-CD2 3.98Å; Y797-Y847 HydrophobicContact CD1-CD2 3.98Å; Y797-Y847 HydrophobicContact CD1-CE2 4.17Å; Y797-Y847 HydrophobicContact CD1-CG 4.48Å; Y797-Y847 HydrophobicContact CE1-CD1 4.08Å; Y797-Y847 AromaticContact CE1-CD2 3.5Å; Y797-Y847 HydrophobicContact CE1-CD2 3.5Å; Y797-Y847 HydrophobicContact CE1-CE1 4.09Å; Y797-Y847 AromaticContact CE1-CE2 3.48Å; Y797-Y847 HydrophobicContact CE1-CE2 3.48Å; Y797-Y847 VanDerWaalsContact CE1-CE2 3.48Å; Y797-Y847 AromaticContact CE1-CG 3.81Å; Y797-Y847 HydrophobicContact CE1-CG 3.81Å; Y797-Y847 AromaticContact CE1-CZ 3.81Å; Y797-Y847 AromaticContact CZ-CE2 3.75Å; Y797-Y847 AromaticContact CZ-CZ 3.74Å; Y797-Y847 VanDerWaalsContact OH-CZ 3.31Å; Y797-Y847 PolarHBondContact OH-OH 3.16Å
798	Y	96.6	Very high	76.9	Confident	7 Å²	7	37.7 Å²	37.7	3%	0.027	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	158.1	173.8	-64.8	-86	0	0	0	111.4	T643 F691 D692 V811 T812 Y847	T643-Y798 PolarHBondContact O-OH 3.33Å; F691-Y798 HydrophobicContact CE1-CE1 4.02Å; F691-Y798 HydrophobicContact CE1-CE2 4.45Å; F691-Y798 AromaticContact CE1-CZ 3.77Å; D692-Y798 HydrophobicContact CB-CD1 4.42Å; D692-Y798 HydrophobicContact CB-CE1 4.05Å; D692-Y798 WeakPolarHBondContact OD2-CD1 3.45Å; Y798-V811 WeakPolarHBondContact O-CA 3.28Å; Y798-T812 PolarHBondContact N-OG1 3.36Å; Y798-T812 PolarHBondContact O-N 2.77Å; Y798-Y847 VanDerWaalsContact CD2-C 3.46Å; Y798-Y847 WeakPolarHBondContact CD2-O 3.45Å; Y798-Y847 WeakPolarHBondContact CE2-O 3.5Å; Y798-Y847 VanDerWaalsContact CZ-O 3.31Å
799	V	96.2	Very high	79.3	Confident	4 Å²	4	34.6 Å²	34.6	2%	0.024	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	146.6	-179.1	63.4	0	0	0	0	109.9	C737 A744 V746 I753 L809 G810 V811	C737-V799 HydrophobicContact CB-CG1 4.1Å; C737-V799 VanDerWaalsContact CB-O 3.25Å; C737-V799 WeakPolarHBondContact CB-O 3.27Å; A744-V799 HydrophobicContact CB-CG1 4.04Å; A744-V799 HydrophobicContact CB-CG2 4.01Å; V746-V799 HydrophobicContact CG2-CB 3.66Å; V746-V799 HydrophobicContact CG2-CG1 3.73Å; I753-V799 HydrophobicContact CG2-CG2 4.39Å; V799-L809 HydrophobicContact CG2-CD2 3.65Å; V799-G810 CarbonylContact C-O 3.54Å; V799-G810 WeakPolarHBondContact CA-O 3.25Å; V799-V811 HydrophobicContact CG2-CG2 4.03Å
800	E	96	Very high	81.3	Confident	38 Å²	38	30.2 Å²	30.2	18%	0.178	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	134.5	178.1	179.1	70.7	164.4	0	0	111.1	C737 L809 G810 I849 Y851 F858	C737-E800 PolarHBondContact SG-OE2 3.23Å; E800-L809 WeakPolarHBondContact O-CA 3.45Å; E800-G810 PolarHBondContact N-O 3.42Å; E800-G810 PolarHBondContact O-N 3.41Å; E800-I849 HydrophobicContact CB-CG1 4.38Å; E800-I849 HydrophobicContact CB-CG2 4.06Å; E800-Y851 PolarHBondContact OE1-N 3.13Å; E800-F858 HydrophobicContact CB-CE1 4.1Å; E800-F858 HydrophobicContact CG-CD1 4.38Å; E800-F858 HydrophobicContact CG-CE1 4.02Å
801	F	93	Very high	83.1	Confident	15 Å²	15	23.3 Å²	23.3	7%	0.066	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	142.3	172.2	-78.8	-75	0	0	0	111.5	C737 I740 L742 A744 L755 L809 L824	C737-F801 HydrophobicContact CB-CD2 4.21Å; C737-F801 VanDerWaalsContact O-CE2 3.26Å; C737-F801 WeakPolarHBondContact O-CE2 3.18Å; I740-F801 HydrophobicContact CD1-CD1 3.93Å; I740-F801 HydrophobicContact CD1-CE1 3.93Å; I740-F801 HydrophobicContact CG1-CD1 3.9Å; I740-F801 HydrophobicContact CG1-CE1 3.93Å; I740-F801 HydrophobicContact CG1-CG 4.48Å; L742-F801 HydrophobicContact CB-CE1 4.28Å; L742-F801 HydrophobicContact CB-CZ 3.71Å; L742-F801 WeakPolarHBondContact O-CE2 3.49Å; A744-F801 HydrophobicContact CB-CD2 4.49Å; A744-F801 HydrophobicContact CB-CE2 3.66Å; A744-F801 HydrophobicContact CB-CZ 3.7Å; L755-F801 HydrophobicContact CD2-CZ 4.49Å; F801-L809 HydrophobicContact CD1-CD2 3.51Å; F801-L809 HydrophobicContact CD1-CG 4.19Å; F801-L809 HydrophobicContact CD2-CD2 4.39Å; F801-L809 HydrophobicContact CE1-CD2 3.61Å; F801-L809 HydrophobicContact CE1-CG 4.21Å; F801-L809 HydrophobicContact CE2-CD2 4.44Å; F801-L809 HydrophobicContact CG-CD2 3.94Å; F801-L809 HydrophobicContact CZ-CD2 4.07Å; F801-L824 HydrophobicContact CD1-CD1 3.76Å; F801-L824 HydrophobicContact CD1-CD2 4.19Å; F801-L824 HydrophobicContact CE1-CD1 3.92Å; F801-L824 HydrophobicContact CE1-CD2 3.62Å; F801-L824 HydrophobicContact CE1-CG 4.4Å
802	V	85.4	Confident	84.3	Confident	2 Å²	2	21.1 Å²	21.1	1%	0.012	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	126.6	166.5	-177	0	0	0	0	110.3	D804 G807 C808 Y851 F858 I873	V802-D804 HydrophobicContact CG1-CB 4.18Å; V802-G807 WeakPolarHBondContact O-CA 3.4Å; V802-C808 PolarHBondContact N-O 3.03Å; V802-C808 PolarHBondContact O-N 3.25Å; V802-Y851 HydrophobicContact CB-CD2 4.38Å; V802-Y851 HydrophobicContact CB-CG 4.49Å; V802-Y851 HydrophobicContact CG1-CD1 4.18Å; V802-Y851 HydrophobicContact CG1-CD2 3.99Å; V802-Y851 HydrophobicContact CG1-CE1 3.87Å; V802-Y851 HydrophobicContact CG1-CE2 3.66Å; V802-Y851 HydrophobicContact CG1-CG 4.23Å; V802-Y851 HydrophobicContact CG2-CD1 4.27Å; V802-Y851 HydrophobicContact CG2-CD2 3.45Å; V802-Y851 VanDerWaalsContact CG2-CD2 3.45Å; V802-Y851 HydrophobicContact CG2-CE2 3.97Å; V802-Y851 HydrophobicContact CG2-CG 3.62Å; V802-F858 HydrophobicContact CB-CZ 4.3Å; V802-F858 HydrophobicContact CG2-CD1 4.28Å; V802-F858 HydrophobicContact CG2-CE1 3.31Å; V802-F858 HydrophobicContact CG2-CE2 4.01Å; V802-F858 HydrophobicContact CG2-CZ 3.15Å; V802-I873 HydrophobicContact CB-CD1 3.99Å; V802-I873 HydrophobicContact CG1-CD1 3.6Å; V802-I873 HydrophobicContact CG2-CD1 4.13Å
803	D	71.6	Confident	85.1	Confident	118 Å²	118	19.8 Å²	19.8	63%	0.631	12%	0.123	S	C	*	.			trans	-100.2	87.1	171.4	-169.1	4	0	0	0	109.6	I740 G805	I740-D803 HydrophobicContact CG2-CB 4.01Å; D803-G805 PolarHBondContact OD1-N 3.42Å
804	D	60.1	Low	85.2	Confident	27 Å²	27	23.7 Å²	23.7	14%	0.144	14%	0.137	C	C	.	.	S	Bend	trans	-102.6	22.4	174.9	64	-7	0	0	0	112.2	V802 G806 G807 H875	V802-D804 HydrophobicContact CG1-CB 4.18Å; D804-G806 PolarHBondContact OD1-N 3.09Å; D804-G807 PolarHBondContact OD1-N 3.26Å; D804-H875 IonicContact OD2-CE1 3.04Å; D804-H875 PolarHBondContact OD2-CE1 3.44Å; D804-H875 IonicContact OD2-NE2 3.36Å
805	G	53.1	Low	85.1	Confident	48 Å²	48	22.2 Å²	22.2	50%	0.495	13%	0.131	S	C	.	.	S	Bend	trans	90	-9	-177.7	0	0	0	0	0	114.9	D803	D803-G805 PolarHBondContact OD1-N 3.42Å
806	G	58.3	Low	84.9	Confident	26 Å²	26	21.2 Å²	21.2	27%	0.268	13%	0.131	S	C	.	.	S	Bend	trans	-122.5	-15.2	172.8	0	0	0	0	0	114.9	D804	D804-G806 PolarHBondContact OD1-N 3.09Å
807	G	78.7	Confident	84.8	Confident	7 Å²	7	21.4 Å²	21.4	7%	0.072	13%	0.132	C	C	.	.			trans	73.1	109.8	-176.4	0	0	0	0	0	112.1	V802 D804 L824	V802-G807 WeakPolarHBondContact O-CA 3.4Å; D804-G807 PolarHBondContact OD1-N 3.26Å; G807-L824 VanDerWaalsContact O-CB 3.3Å; G807-L824 WeakPolarHBondContact O-CB 3.47Å; G807-L824 PolarHBondContact O-N 2.82Å
808	C	88.1	Confident	84.8	Confident	0 Å²	0	21.5 Å²	21.5	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	160.1	174.4	-60.3	0	0	0	0	112.1	V802 L821 Y822	V802-C808 PolarHBondContact N-O 3.03Å; V802-C808 PolarHBondContact O-N 3.25Å; C808-L821 HydrophobicContact CB-CD1 3.74Å; C808-L821 HydrophobicContact CB-CG 4.15Å; C808-Y822 CarbonylContact C-O 3.55Å; C808-Y822 VanDerWaalsContact CA-O 3.3Å; C808-Y822 WeakPolarHBondContact CA-O 3.43Å
809	L	91.8	Very high	84.6	Confident	0 Å²	0	21.2 Å²	21.2	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	118.6	170.4	-77.7	162.9	0	0	0	110.1	A744 L755 I769 V799 E800 F801 L821 Y822 L824	A744-L809 HydrophobicContact CB-CD2 3.92Å; L755-L809 HydrophobicContact CD1-CD1 4.07Å; L755-L809 HydrophobicContact CD2-CD1 3.69Å; L755-L809 HydrophobicContact CG-CD1 4.47Å; I769-L809 HydrophobicContact CD1-CD1 3.7Å; V799-L809 HydrophobicContact CG2-CD2 3.65Å; E800-L809 WeakPolarHBondContact O-CA 3.45Å; F801-L809 HydrophobicContact CD1-CD2 3.51Å; F801-L809 HydrophobicContact CD1-CG 4.19Å; F801-L809 HydrophobicContact CD2-CD2 4.39Å; F801-L809 HydrophobicContact CE1-CD2 3.61Å; F801-L809 HydrophobicContact CE1-CG 4.21Å; F801-L809 HydrophobicContact CE2-CD2 4.44Å; F801-L809 HydrophobicContact CG-CD2 3.94Å; F801-L809 HydrophobicContact CZ-CD2 4.07Å; L809-L821 CarbonylContact O-C 3.57Å; L809-L821 WeakPolarHBondContact O-CA 3.48Å; L809-Y822 PolarHBondContact N-O 2.9Å; L809-Y822 PolarHBondContact O-N 2.89Å; L809-L824 HydrophobicContact CD1-CD2 3.33Å; L809-L824 HydrophobicContact CD1-CG 4.2Å; L809-L824 HydrophobicContact CD2-CD2 4.34Å; L809-L824 HydrophobicContact CG-CD2 3.56Å; L809-L824 HydrophobicContact CG-CG 4.02Å
810	G	93	Very high	84.4	Confident	0 Å²	0	21.2 Å²	21.2	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	133.3	167.6	0	0	0	0	0	110.1	V799 E800 K820	V799-G810 CarbonylContact C-O 3.54Å; V799-G810 WeakPolarHBondContact CA-O 3.25Å; E800-G810 PolarHBondContact N-O 3.42Å; E800-G810 PolarHBondContact O-N 3.41Å; G810-K820 CarbonylContact C-O 3.56Å
811	V	94.6	Very high	84.1	Confident	0 Å²	0	19.4 Å²	19.4	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	130.9	-174.2	-175.3	0	0	0	0	108.8	I753 L793 P796 Y798 V799 V819 K820 Y822	I753-V811 HydrophobicContact CD1-CB 4.29Å; I753-V811 HydrophobicContact CD1-CG1 4.12Å; I753-V811 HydrophobicContact CD1-CG2 3.26Å; I753-V811 HydrophobicContact CG1-CG2 4.38Å; L793-V811 HydrophobicContact CD2-CG1 4.08Å; P796-V811 HydrophobicContact CB-CG1 3.84Å; Y798-V811 WeakPolarHBondContact O-CA 3.28Å; V799-V811 HydrophobicContact CG2-CG2 4.03Å; V811-V819 CarbonylContact O-C 3.55Å; V811-V819 WeakPolarHBondContact O-CA 3.23Å; V811-K820 PolarHBondContact N-O 3.18Å; V811-K820 PolarHBondContact O-N 2.99Å; V811-Y822 HydrophobicContact CG2-CD2 4.17Å; V811-Y822 HydrophobicContact CG2-CE2 4.41Å
812	T	95.2	Very high	84	Confident	0 Å²	0	18.8 Å²	18.8	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	132.4	171.2	60.9	0	0	0	0	110.1	P796 Y797 Y798 S818 V819 P846 I849	P796-T812 CarbonylContact C-O 3.56Å; P796-T812 WeakPolarHBondContact CA-O 3.14Å; Y797-T812 PolarHBondContact N-O 3.49Å; Y798-T812 PolarHBondContact N-OG1 3.36Å; Y798-T812 PolarHBondContact O-N 2.77Å; T812-S818 WeakPolarHBondContact CA-O 3.09Å; T812-V819 HydrophobicContact CG2-CG2 4.33Å; T812-P846 HydrophobicContact CG2-CB 3.78Å; T812-P846 HydrophobicContact CG2-CG 4.27Å; T812-P846 PolarHBondContact OG1-O 3.23Å; T812-I849 HydrophobicContact CG2-CB 3.69Å; T812-I849 HydrophobicContact CG2-CD1 4.16Å; T812-I849 HydrophobicContact CG2-CG1 4.46Å; T812-I849 HydrophobicContact CG2-CG2 3.92Å
813	D	91	Very high	83.9	Confident	0 Å²	0	18.8 Å²	18.8	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	119.1	176	-167.7	-31.6	0	0	0	108.9	T794 E795 A815 A816 P817 S818 K820	T794-D813 PolarHBondContact N-OD2 3.34Å; E795-D813 PolarHBondContact N-OD1 3.3Å; D813-A815 PolarHBondContact OD1-N 2.83Å; D813-A816 WeakPolarHBondContact CB-O 3.4Å; D813-A816 CarbonylContact O-C 3.6Å; D813-A816 PolarHBondContact OD1-N 3.3Å; D813-A816 VanDerWaalsContact OD1-N 3.13Å; D813-P817 WeakPolarHBondContact O-CA 3.36Å; D813-S818 PolarHBondContact N-O 3.12Å; D813-S818 PolarHBondContact O-N 3.09Å; D813-K820 HydrophobicContact CB-CD 4.42Å; D813-K820 IonicContact OD2-NZ 3.6Å; D813-K820 PolarHBondContact OD2-NZ 2.98Å
814	W	88.1	Confident	84.4	Confident	88 Å²	88	14.3 Å²	14.3	33%	0.333	10%	0.098	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.7	-48.1	-172	178.3	73.6	0	0	0	112.7	E795 Y797 Y847	E795-W814 HydrophobicContact CB-CB 4.25Å; E795-W814 HydrophobicContact CB-CE3 4.25Å; E795-W814 HydrophobicContact CG-CE3 4.42Å; E795-W814 WeakPolarHBondContact O-CB 3.49Å; E795-W814 PolarHBondContact O-N 2.95Å; Y797-W814 HydrophobicContact CD2-CB 4.17Å; Y797-W814 HydrophobicContact CG-CB 4.28Å; W814-Y847 AromaticContact CD1-CE2 3.44Å; W814-Y847 VanDerWaalsContact CD1-CE2 3.44Å; W814-Y847 AromaticContact NE1-CE2 3.48Å
815	A	82	Confident	85.2	Confident	29 Å²	29	21.5 Å²	21.5	24%	0.24	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.9	-22.1	-176.6	0	0	0	0	0	112.5	T794 E795 D813 P817 Y836	T794-A815 HydrophobicContact CG2-CB 3.74Å; E795-A815 HydrophobicContact CB-CB 3.67Å; E795-A815 HydrophobicContact CG-CB 3.76Å; D813-A815 PolarHBondContact OD1-N 2.83Å; A815-P817 WeakPolarHBondContact O-CD 3.47Å; A815-Y836 PolarHBondContact O-OH 2.86Å
816	A	84.5	Confident	86.2	Confident	28 Å²	28	21.8 Å²	21.8	23%	0.231	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	-116.7	78.2	164.7	0	0	0	0	0	108.6	D813 S818	D813-A816 WeakPolarHBondContact CB-O 3.4Å; D813-A816 CarbonylContact O-C 3.6Å; D813-A816 PolarHBondContact OD1-N 3.3Å; D813-A816 VanDerWaalsContact OD1-N 3.13Å; A816-S818 WeakPolarHBondContact O-CB 3.22Å; A816-S818 PolarHBondContact O-N 2.68Å; A816-S818 PolarHBondContact O-OG 2.96Å
817	P	90.6	Very high	87.2	Confident	4 Å²	4	20.8 Å²	20.8	3%	0.026	11%	0.11	C	C	.	.	T	Hydrogen-bonded Turn	trans	-48.1	99.5	-166.7	-29.1	35.3	0	0	0	113	D813 A815 G834 G835 Y836 I843 L844	D813-P817 WeakPolarHBondContact O-CA 3.36Å; A815-P817 WeakPolarHBondContact O-CD 3.47Å; P817-G834 CarbonylContact O-C 3.2Å; P817-G835 VanDerWaalsContact O-CA 3.25Å; P817-G835 WeakPolarHBondContact O-CA 3.21Å; P817-G835 PolarHBondContact O-N 3.42Å; P817-Y836 VanDerWaalsContact CD-CE2 3.42Å; P817-Y836 HydrophobicContact CG-CD1 3.93Å; P817-Y836 HydrophobicContact CG-CD2 4.46Å; P817-Y836 HydrophobicContact CG-CE1 3.64Å; P817-Y836 HydrophobicContact CG-CE2 4.18Å; P817-Y836 HydrophobicContact CG-CG 4.34Å; P817-I843 WeakPolarHBondContact CB-O 3.22Å; P817-L844 HydrophobicContact CB-CD2 4.46Å; P817-L844 HydrophobicContact CG-CD2 4.23Å
818	S	92.3	Very high	87.3	Confident	11 Å²	11	22 Å²	22	8%	0.077	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.7	163.7	-174.8	57.2	0	0	0	0	111.5	T812 D813 A816 K820 I833	T812-S818 WeakPolarHBondContact CA-O 3.09Å; D813-S818 PolarHBondContact N-O 3.12Å; D813-S818 PolarHBondContact O-N 3.09Å; A816-S818 WeakPolarHBondContact O-CB 3.22Å; A816-S818 PolarHBondContact O-N 2.68Å; A816-S818 PolarHBondContact O-OG 2.96Å; S818-K820 WeakPolarHBondContact OG-CE 3.29Å; S818-I833 CarbonylContact C-O 3.52Å; S818-I833 VanDerWaalsContact CA-O 3.22Å; S818-I833 WeakPolarHBondContact CA-O 3.37Å; S818-I833 VanDerWaalsContact CB-O 3.29Å; S818-I833 WeakPolarHBondContact CB-O 3.46Å
819	V	93.4	Very high	87.1	Confident	0 Å²	0	24.8 Å²	24.8	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	125.6	158.6	179.8	0	0	0	0	107.6	V811 T812 S832 I833 I843 I849 I860 L913	V811-V819 CarbonylContact O-C 3.55Å; V811-V819 WeakPolarHBondContact O-CA 3.23Å; T812-V819 HydrophobicContact CG2-CG2 4.33Å; V819-S832 CarbonylContact O-C 3.52Å; V819-S832 WeakPolarHBondContact O-CA 3.34Å; V819-I833 HydrophobicContact CB-CG2 4.24Å; V819-I833 PolarHBondContact N-O 2.73Å; V819-I833 PolarHBondContact O-N 2.92Å; V819-I843 HydrophobicContact CG2-CD1 4.06Å; V819-I849 HydrophobicContact CG1-CD1 3.77Å; V819-I849 HydrophobicContact CG2-CD1 4.31Å; V819-I860 HydrophobicContact CG2-CD1 4.29Å; V819-I860 HydrophobicContact CG2-CG1 3.6Å; V819-L913 HydrophobicContact CB-CD1 4.39Å; V819-L913 HydrophobicContact CG1-CD1 4.08Å
820	K	91.6	Very high	86.7	Confident	4 Å²	4	26.7 Å²	26.7	2%	0.017	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	136.7	176.3	-66.1	175.4	176	166.9	0	109.3	R790 A792 L793 G810 V811 D813 S818 Y822 F829	R790-K820 WeakPolarHBondContact O-CE 3.38Å; A792-K820 PolarHBondContact O-NZ 2.72Å; L793-K820 HydrophobicContact CD2-CD 3.91Å; G810-K820 CarbonylContact C-O 3.56Å; V811-K820 PolarHBondContact N-O 3.18Å; V811-K820 PolarHBondContact O-N 2.99Å; D813-K820 HydrophobicContact CB-CD 4.42Å; D813-K820 IonicContact OD2-NZ 3.6Å; D813-K820 PolarHBondContact OD2-NZ 2.98Å; S818-K820 WeakPolarHBondContact OG-CE 3.29Å; K820-Y822 HydrophobicContact CB-CD2 4.46Å; K820-Y822 HydrophobicContact CB-CE2 3.64Å; K820-F829 HydrophobicContact CB-CE2 4.14Å; K820-F829 HydrophobicContact CG-CE2 4.13Å
821	L	90.7	Very high	86.4	Confident	0 Å²	0	27 Å²	27	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	130.5	-179.1	-167.4	70.5	0	0	0	109.4	C808 L809 L830 S831 F858 I873 I911 L913	C808-L821 HydrophobicContact CB-CD1 3.74Å; C808-L821 HydrophobicContact CB-CG 4.15Å; L809-L821 CarbonylContact O-C 3.57Å; L809-L821 WeakPolarHBondContact O-CA 3.48Å; L821-L830 HydrophobicContact CB-CB 4.34Å; L821-L830 HydrophobicContact CD2-CB 4.25Å; L821-L830 HydrophobicContact CD2-CD1 4.19Å; L821-L830 HydrophobicContact CG-CB 4.32Å; L821-L830 HydrophobicContact CG-CD1 4.2Å; L821-L830 PolarHBondContact O-N 2.77Å; L821-S831 PolarHBondContact N-O 2.91Å; L821-F858 HydrophobicContact CD1-CE2 3.85Å; L821-F858 HydrophobicContact CD1-CZ 3.96Å; L821-I873 HydrophobicContact CD1-CD1 4.47Å; L821-I911 HydrophobicContact CD2-CG2 3.69Å; L821-L913 HydrophobicContact CB-CD1 4.33Å; L821-L913 HydrophobicContact CB-CG 4.48Å; L821-L913 HydrophobicContact CD2-CD2 4.27Å
822	Y	89.1	Confident	86.2	Confident	2 Å²	2	29 Å²	29	1%	0.008	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	145.7	177.6	-64.6	-94.1	0	0	0	110.9	I769 T791 L793 C808 L809 V811 K820 S828 F829	I769-Y822 HydrophobicContact CG2-CD1 3.38Å; I769-Y822 HydrophobicContact CG2-CD2 4.22Å; I769-Y822 HydrophobicContact CG2-CE1 3.89Å; I769-Y822 HydrophobicContact CG2-CG 3.59Å; T791-Y822 PolarHBondContact O-OH 3.44Å; L793-Y822 HydrophobicContact CD2-CE2 3.78Å; L793-Y822 VanDerWaalsContact CD2-OH 3.3Å; L793-Y822 WeakPolarHBondContact CD2-OH 3.2Å; L793-Y822 HydrophobicContact CG-CE2 4.37Å; C808-Y822 CarbonylContact C-O 3.55Å; C808-Y822 VanDerWaalsContact CA-O 3.3Å; C808-Y822 WeakPolarHBondContact CA-O 3.43Å; L809-Y822 PolarHBondContact N-O 2.9Å; L809-Y822 PolarHBondContact O-N 2.89Å; V811-Y822 HydrophobicContact CG2-CD2 4.17Å; V811-Y822 HydrophobicContact CG2-CE2 4.41Å; K820-Y822 HydrophobicContact CB-CD2 4.46Å; K820-Y822 HydrophobicContact CB-CE2 3.64Å; Y822-S828 WeakPolarHBondContact CA-O 3.44Å; Y822-F829 HydrophobicContact CD1-CB 4.12Å; Y822-F829 HydrophobicContact CE1-CB 3.82Å; Y822-F829 HydrophobicContact CE1-CD2 4.01Å; Y822-F829 HydrophobicContact CE1-CG 4.44Å; Y822-F829 AromaticContact CZ-CD2 3.97Å
823	S	83.8	Confident	86.1	Confident	2 Å²	2	30.2 Å²	30.2	1%	0.014	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	132.5	172.1	179.1	0	0	0	0	109.9	K825 T826 G827 S828	S823-K825 VanDerWaalsContact C-N 3.32Å; S823-K825 PolarHBondContact OG-N 3.18Å; S823-T826 WeakPolarHBondContact CB-OG1 3.46Å; S823-T826 PolarHBondContact OG-OG1 2.85Å; S823-G827 WeakPolarHBondContact O-CA 3.27Å; S823-G827 PolarHBondContact O-N 2.93Å; S823-S828 PolarHBondContact N-O 3.35Å
824	L	83.1	Confident	86.1	Confident	25 Å²	25	31.7 Å²	31.7	13%	0.131	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-32.9	173.1	-77.8	164.9	0	0	0	113	I740 L755 F801 G807 L809	I740-L824 HydrophobicContact CD1-CD1 3.25Å; I740-L824 HydrophobicContact CD1-CG 4.47Å; L755-L824 HydrophobicContact CD1-CD2 3.65Å; F801-L824 HydrophobicContact CD1-CD1 3.76Å; F801-L824 HydrophobicContact CD1-CD2 4.19Å; F801-L824 HydrophobicContact CE1-CD1 3.92Å; F801-L824 HydrophobicContact CE1-CD2 3.62Å; F801-L824 HydrophobicContact CE1-CG 4.4Å; G807-L824 VanDerWaalsContact O-CB 3.3Å; G807-L824 WeakPolarHBondContact O-CB 3.47Å; G807-L824 PolarHBondContact O-N 2.82Å; L809-L824 HydrophobicContact CD1-CD2 3.33Å; L809-L824 HydrophobicContact CD1-CG 4.2Å; L809-L824 HydrophobicContact CD2-CD2 4.34Å; L809-L824 HydrophobicContact CG-CD2 3.56Å; L809-L824 HydrophobicContact CG-CG 4.02Å
825	K	75.7	Confident	86.1	Confident	177 Å²	177	28.5 Å²	28.5	77%	0.77	17%	0.171	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.1	-42.2	-176.1	-175.7	177.4	180	-179.9	0	112.3	S823	S823-K825 VanDerWaalsContact C-N 3.32Å; S823-K825 PolarHBondContact OG-N 3.18Å
826	T	75.6	Confident	86.5	Confident	55 Å²	55	34.9 Å²	34.9	34%	0.337	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-111.3	-14.1	-172.1	61.5	0	0	0	0	113.5	S823 S828 N899	S823-T826 WeakPolarHBondContact CB-OG1 3.46Å; S823-T826 PolarHBondContact OG-OG1 2.85Å; T826-S828 PolarHBondContact O-N 3.47Å; T826-S828 WeakPolarHBondContact OG1-CB 3.45Å; T826-S828 PolarHBondContact OG1-N 2.75Å; T826-S828 PolarHBondContact OG1-OG 2.9Å; T826-N899 PolarHBondContact OG1-ND2 3.34Å
827	G	79.1	Confident	86.7	Confident	5 Å²	5	34.6 Å²	34.6	5%	0.052	19%	0.191	C	C	.	.			trans	69.6	2.8	-170.1	0	0	0	0	0	113.9	H767 S823	H767-G827 WeakPolarHBondContact NE2-CA 3.43Å; S823-G827 WeakPolarHBondContact O-CA 3.27Å; S823-G827 PolarHBondContact O-N 2.93Å
828	S	79.5	Confident	86.5	Confident	33 Å²	33	39.2 Å²	39.2	23%	0.231	22%	0.219	C	C	.	.			trans	-75.2	143.7	-176.2	69.4	0	0	0	0	111.7	Y822 S823 T826 L830 N899	Y822-S828 WeakPolarHBondContact CA-O 3.44Å; S823-S828 PolarHBondContact N-O 3.35Å; T826-S828 PolarHBondContact O-N 3.47Å; T826-S828 WeakPolarHBondContact OG1-CB 3.45Å; T826-S828 PolarHBondContact OG1-N 2.75Å; T826-S828 PolarHBondContact OG1-OG 2.9Å; S828-L830 PolarHBondContact O-N 2.95Å; S828-N899 WeakPolarHBondContact CB-ND2 3.44Å; S828-N899 PolarHBondContact OG-ND2 3.12Å
829	F	84.9	Confident	86.4	Confident	58 Å²	58	42.6 Å²	42.6	25%	0.254	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.8	132.7	166.5	176.2	-96.5	0	0	0	111	T791 K820 Y822 S831	T791-F829 HydrophobicContact CG2-CB 4.27Å; T791-F829 HydrophobicContact CG2-CD1 3.71Å; T791-F829 HydrophobicContact CG2-CE1 4.16Å; T791-F829 HydrophobicContact CG2-CG 3.98Å; K820-F829 HydrophobicContact CB-CE2 4.14Å; K820-F829 HydrophobicContact CG-CE2 4.13Å; Y822-F829 HydrophobicContact CD1-CB 4.12Å; Y822-F829 HydrophobicContact CE1-CB 3.82Å; Y822-F829 HydrophobicContact CE1-CD2 4.01Å; Y822-F829 HydrophobicContact CE1-CG 4.44Å; Y822-F829 AromaticContact CZ-CD2 3.97Å; F829-S831 VanDerWaalsContact CE2-O 3.28Å; F829-S831 WeakPolarHBondContact CE2-O 3.37Å; F829-S831 WeakPolarHBondContact CZ-O 3.34Å
830	L	82.9	Confident	85.9	Confident	39 Å²	39	46.6 Å²	46.6	20%	0.204	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	-51.1	-179.8	-64.3	176.4	0	0	0	111.9	L821 S828 I911	L821-L830 HydrophobicContact CB-CB 4.34Å; L821-L830 HydrophobicContact CD2-CB 4.25Å; L821-L830 HydrophobicContact CD2-CD1 4.19Å; L821-L830 HydrophobicContact CG-CB 4.32Å; L821-L830 HydrophobicContact CG-CD1 4.2Å; L821-L830 PolarHBondContact O-N 2.77Å; S828-L830 PolarHBondContact O-N 2.95Å; L830-I911 HydrophobicContact CD1-CB 4.42Å; L830-I911 HydrophobicContact CD1-CD1 4.38Å
831	S	87.5	Confident	85.7	Confident	7 Å²	7	50.1 Å²	50.1	5%	0.049	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.4	161.9	-175.9	177.2	0	0	0	0	111.2	L821 F829 N912 L913	L821-S831 PolarHBondContact N-O 2.91Å; F829-S831 VanDerWaalsContact CE2-O 3.28Å; F829-S831 WeakPolarHBondContact CE2-O 3.37Å; F829-S831 WeakPolarHBondContact CZ-O 3.34Å; S831-N912 WeakPolarHBondContact CB-OD1 3.39Å; S831-N912 PolarHBondContact OG-OD1 3.41Å; S831-L913 PolarHBondContact OG-N 3.35Å
832	S	90.5	Very high	85.8	Confident	43 Å²	43	51.5 Å²	51.5	30%	0.301	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	147.4	170.6	63.5	0	0	0	0	111.1	V819	V819-S832 CarbonylContact O-C 3.52Å; V819-S832 WeakPolarHBondContact O-CA 3.34Å
833	I	91.8	Very high	86	Confident	24 Å²	24	51.4 Å²	51.4	12%	0.123	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	152.7	169.1	-168.1	162.4	0	0	0	111.4	S818 V819 C871 L913 S914 L916	S818-I833 CarbonylContact C-O 3.52Å; S818-I833 VanDerWaalsContact CA-O 3.22Å; S818-I833 WeakPolarHBondContact CA-O 3.37Å; S818-I833 VanDerWaalsContact CB-O 3.29Å; S818-I833 WeakPolarHBondContact CB-O 3.46Å; V819-I833 HydrophobicContact CB-CG2 4.24Å; V819-I833 PolarHBondContact N-O 2.73Å; V819-I833 PolarHBondContact O-N 2.92Å; I833-C871 HydrophobicContact CG2-CB 4.43Å; I833-L913 HydrophobicContact CB-CB 4.29Å; I833-L913 HydrophobicContact CB-CD1 4.39Å; I833-L913 HydrophobicContact CG2-CB 4.1Å; I833-L913 HydrophobicContact CG2-CD1 3.77Å; I833-S914 WeakPolarHBondContact CD1-O 3.28Å; I833-L916 HydrophobicContact CD1-CD1 4.24Å; I833-L916 HydrophobicContact CD1-CG 3.85Å; I833-L916 HydrophobicContact CG1-CD1 4Å; I833-L916 HydrophobicContact CG1-CG 4.1Å; I833-L916 HydrophobicContact CG2-CD2 4.48Å; I833-L916 HydrophobicContact CG2-CG 4.43Å
834	G	90.8	Very high	86.3	Confident	31 Å²	31	52.8 Å²	52.8	32%	0.32	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	116.6	-162.1	-179.9	0	0	0	0	0	111.2	P817 D841	P817-G834 CarbonylContact O-C 3.2Å; G834-D841 WeakPolarHBondContact CA-O 3.5Å
835	G	88.8	Confident	86.7	Confident	21 Å²	21	54.5 Å²	54.5	22%	0.216	30%	0.301	C	S	.	.			trans	140.8	166.8	-176.9	0	0	0	0	0	109.7	P817 G837 N842 I843	P817-G835 VanDerWaalsContact O-CA 3.25Å; P817-G835 WeakPolarHBondContact O-CA 3.21Å; P817-G835 PolarHBondContact O-N 3.42Å; G835-G837 PolarHBondContact O-N 2.88Å; G835-N842 WeakPolarHBondContact O-CA 3.42Å; G835-N842 VanDerWaalsContact O-CB 3.3Å; G835-N842 WeakPolarHBondContact O-CB 3.38Å; G835-N842 PolarHBondContact O-ND2 2.82Å; G835-I843 PolarHBondContact O-N 3.01Å; G835-I843 VanDerWaalsContact O-N 3.14Å
836	Y	89.5	Confident	87.5	Confident	163 Å²	163	46.1 Å²	46.1	64%	0.639	27%	0.265	S	S	*	.	S	Bend	trans	-60.5	127.8	177.9	-70.2	-85.4	0	0	0	111.9	A815 P817 N842 L844	A815-Y836 PolarHBondContact O-OH 2.86Å; P817-Y836 VanDerWaalsContact CD-CE2 3.42Å; P817-Y836 HydrophobicContact CG-CD1 3.93Å; P817-Y836 HydrophobicContact CG-CD2 4.46Å; P817-Y836 HydrophobicContact CG-CE1 3.64Å; P817-Y836 HydrophobicContact CG-CE2 4.18Å; P817-Y836 HydrophobicContact CG-CG 4.34Å; Y836-N842 PolarHBondContact O-ND2 3.39Å; Y836-L844 HydrophobicContact CD1-CD2 3.75Å; Y836-L844 HydrophobicContact CE1-CD2 4.5Å; Y836-L844 HydrophobicContact CG-CD2 4.46Å
837	G	88.6	Confident	88.2	Confident	23 Å²	23	44.9 Å²	44.9	24%	0.237	25%	0.254	C	S	.	.	S	Bend	trans	147.3	-178.7	172.9	0	0	0	0	0	113.1	G835 N842 L844 N865	G835-G837 PolarHBondContact O-N 2.88Å; G837-N842 VanDerWaalsContact O-CB 3.23Å; G837-N842 WeakPolarHBondContact O-CB 3.33Å; G837-L844 VanDerWaalsContact O-CD1 3.29Å; G837-L844 WeakPolarHBondContact O-CD1 3.23Å; G837-L844 WeakPolarHBondContact O-CG 3.16Å; G837-N865 PolarHBondContact O-ND2 3.37Å
838	T	87.6	Confident	88.9	Confident	100 Å²	100	44.8 Å²	44.8	61%	0.613	25%	0.253	S	S	*	.	S	Bend	trans	-114.2	-2.9	-177.5	60.5	0	0	0	0	112.8	N865 R867	T838-N865 WeakPolarHBondContact CG2-OD1 3.44Å; T838-R867 PolarHBondContact O-NH1 3.09Å
839	T	89.8	Confident	89.8	Confident	83 Å²	83	43.7 Å²	43.7	51%	0.509	24%	0.244	S	C	.	.	S	Bend	trans	-69.4	168.7	180	78.8	0	0	0	0	111.4	D841 N842 R867	T839-D841 PolarHBondContact O-N 2.89Å; T839-D841 VanDerWaalsContact O-N 3.15Å; T839-N842 WeakPolarHBondContact CB-OD1 3.29Å; T839-N842 PolarHBondContact N-OD1 2.74Å; T839-N842 PolarHBondContact O-N 3.45Å; T839-N842 PolarHBondContact OG1-OD1 2.97Å; T839-R867 PolarHBondContact O-NH1 3.25Å; T839-R867 PolarHBondContact O-NH2 3.2Å
840	N	83.8	Confident	90.3	Very high	83 Å²	83	41 Å²	41	44%	0.444	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60	-27	-175.7	-73.3	-14.9	0	0	0	113.8	Q869 L916	N840-Q869 PolarHBondContact O-NE2 3.43Å; N840-L916 WeakPolarHBondContact O-CB 3.13Å
841	D	86.6	Confident	90.8	Very high	78 Å²	78	40.7 Å²	40.7	42%	0.417	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.8	6.3	178.8	-71.5	-51.5	0	0	0	114.1	G834 T839 S915 L916	G834-D841 WeakPolarHBondContact CA-O 3.5Å; T839-D841 PolarHBondContact O-N 2.89Å; T839-D841 VanDerWaalsContact O-N 3.15Å; D841-S915 VanDerWaalsContact OD1-CB 3.27Å; D841-S915 WeakPolarHBondContact OD1-CB 3.49Å; D841-L916 WeakPolarHBondContact O-CD1 3.42Å; D841-L916 PolarHBondContact OD1-N 3.23Å
842	N	92.6	Very high	91	Very high	30 Å²	30	40.4 Å²	40.4	16%	0.16	23%	0.227	C	C	.	.			trans	-102.8	155.5	174.7	-63.7	129.2	0	0	0	111.8	G835 Y836 G837 T839 R867 Q869	G835-N842 WeakPolarHBondContact O-CA 3.42Å; G835-N842 VanDerWaalsContact O-CB 3.3Å; G835-N842 WeakPolarHBondContact O-CB 3.38Å; G835-N842 PolarHBondContact O-ND2 2.82Å; Y836-N842 PolarHBondContact O-ND2 3.39Å; G837-N842 VanDerWaalsContact O-CB 3.23Å; G837-N842 WeakPolarHBondContact O-CB 3.33Å; T839-N842 WeakPolarHBondContact CB-OD1 3.29Å; T839-N842 PolarHBondContact N-OD1 2.74Å; T839-N842 PolarHBondContact O-N 3.45Å; T839-N842 PolarHBondContact OG1-OD1 2.97Å; N842-R867 PolarHBondContact O-NH2 3.41Å; N842-Q869 PolarHBondContact O-OE1 3.23Å
843	I	92.3	Very high	90.9	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	23%	0.231	C	C	.	.			trans	-137.4	142.5	174.8	-46.9	179.5	0	0	0	107.4	P817 V819 G835 P846 I860 D862 L916	P817-I843 WeakPolarHBondContact CB-O 3.22Å; V819-I843 HydrophobicContact CG2-CD1 4.06Å; G835-I843 PolarHBondContact O-N 3.01Å; G835-I843 VanDerWaalsContact O-N 3.14Å; I843-P846 HydrophobicContact CG2-CB 3.79Å; I843-P846 HydrophobicContact CG2-CG 4.29Å; I843-I860 HydrophobicContact CD1-CG2 4.24Å; I843-I860 HydrophobicContact CG2-CG2 4.14Å; I843-D862 HydrophobicContact CG2-CB 3.97Å; I843-L916 HydrophobicContact CD1-CD1 3.62Å; I843-L916 HydrophobicContact CD1-CD2 3.82Å; I843-L916 HydrophobicContact CD1-CG 4.36Å; I843-L916 HydrophobicContact CG1-CD1 3.41Å; I843-L916 VanDerWaalsContact CG1-CD1 3.41Å; I843-L916 HydrophobicContact CG1-CD2 4.34Å
844	L	91.7	Very high	90.7	Very high	31 Å²	31	42.4 Å²	42.4	16%	0.162	23%	0.234	C	C	.	.	S	Bend	trans	-131.6	120.7	177.8	-75.5	175	0	0	0	111.2	P817 Y836 G837 D862 V864	P817-L844 HydrophobicContact CB-CD2 4.46Å; P817-L844 HydrophobicContact CG-CD2 4.23Å; Y836-L844 HydrophobicContact CD1-CD2 3.75Å; Y836-L844 HydrophobicContact CE1-CD2 4.5Å; Y836-L844 HydrophobicContact CG-CD2 4.46Å; G837-L844 VanDerWaalsContact O-CD1 3.29Å; G837-L844 WeakPolarHBondContact O-CD1 3.23Å; G837-L844 WeakPolarHBondContact O-CG 3.16Å; L844-D862 PolarHBondContact N-OD1 2.83Å; L844-V864 HydrophobicContact CB-CB 3.82Å; L844-V864 HydrophobicContact CB-CG1 4.38Å; L844-V864 HydrophobicContact CB-CG2 4.32Å; L844-V864 HydrophobicContact CD1-CG1 4.39Å; L844-V864 PolarHBondContact O-N 3.47Å
845	Q	90.4	Very high	90.5	Very high	61 Å²	61	41.6 Å²	41.6	29%	0.285	22%	0.222	S	C	.	.	S	Bend	trans	49.9	65.8	-174	-51.2	-175.5	-23.1	0	0	112	Y847 H863 V864	Q845-Y847 HydrophobicContact CB-CD2 4.03Å; Q845-Y847 HydrophobicContact CB-CE2 3.91Å; Q845-Y847 WeakPolarHBondContact O-CD2 3.27Å; Q845-Y847 PolarHBondContact O-N 3.25Å; Q845-H863 HydrophobicContact CB-CB 4.48Å; Q845-H863 WeakPolarHBondContact O-CB 3.36Å; Q845-V864 HydrophobicContact CB-CG2 3.9Å; Q845-V864 VanDerWaalsContact CD-CG2 3.48Å; Q845-V864 HydrophobicContact CG-CG2 3.66Å
846	P	93.8	Very high	90.4	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.8	96.4	179.8	24.3	-33.7	0	0	0	112.5	T812 I843 G848 I860 A861	T812-P846 HydrophobicContact CG2-CB 3.78Å; T812-P846 HydrophobicContact CG2-CG 4.27Å; T812-P846 PolarHBondContact OG1-O 3.23Å; I843-P846 HydrophobicContact CG2-CB 3.79Å; I843-P846 HydrophobicContact CG2-CG 4.29Å; P846-G848 VanDerWaalsContact C-N 3.34Å; P846-G848 PolarHBondContact O-N 3.02Å; P846-I860 HydrophobicContact CB-CG2 3.82Å; P846-A861 CarbonylContact C-O 3.57Å; P846-A861 VanDerWaalsContact CA-O 3.31Å; P846-A861 WeakPolarHBondContact CA-O 3.46Å
847	Y	90	Very high	90.4	Very high	30 Å²	30	39.9 Å²	39.9	12%	0.118	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	17.5	-169.7	-92.8	-141.8	0	0	0	115.1	Y797 Y798 W814 Q845 A861 H863 M931	Y797-Y847 AromaticContact CD1-CD2 3.98Å; Y797-Y847 HydrophobicContact CD1-CD2 3.98Å; Y797-Y847 HydrophobicContact CD1-CE2 4.17Å; Y797-Y847 HydrophobicContact CD1-CG 4.48Å; Y797-Y847 HydrophobicContact CE1-CD1 4.08Å; Y797-Y847 AromaticContact CE1-CD2 3.5Å; Y797-Y847 HydrophobicContact CE1-CD2 3.5Å; Y797-Y847 HydrophobicContact CE1-CE1 4.09Å; Y797-Y847 AromaticContact CE1-CE2 3.48Å; Y797-Y847 HydrophobicContact CE1-CE2 3.48Å; Y797-Y847 VanDerWaalsContact CE1-CE2 3.48Å; Y797-Y847 AromaticContact CE1-CG 3.81Å; Y797-Y847 HydrophobicContact CE1-CG 3.81Å; Y797-Y847 AromaticContact CE1-CZ 3.81Å; Y797-Y847 AromaticContact CZ-CE2 3.75Å; Y797-Y847 AromaticContact CZ-CZ 3.74Å; Y797-Y847 VanDerWaalsContact OH-CZ 3.31Å; Y797-Y847 PolarHBondContact OH-OH 3.16Å; Y798-Y847 VanDerWaalsContact CD2-C 3.46Å; Y798-Y847 WeakPolarHBondContact CD2-O 3.45Å; Y798-Y847 WeakPolarHBondContact CE2-O 3.5Å; Y798-Y847 VanDerWaalsContact CZ-O 3.31Å; W814-Y847 AromaticContact CD1-CE2 3.44Å; W814-Y847 VanDerWaalsContact CD1-CE2 3.44Å; W814-Y847 AromaticContact NE1-CE2 3.48Å; Q845-Y847 HydrophobicContact CB-CD2 4.03Å; Q845-Y847 HydrophobicContact CB-CE2 3.91Å; Q845-Y847 WeakPolarHBondContact O-CD2 3.27Å; Q845-Y847 PolarHBondContact O-N 3.25Å; Y847-A861 PolarHBondContact N-O 3.48Å; Y847-H863 HydrophobicContact CG-CB 4.21Å; Y847-M931 CarbonylContact C-O 3.51Å; Y847-M931 CarbonylContact O-C 3.42Å
848	G	94	Very high	90.7	Very high	2 Å²	2	38.8 Å²	38.8	2%	0.021	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	179.7	148.6	174.8	0	0	0	0	0	110	P846 I860 A861 M931	P846-G848 VanDerWaalsContact C-N 3.34Å; P846-G848 PolarHBondContact O-N 3.02Å; G848-I860 WeakPolarHBondContact O-CA 3.22Å; G848-A861 PolarHBondContact O-N 3.3Å; G848-M931 PolarHBondContact N-O 3.35Å
849	I	96.9	Very high	91.1	Very high	10 Å²	10	34 Å²	34	5%	0.051	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	139.3	172.5	-172.1	170.4	0	0	0	108.6	E800 T812 V819 F858 L859	E800-I849 HydrophobicContact CB-CG1 4.38Å; E800-I849 HydrophobicContact CB-CG2 4.06Å; T812-I849 HydrophobicContact CG2-CB 3.69Å; T812-I849 HydrophobicContact CG2-CD1 4.16Å; T812-I849 HydrophobicContact CG2-CG1 4.46Å; T812-I849 HydrophobicContact CG2-CG2 3.92Å; V819-I849 HydrophobicContact CG1-CD1 3.77Å; V819-I849 HydrophobicContact CG2-CD1 4.31Å; I849-F858 HydrophobicContact CD1-CB 4.37Å; I849-F858 HydrophobicContact CD1-CD1 3.65Å; I849-F858 HydrophobicContact CD1-CE1 4.08Å; I849-F858 HydrophobicContact CD1-CG 4.1Å; I849-F858 HydrophobicContact CG1-CB 4.37Å; I849-F858 HydrophobicContact CG1-CD1 3.77Å; I849-F858 HydrophobicContact CG1-CE1 4.46Å; I849-F858 HydrophobicContact CG1-CG 4.39Å; I849-L859 VanDerWaalsContact CA-O 3.3Å; I849-L859 WeakPolarHBondContact CA-O 3.41Å
850	C	95.6	Very high	91.3	Very high	2 Å²	2	30 Å²	30	1%	0.014	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	156.8	167.7	68.5	0	0	0	0	109.4	F858 L859	C850-F858 CarbonylContact O-C 3.59Å; C850-F858 WeakPolarHBondContact O-CA 3.45Å; C850-L859 PolarHBondContact N-O 3.32Å; C850-L859 VanDerWaalsContact N-O 3.1Å; C850-L859 PolarHBondContact O-N 3.39Å
851	Y	93.6	Very high	91.9	Very high	33 Å²	33	26.1 Å²	26.1	13%	0.129	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	133.9	172.9	-172.2	-109.9	0	0	0	109.3	E800 V802 P853 K856 S857 F858 I873 T935	E800-Y851 PolarHBondContact OE1-N 3.13Å; V802-Y851 HydrophobicContact CB-CD2 4.38Å; V802-Y851 HydrophobicContact CB-CG 4.49Å; V802-Y851 HydrophobicContact CG1-CD1 4.18Å; V802-Y851 HydrophobicContact CG1-CD2 3.99Å; V802-Y851 HydrophobicContact CG1-CE1 3.87Å; V802-Y851 HydrophobicContact CG1-CE2 3.66Å; V802-Y851 HydrophobicContact CG1-CG 4.23Å; V802-Y851 HydrophobicContact CG2-CD1 4.27Å; V802-Y851 HydrophobicContact CG2-CD2 3.45Å; V802-Y851 VanDerWaalsContact CG2-CD2 3.45Å; V802-Y851 HydrophobicContact CG2-CE2 3.97Å; V802-Y851 HydrophobicContact CG2-CG 3.62Å; Y851-P853 HydrophobicContact CD1-CB 4.5Å; Y851-P853 HydrophobicContact CD1-CG 4.05Å; Y851-P853 HydrophobicContact CE1-CB 4.28Å; Y851-P853 HydrophobicContact CE1-CG 4.32Å; Y851-P853 WeakPolarHBondContact O-CD 3.34Å; Y851-K856 WeakPolarHBondContact OH-CA 3.35Å; Y851-S857 WeakPolarHBondContact CD2-O 3.46Å; Y851-F858 HydrophobicContact CD2-CD1 4.19Å; Y851-F858 HydrophobicContact CD2-CE1 4.35Å; Y851-F858 HydrophobicContact CD2-CG 4.4Å; Y851-I873 HydrophobicContact CE2-CD1 4.48Å; Y851-T935 PolarHBondContact O-OG1 2.94Å
852	A	92.2	Very high	92.3	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	98.6	173.5	0	0	0	0	0	108.7	W854 M855 K856 S857 L859 T935	A852-W854 VanDerWaalsContact C-N 3.27Å; A852-W854 HydrophobicContact CB-CH2 4.4Å; A852-W854 HydrophobicContact CB-CZ2 4.3Å; A852-W854 HydrophobicContact CB-CZ3 4.48Å; A852-W854 PolarHBondContact O-N 3.34Å; A852-M855 HydrophobicContact CB-CB 4.08Å; A852-M855 HydrophobicContact CB-CG 4.16Å; A852-M855 HydrophobicContact CB-SD 4.03Å; A852-M855 CarbonylContact O-C 3.55Å; A852-M855 PolarHBondContact O-N 3.16Å; A852-K856 PolarHBondContact O-N 3.45Å; A852-S857 PolarHBondContact N-O 3.11Å; A852-S857 PolarHBondContact O-N 3.14Å; A852-L859 HydrophobicContact CB-CD1 3.89Å; A852-L859 HydrophobicContact CB-CG 4.12Å; A852-T935 HydrophobicContact CB-CG2 4.03Å
853	P	88.8	Confident	92.4	Very high	60 Å²	60	22 Å²	22	39%	0.39	10%	0.104	S	C	.	.	G	3₁₀ helix	trans	-58.7	-36.8	-172.8	-26.2	34.4	0	0	0	113.7	Y851 M855 K856 V937	Y851-P853 HydrophobicContact CD1-CB 4.5Å; Y851-P853 HydrophobicContact CD1-CG 4.05Å; Y851-P853 HydrophobicContact CE1-CB 4.28Å; Y851-P853 HydrophobicContact CE1-CG 4.32Å; Y851-P853 WeakPolarHBondContact O-CD 3.34Å; P853-M855 VanDerWaalsContact C-N 3.32Å; P853-M855 PolarHBondContact O-N 3.29Å; P853-K856 PolarHBondContact O-N 2.84Å; P853-V937 HydrophobicContact CG-CG1 4.49Å; P853-V937 HydrophobicContact CG-CG2 4.33Å
854	W	87.1	Confident	92.4	Very high	50 Å²	50	24.8 Å²	24.8	19%	0.189	12%	0.12	C	C	.	.	G	3₁₀ helix	trans	-70.4	-27.6	-180	66.1	91.9	0	0	0	113	A852 T935 V937 K940 I942	A852-W854 VanDerWaalsContact C-N 3.27Å; A852-W854 HydrophobicContact CB-CH2 4.4Å; A852-W854 HydrophobicContact CB-CZ2 4.3Å; A852-W854 HydrophobicContact CB-CZ3 4.48Å; A852-W854 PolarHBondContact O-N 3.34Å; W854-T935 VanDerWaalsContact CH2-CB 3.43Å; W854-T935 HydrophobicContact CH2-CG2 3.42Å; W854-T935 VanDerWaalsContact CH2-CG2 3.42Å; W854-T935 HydrophobicContact CZ2-CG2 4.21Å; W854-T935 HydrophobicContact CZ3-CG2 3.95Å; W854-V937 HydrophobicContact CE3-CG1 4.3Å; W854-V937 HydrophobicContact CZ3-CB 4.23Å; W854-V937 HydrophobicContact CZ3-CG1 4.43Å; W854-V937 HydrophobicContact CZ3-CG2 4.08Å; W854-K940 HydrophobicContact CD2-CB 4.26Å; W854-K940 HydrophobicContact CD2-CG 4.19Å; W854-K940 HydrophobicContact CG-CD 4.48Å; W854-K940 HydrophobicContact CG-CG 4.19Å; W854-K940 HydrophobicContact CZ2-CB 4.31Å; W854-I942 HydrophobicContact CZ2-CG1 4.26Å
855	M	87	Confident	92.4	Very high	13 Å²	13	24.7 Å²	24.7	6%	0.064	12%	0.12	C	C	.	.	G	3₁₀ helix	trans	-91.5	-8.9	174.9	-58	175.3	66	0	0	112.7	A852 P853 S857 L859 I919 I942	A852-M855 HydrophobicContact CB-CB 4.08Å; A852-M855 HydrophobicContact CB-CG 4.16Å; A852-M855 HydrophobicContact CB-SD 4.03Å; A852-M855 CarbonylContact O-C 3.55Å; A852-M855 PolarHBondContact O-N 3.16Å; P853-M855 VanDerWaalsContact C-N 3.32Å; P853-M855 PolarHBondContact O-N 3.29Å; M855-S857 PolarHBondContact O-N 3.13Å; M855-S857 PolarHBondContact O-OG 2.93Å; M855-L859 HydrophobicContact CE-CD2 4.2Å; M855-L859 HydrophobicContact SD-CD2 4.24Å; M855-I919 HydrophobicContact CE-CD1 3.74Å; M855-I942 HydrophobicContact SD-CD1 4.22Å
856	K	86.7	Confident	92.6	Very high	145 Å²	145	23.7 Å²	23.7	63%	0.63	12%	0.115	S	C	*	.	T	Hydrogen-bonded Turn	trans	48.3	38.5	-170.1	-59.1	-175.2	178	-173.7	0	113.3	Y851 A852 P853	Y851-K856 WeakPolarHBondContact OH-CA 3.35Å; A852-K856 PolarHBondContact O-N 3.45Å; P853-K856 PolarHBondContact O-N 2.84Å
857	S	90.5	Very high	92.6	Very high	3 Å²	3	24.5 Å²	24.5	2%	0.021	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	144.8	-170.7	-54.8	0	0	0	0	111.2	Y851 A852 M855 C871 Q872	Y851-S857 WeakPolarHBondContact CD2-O 3.46Å; A852-S857 PolarHBondContact N-O 3.11Å; A852-S857 PolarHBondContact O-N 3.14Å; M855-S857 PolarHBondContact O-N 3.13Å; M855-S857 PolarHBondContact O-OG 2.93Å; S857-C871 CarbonylContact C-O 3.58Å; S857-C871 VanDerWaalsContact CA-O 3.31Å; S857-C871 WeakPolarHBondContact CA-O 3.36Å; S857-Q872 WeakPolarHBondContact OG-CG 3.34Å
858	F	93.6	Very high	92.8	Very high	0 Å²	0	23 Å²	23	0%	0	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	143.9	157	-70.6	-72.7	0	0	0	109.4	E800 V802 L821 I849 C850 Y851 I860 S870 C871 I873 L913	E800-F858 HydrophobicContact CB-CE1 4.1Å; E800-F858 HydrophobicContact CG-CD1 4.38Å; E800-F858 HydrophobicContact CG-CE1 4.02Å; V802-F858 HydrophobicContact CB-CZ 4.3Å; V802-F858 HydrophobicContact CG2-CD1 4.28Å; V802-F858 HydrophobicContact CG2-CE1 3.31Å; V802-F858 HydrophobicContact CG2-CE2 4.01Å; V802-F858 HydrophobicContact CG2-CZ 3.15Å; L821-F858 HydrophobicContact CD1-CE2 3.85Å; L821-F858 HydrophobicContact CD1-CZ 3.96Å; I849-F858 HydrophobicContact CD1-CB 4.37Å; I849-F858 HydrophobicContact CD1-CD1 3.65Å; I849-F858 HydrophobicContact CD1-CE1 4.08Å; I849-F858 HydrophobicContact CD1-CG 4.1Å; I849-F858 HydrophobicContact CG1-CB 4.37Å; I849-F858 HydrophobicContact CG1-CD1 3.77Å; I849-F858 HydrophobicContact CG1-CE1 4.46Å; I849-F858 HydrophobicContact CG1-CG 4.39Å; C850-F858 CarbonylContact O-C 3.59Å; C850-F858 WeakPolarHBondContact O-CA 3.45Å; Y851-F858 HydrophobicContact CD2-CD1 4.19Å; Y851-F858 HydrophobicContact CD2-CE1 4.35Å; Y851-F858 HydrophobicContact CD2-CG 4.4Å; F858-I860 HydrophobicContact CB-CD1 4Å; F858-S870 CarbonylContact O-C 3.21Å; F858-S870 WeakPolarHBondContact O-CA 3.36Å; F858-S870 WeakPolarHBondContact O-CB 3.41Å; F858-C871 PolarHBondContact N-O 3.21Å; F858-C871 PolarHBondContact O-N 3.2Å; F858-I873 HydrophobicContact CD2-CG1 4.28Å; F858-I873 HydrophobicContact CE2-CD1 3.72Å; F858-I873 HydrophobicContact CE2-CG1 3.86Å; F858-I873 HydrophobicContact CZ-CD1 4.26Å; F858-L913 HydrophobicContact CD2-CD2 4.04Å; F858-L913 HydrophobicContact CE2-CD2 4.07Å
859	L	95.3	Very high	92.8	Very high	0 Å²	0	23 Å²	23	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	134.9	166.4	-57.5	174.7	0	0	0	108	I849 C850 A852 M855 Q869 I919 I933 T935 I942	I849-L859 VanDerWaalsContact CA-O 3.3Å; I849-L859 WeakPolarHBondContact CA-O 3.41Å; C850-L859 PolarHBondContact N-O 3.32Å; C850-L859 VanDerWaalsContact N-O 3.1Å; C850-L859 PolarHBondContact O-N 3.39Å; A852-L859 HydrophobicContact CB-CD1 3.89Å; A852-L859 HydrophobicContact CB-CG 4.12Å; M855-L859 HydrophobicContact CE-CD2 4.2Å; M855-L859 HydrophobicContact SD-CD2 4.24Å; L859-Q869 CarbonylContact C-O 3.51Å; L859-Q869 WeakPolarHBondContact CA-O 3.48Å; L859-I919 HydrophobicContact CD2-CG1 4.07Å; L859-I933 HydrophobicContact CB-CD1 3.73Å; L859-I933 HydrophobicContact CD1-CD1 4.44Å; L859-T935 HydrophobicContact CD1-CG2 4.14Å; L859-I942 HydrophobicContact CD1-CB 4.37Å; L859-I942 HydrophobicContact CD1-CD1 3.58Å; L859-I942 HydrophobicContact CD1-CG1 3.61Å; L859-I942 HydrophobicContact CD1-CG2 3.88Å; L859-I942 HydrophobicContact CD2-CD1 4.43Å
860	I	96	Very high	92.6	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	128.1	-174.5	-55.7	82.1	0	0	0	108.9	V819 I843 P846 G848 F858 D862 I868 Q869 L916	V819-I860 HydrophobicContact CG2-CD1 4.29Å; V819-I860 HydrophobicContact CG2-CG1 3.6Å; I843-I860 HydrophobicContact CD1-CG2 4.24Å; I843-I860 HydrophobicContact CG2-CG2 4.14Å; P846-I860 HydrophobicContact CB-CG2 3.82Å; G848-I860 WeakPolarHBondContact O-CA 3.22Å; F858-I860 HydrophobicContact CB-CD1 4Å; I860-D862 PolarHBondContact O-N 3.5Å; I860-I868 WeakPolarHBondContact O-CA 3.49Å; I860-Q869 PolarHBondContact N-O 2.88Å; I860-Q869 PolarHBondContact O-N 3.16Å; I860-L916 HydrophobicContact CD1-CD2 4.18Å
861	A	96	Very high	92.4	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80	98.1	168.7	0	0	0	0	0	109.8	P846 Y847 G848 H863 P930 M931 I933	P846-A861 CarbonylContact C-O 3.57Å; P846-A861 VanDerWaalsContact CA-O 3.31Å; P846-A861 WeakPolarHBondContact CA-O 3.46Å; Y847-A861 PolarHBondContact N-O 3.48Å; G848-A861 PolarHBondContact O-N 3.3Å; A861-H863 PolarHBondContact O-N 3.18Å; A861-H863 VanDerWaalsContact O-N 3.15Å; A861-P930 HydrophobicContact CB-CB 3.89Å; A861-P930 HydrophobicContact CB-CG 4.22Å; A861-M931 WeakPolarHBondContact CB-O 3.37Å; A861-I933 HydrophobicContact CB-CG2 4.34Å
862	D	94.6	Very high	92.2	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	82	177.4	-173.3	2.9	0	0	0	109	I843 L844 I860 V864 N865 H866 R867	I843-D862 HydrophobicContact CG2-CB 3.97Å; L844-D862 PolarHBondContact N-OD1 2.83Å; I860-D862 PolarHBondContact O-N 3.5Å; D862-V864 PolarHBondContact O-N 2.81Å; D862-N865 VanDerWaalsContact CG-ND2 3.34Å; D862-N865 PolarHBondContact O-N 2.77Å; D862-N865 PolarHBondContact OD1-ND2 3.04Å; D862-N865 VanDerWaalsContact OD1-ND2 3.11Å; D862-N865 VanDerWaalsContact OD2-CB 3.28Å; D862-N865 WeakPolarHBondContact OD2-CB 3.31Å; D862-N865 PolarHBondContact OD2-ND2 2.91Å; D862-H866 PolarHBondContact O-N 3.07Å; D862-H866 VanDerWaalsContact O-N 3.1Å; D862-R867 WeakPolarHBondContact CA-O 3.46Å; D862-R867 HydrophobicContact CB-CG 3.79Å; D862-R867 WeakPolarHBondContact CB-O 3.22Å; D862-R867 PolarHBondContact N-O 2.05Å; D862-R867 PolarHBondContact O-N 2.82Å; D862-R867 IonicContact OD2-CZ 3.9Å; D862-R867 IonicContact OD2-NE 3.92Å; D862-R867 PolarHBondContact OD2-NE 3.44Å; D862-R867 IonicContact OD2-NH2 3.69Å; D862-R867 PolarHBondContact OD2-NH2 3.38Å; D862-R867 VanDerWaalsContact OD2-NH2 3.09Å
863	H	94.3	Very high	91.8	Very high	22 Å²	22	25.3 Å²	25.3	10%	0.102	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-54.6	-165.4	177.3	-99	0	0	0	113.3	Q845 Y847 A861 N865 H866 H929 P930	Q845-H863 HydrophobicContact CB-CB 4.48Å; Q845-H863 WeakPolarHBondContact O-CB 3.36Å; Y847-H863 HydrophobicContact CG-CB 4.21Å; A861-H863 PolarHBondContact O-N 3.18Å; A861-H863 VanDerWaalsContact O-N 3.15Å; H863-N865 VanDerWaalsContact C-N 3.35Å; H863-N865 PolarHBondContact O-N 3.37Å; H863-H866 PolarHBondContact O-N 3.14Å; H863-H866 PolarHBondContact O-ND1 3.07Å; H863-H866 VanDerWaalsContact O-ND1 3.16Å; H863-H929 AromaticContact CE1-CD2 3.77Å; H863-H929 AromaticContact NE2-CD2 3.84Å; H863-P930 PolarHBondContact CD2-O 2.96Å
864	V	92.1	Very high	91.5	Very high	58 Å²	58	27.7 Å²	27.7	35%	0.352	13%	0.129	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-34.1	-174.2	178.4	0	0	0	0	111.2	L844 Q845 D862 H866	L844-V864 HydrophobicContact CB-CB 3.82Å; L844-V864 HydrophobicContact CB-CG1 4.38Å; L844-V864 HydrophobicContact CB-CG2 4.32Å; L844-V864 HydrophobicContact CD1-CG1 4.39Å; L844-V864 PolarHBondContact O-N 3.47Å; Q845-V864 HydrophobicContact CB-CG2 3.9Å; Q845-V864 VanDerWaalsContact CD-CG2 3.48Å; Q845-V864 HydrophobicContact CG-CG2 3.66Å; D862-V864 PolarHBondContact O-N 2.81Å; V864-H866 PolarHBondContact O-CE1 2.95Å; V864-H866 PolarHBondContact O-N 3.28Å
865	N	92.1	Very high	90.8	Very high	29 Å²	29	28.5 Å²	28.5	16%	0.155	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.7	1.8	177.2	-64.8	-38.9	0	0	0	113.2	G837 T838 D862 H863 R867	G837-N865 PolarHBondContact O-ND2 3.37Å; T838-N865 WeakPolarHBondContact CG2-OD1 3.44Å; D862-N865 VanDerWaalsContact CG-ND2 3.34Å; D862-N865 PolarHBondContact O-N 2.77Å; D862-N865 PolarHBondContact OD1-ND2 3.04Å; D862-N865 VanDerWaalsContact OD1-ND2 3.11Å; D862-N865 VanDerWaalsContact OD2-CB 3.28Å; D862-N865 WeakPolarHBondContact OD2-CB 3.31Å; D862-N865 PolarHBondContact OD2-ND2 2.91Å; H863-N865 VanDerWaalsContact C-N 3.35Å; H863-N865 PolarHBondContact O-N 3.37Å; N865-R867 HydrophobicContact CB-CG 3.97Å; N865-R867 PolarHBondContact ND2-NH2 3.25Å; N865-R867 PolarHBondContact O-N 3.28Å
866	H	93.8	Very high	89.5	Confident	40 Å²	40	30.3 Å²	30.3	19%	0.185	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.3	49.1	177.1	-48.2	-37.9	0	0	0	113.7	D862 H863 V864 K922 H929	D862-H866 PolarHBondContact O-N 3.07Å; D862-H866 VanDerWaalsContact O-N 3.1Å; H863-H866 PolarHBondContact O-N 3.14Å; H863-H866 PolarHBondContact O-ND1 3.07Å; H863-H866 VanDerWaalsContact O-ND1 3.16Å; V864-H866 PolarHBondContact O-CE1 2.95Å; V864-H866 PolarHBondContact O-N 3.28Å; H866-K922 HydrophobicContact CB-CB 4.02Å; H866-K922 HydrophobicContact CB-CD 4.22Å; H866-K922 PolarHBondContact O-N 3.16Å; H866-K922 VanDerWaalsContact O-N 3.08Å; H866-H929 AromaticContact CE1-CD2 3.4Å; H866-H929 PolarHBondContact CE1-CD2 3.09Å; H866-H929 VanDerWaalsContact CE1-CD2 3.4Å; H866-H929 AromaticContact CE1-CE1 3.4Å; H866-H929 PolarHBondContact CE1-CE1 3.39Å; H866-H929 VanDerWaalsContact CE1-CE1 3.4Å; H866-H929 AromaticContact CE1-CG 3.91Å; H866-H929 AromaticContact CE1-ND1 3.9Å; H866-H929 AromaticContact CE1-NE2 3.05Å; H866-H929 PolarHBondContact CE1-NE2 3.34Å; H866-H929 AromaticContact ND1-CD2 3.61Å; H866-H929 AromaticContact ND1-CE1 3.94Å; H866-H929 AromaticContact ND1-CG 3.79Å; H866-H929 AromaticContact ND1-ND1 3.98Å; H866-H929 AromaticContact ND1-NE2 3.72Å
867	R	93.8	Very high	88	Confident	17 Å²	17	26.3 Å²	26.3	6%	0.064	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	163.4	-175.3	65.8	-171.7	-174.6	-175.2	-0.9	112.6	T838 T839 N842 D862 N865 Q869 L918 A920 E921 P930	T838-R867 PolarHBondContact O-NH1 3.09Å; T839-R867 PolarHBondContact O-NH1 3.25Å; T839-R867 PolarHBondContact O-NH2 3.2Å; N842-R867 PolarHBondContact O-NH2 3.41Å; D862-R867 WeakPolarHBondContact CA-O 3.46Å; D862-R867 HydrophobicContact CB-CG 3.79Å; D862-R867 WeakPolarHBondContact CB-O 3.22Å; D862-R867 PolarHBondContact N-O 2.05Å; D862-R867 PolarHBondContact O-N 2.82Å; D862-R867 IonicContact OD2-CZ 3.9Å; D862-R867 IonicContact OD2-NE 3.92Å; D862-R867 PolarHBondContact OD2-NE 3.44Å; D862-R867 IonicContact OD2-NH2 3.69Å; D862-R867 PolarHBondContact OD2-NH2 3.38Å; D862-R867 VanDerWaalsContact OD2-NH2 3.09Å; N865-R867 HydrophobicContact CB-CG 3.97Å; N865-R867 PolarHBondContact ND2-NH2 3.25Å; N865-R867 PolarHBondContact O-N 3.28Å; R867-Q869 HydrophobicContact CG-CG 4.15Å; R867-L918 HydrophobicContact CB-CD1 3.79Å; R867-L918 HydrophobicContact CG-CD1 4.16Å; R867-A920 CarbonylContact C-O 3.5Å; R867-A920 VanDerWaalsContact CA-O 3.25Å; R867-A920 WeakPolarHBondContact CA-O 3.32Å; R867-A920 VanDerWaalsContact CB-O 3.3Å; R867-A920 WeakPolarHBondContact CB-O 3.31Å; R867-E921 HydrophobicContact CB-CB 3.99Å; R867-P930 WeakPolarHBondContact O-CG 3.26Å
868	I	94.7	Very high	85.5	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	129.5	169.2	-59.3	166.3	0	0	0	107	I860 I919 A920 I927 P930 I933 V944 L954	I860-I868 WeakPolarHBondContact O-CA 3.49Å; I868-I919 HydrophobicContact CB-CB 4.33Å; I868-I919 HydrophobicContact CG2-CB 4.08Å; I868-I919 HydrophobicContact CG2-CG2 4.35Å; I868-I919 WeakPolarHBondContact O-CB 3.48Å; I868-I919 PolarHBondContact O-N 3.25Å; I868-A920 HydrophobicContact CB-CB 4.39Å; I868-A920 HydrophobicContact CD1-CB 4.24Å; I868-A920 PolarHBondContact N-O 2.99Å; I868-A920 PolarHBondContact O-N 3.38Å; I868-I927 HydrophobicContact CD1-CD1 4.16Å; I868-I927 HydrophobicContact CD1-CG1 4.42Å; I868-I927 HydrophobicContact CD1-CG2 4.39Å; I868-I927 HydrophobicContact CG1-CG2 4.3Å; I868-P930 HydrophobicContact CG1-CB 4.47Å; I868-I933 HydrophobicContact CD1-CD1 4.22Å; I868-I933 HydrophobicContact CG1-CD1 4.33Å; I868-I933 HydrophobicContact CG2-CD1 3.65Å; I868-V944 HydrophobicContact CD1-CB 4.23Å; I868-V944 HydrophobicContact CD1-CG1 4.18Å; I868-V944 HydrophobicContact CD1-CG2 3.3Å; I868-V944 HydrophobicContact CG1-CG2 4.39Å; I868-L954 HydrophobicContact CD1-CD1 3.99Å
869	Q	93.8	Very high	82.9	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	162	175.3	-60.1	-169.8	-54.6	0	0	110.5	N840 N842 L859 I860 R867 L916 K917	N840-Q869 PolarHBondContact O-NE2 3.43Å; N842-Q869 PolarHBondContact O-OE1 3.23Å; L859-Q869 CarbonylContact C-O 3.51Å; L859-Q869 WeakPolarHBondContact CA-O 3.48Å; I860-Q869 PolarHBondContact N-O 2.88Å; I860-Q869 PolarHBondContact O-N 3.16Å; R867-Q869 HydrophobicContact CG-CG 4.15Å; Q869-L916 HydrophobicContact CB-CD2 3.99Å; Q869-K917 CarbonylContact C-O 3.57Å; Q869-K917 VanDerWaalsContact CA-O 3.29Å; Q869-K917 WeakPolarHBondContact CA-O 3.47Å
870	S	93.4	Very high	80.3	Confident	4 Å²	4	42.4 Å²	42.4	3%	0.028	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	147.7	174.8	63.1	0	0	0	0	111.6	F858 L916 K917 I919	F858-S870 CarbonylContact O-C 3.21Å; F858-S870 WeakPolarHBondContact O-CA 3.36Å; F858-S870 WeakPolarHBondContact O-CB 3.41Å; S870-L916 CarbonylContact O-C 3.47Å; S870-L916 WeakPolarHBondContact O-CA 3.46Å; S870-K917 PolarHBondContact N-O 3.12Å; S870-K917 PolarHBondContact O-N 3.25Å; S870-K917 PolarHBondContact OG-O 3.23Å; S870-I919 WeakPolarHBondContact OG-CD1 3.3Å
871	C	92	Very high	77.3	Confident	1 Å²	1	48.4 Å²	48.4	1%	0.007	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	134.9	167.1	63.4	0	0	0	0	110.3	I833 S857 F858 L916	I833-C871 HydrophobicContact CG2-CB 4.43Å; S857-C871 CarbonylContact C-O 3.58Å; S857-C871 VanDerWaalsContact CA-O 3.31Å; S857-C871 WeakPolarHBondContact CA-O 3.36Å; F858-C871 PolarHBondContact N-O 3.21Å; F858-C871 PolarHBondContact O-N 3.2Å; C871-L916 HydrophobicContact CB-CD2 4.05Å
872	Q	89.2	Confident	74.3	Confident	69 Å²	69	54.4 Å²	54.4	32%	0.322	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	147.5	179.3	-75.1	176.5	-25.8	0	0	110.6	S857 L913 S914	S857-Q872 WeakPolarHBondContact OG-CG 3.34Å; Q872-L913 CarbonylContact O-C 3.1Å; Q872-S914 PolarHBondContact N-OG 3.49Å; Q872-S914 PolarHBondContact O-N 2.8Å
873	I	83.8	Confident	71.3	Confident	20 Å²	20	61.3 Å²	61.3	10%	0.103	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	122.7	165.7	-56	-175.1	0	0	0	108.2	V802 L821 Y851 F858 I911 L913	V802-I873 HydrophobicContact CB-CD1 3.99Å; V802-I873 HydrophobicContact CG1-CD1 3.6Å; V802-I873 HydrophobicContact CG2-CD1 4.13Å; L821-I873 HydrophobicContact CD1-CD1 4.47Å; Y851-I873 HydrophobicContact CE2-CD1 4.48Å; F858-I873 HydrophobicContact CD2-CG1 4.28Å; F858-I873 HydrophobicContact CE2-CD1 3.72Å; F858-I873 HydrophobicContact CE2-CG1 3.86Å; F858-I873 HydrophobicContact CZ-CD1 4.26Å; I873-I911 HydrophobicContact CG2-CG2 3.33Å; I873-L913 HydrophobicContact CG1-CD2 4.26Å
874	K	81.5	Confident	68.2	Low	110 Å²	110	67 Å²	67	48%	0.478	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	119	176.5	-68.8	-176.6	173.2	-179.4	0	109.5	N912	K874-N912 PolarHBondContact N-O 2.9Å; K874-N912 PolarHBondContact O-N 3.41Å
875	H	72.2	Confident	65	Low	67 Å²	67	70 Å²	70	31%	0.31	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	119.6	167.9	-57.3	-92.2	0	0	0	108.2	D804 I908	D804-H875 IonicContact OD2-CE1 3.04Å; D804-H875 PolarHBondContact OD2-CE1 3.44Å; D804-H875 IonicContact OD2-NE2 3.36Å; H875-I908 HydrophobicContact CB-CD1 4.25Å; H875-I908 HydrophobicContact CB-CG1 4.37Å; H875-I908 HydrophobicContact CB-CG2 4.23Å
876	I	60.9	Low	61.9	Low	52 Å²	52	75.2 Å²	75.2	27%	0.267	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	118.8	177	-59.3	173	0	0	0	107.3	T909 S910 N912	I876-T909 PolarHBondContact O-N 3.38Å; I876-T909 PolarHBondContact O-OG1 3.14Å; I876-T909 VanDerWaalsContact O-OG1 3.09Å; I876-S910 PolarHBondContact N-O 3.21Å; I876-N912 HydrophobicContact CD1-CB 4.02Å
877	N	54.1	Low	58.8	Low	60 Å²	60	80.9 Å²	80.9	32%	0.321	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	155.2	176.4	-68.6	-26.8	0	0	0	110.3	N879 D880	N877-N879 PolarHBondContact O-N 2.97Å; N877-D880 PolarHBondContact O-N 3.39Å; N877-D880 VanDerWaalsContact O-N 3.12Å
878	E	39.2	Very low	55.9	Low	90 Å²	90	86.3 Å²	86.3	42%	0.421	45%	0.454	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.5	-17.2	179.3	-136.6	163	-125.5	0	0	114.3	K907 T909	E878-K907 WeakPolarHBondContact OE1-CD 3.33Å; E878-T909 HydrophobicContact CB-CG2 3.8Å; E878-T909 HydrophobicContact CG-CG2 3.54Å
879	N	37.6	Very low	52.8	Low	145 Å²	145	91.3 Å²	91.3	78%	0.775	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.8	-6	-176.5	-66.4	-20.8	0	0	0	115.6	N877 T881	N877-N879 PolarHBondContact O-N 2.97Å; N879-T881 PolarHBondContact O-N 3.13Å
880	D	42.4	Very low	49.7	Very low	107 Å²	107	102.8 Å²	102.8	57%	0.572	52%	0.524	S	S	*	.			trans	-90.8	65.7	-178.5	-77.4	-31.2	0	0	0	111.7	N877 T882	N877-D880 PolarHBondContact O-N 3.39Å; N877-D880 VanDerWaalsContact O-N 3.12Å; D880-T882 PolarHBondContact O-N 3.46Å
881	T	31.4	Very low	46.8	Very low	125 Å²	125	105.3 Å²	105.3	77%	0.767	54%	0.542	S	S	*	.			trans	-89.7	19.6	-175.6	51.4	0	0	0	0	115.5	N879	N879-T881 PolarHBondContact O-N 3.13Å
882	T	32.7	Very low	44.1	Very low	126 Å²	126	109.7 Å²	109.7	77%	0.773	56%	0.564	S	S	*	*	S	Bend	trans	-105.4	4.7	-170.1	45.3	0	0	0	0	117	D880	D880-T882 PolarHBondContact O-N 3.46Å
883	I	32.5	Very low	41.3	Very low	145 Å²	145	115.6 Å²	115.6	74%	0.744	59%	0.589	S	S	*	*			trans	-141.9	74.1	178	-45.6	176.3	0	0	0	111.5
884	L	28.2	Very low	38.7	Very low	142 Å²	142	123.1 Å²	123.1	74%	0.743	62%	0.624	S	S	*	*			trans	-140.3	73.4	166.2	-72.1	175.4	0	0	0	110.2
885	T	26	Very low	36.3	Very low	122 Å²	122	121.5 Å²	121.5	75%	0.748	62%	0.623	S	S	*	*			trans	-104.7	131.1	161.2	45.3	0	0	0	0	109.7
886	N	26	Very low	34.2	Very low	137 Å²	137	124 Å²	124	73%	0.733	64%	0.639	S	S	*	*	S	Bend	trans	89.8	113.2	165.9	-53.4	-13.6	0	0	0	117.9	F888	N886-F888 PolarHBondContact O-N 3.38Å; N886-F888 VanDerWaalsContact O-N 3.14Å
887	D	29.3	Very low	32.7	Very low	159 Å²	159	124.2 Å²	124.2	85%	0.85	65%	0.654	S	S	*	*	S	Bend	trans	67.1	-6.5	156.2	-58.8	-26.1	0	0	0	122.4
888	F	32.2	Very low	31.7	Very low	131 Å²	131	128.3 Å²	128.3	58%	0.575	68%	0.675	S	S	*	*	S	Bend	trans	-88.5	-15.1	-176.7	-96.1	-93.5	0	0	0	117.2	N886 I892	N886-F888 PolarHBondContact O-N 3.38Å; N886-F888 VanDerWaalsContact O-N 3.14Å; F888-I892 WeakPolarHBondContact O-CD1 3.43Å
889	N	30.7	Very low	31.6	Very low	105 Å²	105	126.9 Å²	126.9	56%	0.561	67%	0.67	S	S	*	*	S	Bend	trans	-95	2	-170.9	-84.4	-28.9	0	0	0	116.3
890	R	29.3	Very low	31.3	Very low	241 Å²	241	123.3 Å²	123.3	91%	0.909	65%	0.649	S	S	*	*	S	Bend	trans	-93.6	-18.8	-179	-115.2	179.7	-173.4	177.6	1.9	114.9
891	S	31.5	Very low	31.1	Very low	58 Å²	58	119.4 Å²	119.4	41%	0.406	63%	0.628	S	S	.	*	S	Bend	trans	-101.1	-16.3	178.3	56.9	0	0	0	0	114.4
892	I	35.2	Very low	31.2	Very low	92 Å²	92	118 Å²	118	47%	0.472	62%	0.616	S	S	.	*	G	3₁₀ helix	trans	-80.5	-15.2	-177.7	-62.9	174.5	0	0	0	112.4	F888 Q894	F888-I892 WeakPolarHBondContact O-CD1 3.43Å; I892-Q894 PolarHBondContact O-N 3.29Å
893	K	30.1	Very low	31.4	Very low	193 Å²	193	113.1 Å²	113.1	84%	0.839	59%	0.585	S	S	*	*	G	3₁₀ helix	trans	-78	1.9	176.4	-76.1	-170.9	175.1	-174.6	0	114.9
894	Q	30.2	Very low	31.4	Very low	178 Å²	178	113.6 Å²	113.6	83%	0.832	59%	0.589	S	S	*	*	G	3₁₀ helix	trans	-122	6.8	-178.3	-81.2	-175.6	-16.1	0	0	114.7	I892	I892-Q894 PolarHBondContact O-N 3.29Å
895	T	30.8	Very low	31.7	Very low	76 Å²	76	110.3 Å²	110.3	47%	0.466	59%	0.59	S	S	.	*	S	Bend	trans	-119	116.6	172.7	51.7	0	0	0	0	109.6
896	N	27.6	Very low	32	Very low	121 Å²	121	110.5 Å²	110.5	65%	0.647	58%	0.582	S	S	*	*			trans	-51.8	142.8	-176.8	-62.8	-10.1	0	0	0	113.4	E151	E151-N896 PolarHBondContact OE1-ND2 2.98Å; E151-N896 PolarHBondContact OE2-ND2 3.35Å
897	G	28.9	Very low	32.6	Very low	56 Å²	56	106.2 Å²	106.2	58%	0.577	56%	0.557	S	S	*	*			trans	82.4	85	158.2	0	0	0	0	0	118	N899	G897-N899 PolarHBondContact O-N 3.49Å
898	L	33.4	Very low	33.4	Very low	146 Å²	146	99.3 Å²	99.3	76%	0.764	52%	0.52	S	S	*	.			trans	-62	103	161.2	-85.2	156.4	0	0	0	109.5	Q900	L898-Q900 PolarHBondContact O-N 3.4Å; L898-Q900 VanDerWaalsContact O-N 3.16Å
899	N	36.6	Very low	34.2	Very low	60 Å²	60	95.5 Å²	95.5	32%	0.321	51%	0.507	S	S	.	.			trans	-71.2	101.6	175.2	-79	-31.8	0	0	0	110.3	T826 S828 G897 I901	T826-N899 PolarHBondContact OG1-ND2 3.34Å; S828-N899 WeakPolarHBondContact CB-ND2 3.44Å; S828-N899 PolarHBondContact OG-ND2 3.12Å; G897-N899 PolarHBondContact O-N 3.49Å; N899-I901 PolarHBondContact O-N 2.81Å
900	Q	33.1	Very low	35.8	Very low	70 Å²	70	92.8 Å²	92.8	33%	0.327	50%	0.496	S	S	.	.			trans	-68.2	121	167.5	-65.5	179.8	7	0	0	108.9	N155 L898	N155-Q900 HydrophobicContact CB-CG 4.43Å; L898-Q900 PolarHBondContact O-N 3.4Å; L898-Q900 VanDerWaalsContact O-N 3.16Å
901	I	37.8	Very low	37.9	Very low	24 Å²	24	81.6 Å²	81.6	12%	0.123	46%	0.455	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	110.2	171	-54.1	174.6	0	0	0	106.6	N899 V903 I908 I911	N899-I901 PolarHBondContact O-N 2.81Å; I901-V903 HydrophobicContact CG2-CG2 3.82Å; I901-V903 PolarHBondContact O-N 3.48Å; I901-I908 WeakPolarHBondContact O-CB 3.38Å; I901-I911 HydrophobicContact CD1-CD1 3.72Å; I901-I911 HydrophobicContact CD1-CG1 4.47Å
902	N	33.4	Very low	40.3	Very low	97 Å²	97	82.1 Å²	82.1	52%	0.519	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	112.2	169.3	-96.5	-16.2	0	0	0	108.4
903	V	35.9	Very low	42.7	Very low	22 Å²	22	78.4 Å²	78.4	13%	0.133	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	120.5	166	-175.4	0	0	0	0	107.2	I901 G905 H906 I908	I901-V903 HydrophobicContact CG2-CG2 3.82Å; I901-V903 PolarHBondContact O-N 3.48Å; V903-G905 VanDerWaalsContact C-N 3.34Å; V903-G905 PolarHBondContact O-N 3.48Å; V903-H906 PolarHBondContact O-N 3.37Å; V903-I908 HydrophobicContact CB-CD1 3.75Å; V903-I908 HydrophobicContact CG2-CD1 3.72Å
904	N	33.7	Very low	45.4	Very low	155 Å²	155	69.4 Å²	69.4	83%	0.829	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.2	35.9	175.9	-60.7	-19.6	0	0	0	116	H906	N904-H906 VanDerWaalsContact C-N 3.26Å; N904-H906 PolarHBondContact O-N 3.25Å
905	G	33.6	Very low	48.2	Very low	73 Å²	73	63.9 Å²	63.9	75%	0.753	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.8	5.9	176.5	0	0	0	0	0	115.5	V903	V903-G905 VanDerWaalsContact C-N 3.34Å; V903-G905 PolarHBondContact O-N 3.48Å
906	H	32.8	Very low	51.1	Low	127 Å²	127	60.6 Å²	60.6	59%	0.588	36%	0.356	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.6	129.2	170.5	-70.1	-59.7	0	0	0	110.7	V903 N904 I908	V903-H906 PolarHBondContact O-N 3.37Å; N904-H906 VanDerWaalsContact C-N 3.26Å; N904-H906 PolarHBondContact O-N 3.25Å; H906-I908 PolarHBondContact O-N 3.28Å; H906-I908 VanDerWaalsContact O-N 3.09Å
907	K	39	Very low	54.1	Low	47 Å²	47	59 Å²	59	20%	0.204	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	100	173.1	-74.8	-169.4	176.1	-162.9	0	109.6	D156 E878	D156-K907 IonicContact OD1-NZ 3.67Å; E878-K907 WeakPolarHBondContact OE1-CD 3.33Å
908	I	45.7	Very low	57	Low	14 Å²	14	58.8 Å²	58.8	7%	0.072	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	117.8	168.6	-61.7	164.9	0	0	0	106.9	H875 I901 V903 H906 S910 I911	H875-I908 HydrophobicContact CB-CD1 4.25Å; H875-I908 HydrophobicContact CB-CG1 4.37Å; H875-I908 HydrophobicContact CB-CG2 4.23Å; I901-I908 WeakPolarHBondContact O-CB 3.38Å; V903-I908 HydrophobicContact CB-CD1 3.75Å; V903-I908 HydrophobicContact CG2-CD1 3.72Å; H906-I908 PolarHBondContact O-N 3.28Å; H906-I908 VanDerWaalsContact O-N 3.09Å; I908-S910 WeakPolarHBondContact CG2-O 3.38Å; I908-I911 HydrophobicContact CG2-CG1 4.19Å
909	T	49.1	Very low	59.8	Low	50 Å²	50	52 Å²	52	31%	0.307	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	-27.6	-179	53.9	0	0	0	0	112.1	I876 E878	I876-T909 PolarHBondContact O-N 3.38Å; I876-T909 PolarHBondContact O-OG1 3.14Å; I876-T909 VanDerWaalsContact O-OG1 3.09Å; E878-T909 HydrophobicContact CB-CG2 3.8Å; E878-T909 HydrophobicContact CG-CG2 3.54Å
910	S	63.5	Low	62.4	Low	48 Å²	48	49.2 Å²	49.2	34%	0.336	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.6	151.7	176.6	53.6	0	0	0	0	112.2	I876 I908	I876-S910 PolarHBondContact N-O 3.21Å; I908-S910 WeakPolarHBondContact CG2-O 3.38Å
911	I	73.6	Confident	65.1	Low	6 Å²	6	49 Å²	49	3%	0.031	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	128.6	170.2	-61	178.7	0	0	0	107.3	L821 L830 I873 I901 I908	L821-I911 HydrophobicContact CD2-CG2 3.69Å; L830-I911 HydrophobicContact CD1-CB 4.42Å; L830-I911 HydrophobicContact CD1-CD1 4.38Å; I873-I911 HydrophobicContact CG2-CG2 3.33Å; I901-I911 HydrophobicContact CD1-CD1 3.72Å; I901-I911 HydrophobicContact CD1-CG1 4.47Å; I908-I911 HydrophobicContact CG2-CG1 4.19Å
912	N	81.7	Confident	67.5	Low	70 Å²	70	51.4 Å²	51.4	37%	0.374	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	149.5	-176.9	-150.3	-11.3	0	0	0	111.8	S831 K874 I876	S831-N912 WeakPolarHBondContact CB-OD1 3.39Å; S831-N912 PolarHBondContact OG-OD1 3.41Å; K874-N912 PolarHBondContact N-O 2.9Å; K874-N912 PolarHBondContact O-N 3.41Å; I876-N912 HydrophobicContact CD1-CB 4.02Å
913	L	86.6	Confident	69.7	Low	13 Å²	13	50.1 Å²	50.1	7%	0.068	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	137	172.7	-65.2	173.7	0	0	0	110	V819 L821 S831 I833 F858 Q872 I873	V819-L913 HydrophobicContact CB-CD1 4.39Å; V819-L913 HydrophobicContact CG1-CD1 4.08Å; L821-L913 HydrophobicContact CB-CD1 4.33Å; L821-L913 HydrophobicContact CB-CG 4.48Å; L821-L913 HydrophobicContact CD2-CD2 4.27Å; S831-L913 PolarHBondContact OG-N 3.35Å; I833-L913 HydrophobicContact CB-CB 4.29Å; I833-L913 HydrophobicContact CB-CD1 4.39Å; I833-L913 HydrophobicContact CG2-CB 4.1Å; I833-L913 HydrophobicContact CG2-CD1 3.77Å; F858-L913 HydrophobicContact CD2-CD2 4.04Å; F858-L913 HydrophobicContact CE2-CD2 4.07Å; Q872-L913 CarbonylContact O-C 3.1Å; I873-L913 HydrophobicContact CG1-CD2 4.26Å
914	S	87.3	Confident	71.9	Confident	4 Å²	4	53.2 Å²	53.2	3%	0.028	32%	0.315	C	S	.	.	P	Polyproline II helix	trans	-69.3	163.5	171.8	80.4	0	0	0	0	111.4	I833 Q872	I833-S914 WeakPolarHBondContact CD1-O 3.28Å; Q872-S914 PolarHBondContact N-OG 3.49Å; Q872-S914 PolarHBondContact O-N 2.8Å
915	S	88	Confident	74.2	Confident	62 Å²	62	46.5 Å²	46.5	43%	0.434	28%	0.279	S	S	.	.	P	Polyproline II helix	trans	-50.2	151	164.9	56.6	0	0	0	0	111.9	D841	D841-S915 VanDerWaalsContact OD1-CB 3.27Å; D841-S915 WeakPolarHBondContact OD1-CB 3.49Å
916	L	91.4	Very high	76.6	Confident	7 Å²	7	46.2 Å²	46.2	4%	0.037	27%	0.265	C	S	.	.	P	Polyproline II helix	trans	-76.5	133.9	-178.8	-74.9	155	0	0	0	109.7	I833 N840 D841 I843 I860 Q869 S870 C871	I833-L916 HydrophobicContact CD1-CD1 4.24Å; I833-L916 HydrophobicContact CD1-CG 3.85Å; I833-L916 HydrophobicContact CG1-CD1 4Å; I833-L916 HydrophobicContact CG1-CG 4.1Å; I833-L916 HydrophobicContact CG2-CD2 4.48Å; I833-L916 HydrophobicContact CG2-CG 4.43Å; N840-L916 WeakPolarHBondContact O-CB 3.13Å; D841-L916 WeakPolarHBondContact O-CD1 3.42Å; D841-L916 PolarHBondContact OD1-N 3.23Å; I843-L916 HydrophobicContact CD1-CD1 3.62Å; I843-L916 HydrophobicContact CD1-CD2 3.82Å; I843-L916 HydrophobicContact CD1-CG 4.36Å; I843-L916 HydrophobicContact CG1-CD1 3.41Å; I843-L916 VanDerWaalsContact CG1-CD1 3.41Å; I843-L916 HydrophobicContact CG1-CD2 4.34Å; I860-L916 HydrophobicContact CD1-CD2 4.18Å; Q869-L916 HydrophobicContact CB-CD2 3.99Å; S870-L916 CarbonylContact O-C 3.47Å; S870-L916 WeakPolarHBondContact O-CA 3.46Å; C871-L916 HydrophobicContact CB-CD2 4.05Å
917	K	90.7	Very high	79.2	Confident	89 Å²	89	40.1 Å²	40.1	39%	0.387	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	131.7	178	-64.6	178.5	-176.9	171.9	0	110.1	Q869 S870 I919	Q869-K917 CarbonylContact C-O 3.57Å; Q869-K917 VanDerWaalsContact CA-O 3.29Å; Q869-K917 WeakPolarHBondContact CA-O 3.47Å; S870-K917 PolarHBondContact N-O 3.12Å; S870-K917 PolarHBondContact O-N 3.25Å; S870-K917 PolarHBondContact OG-O 3.23Å; K917-I919 PolarHBondContact O-N 2.94Å
918	L	90.6	Very high	81.6	Confident	51 Å²	51	43.5 Å²	43.5	27%	0.267	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	129.1	176.2	-168.1	67.2	0	0	0	110.9	R867 E921	R867-L918 HydrophobicContact CB-CD1 3.79Å; R867-L918 HydrophobicContact CG-CD1 4.16Å; L918-E921 HydrophobicContact CD1-CB 4.29Å; L918-E921 HydrophobicContact CD2-CB 4.43Å; L918-E921 HydrophobicContact CD2-CG 4.17Å
919	I	91.2	Very high	83.7	Confident	4 Å²	4	45.8 Å²	45.8	2%	0.021	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	-50.9	175.8	-63.7	-57.5	0	0	0	110.5	Q622 V623 M855 L859 I868 S870 K917 I942	Q622-I919 HydrophobicContact CB-CD1 4.41Å; V623-I919 HydrophobicContact CG1-CG2 3.75Å; V623-I919 HydrophobicContact CG2-CG2 4.22Å; M855-I919 HydrophobicContact CE-CD1 3.74Å; L859-I919 HydrophobicContact CD2-CG1 4.07Å; I868-I919 HydrophobicContact CB-CB 4.33Å; I868-I919 HydrophobicContact CG2-CB 4.08Å; I868-I919 HydrophobicContact CG2-CG2 4.35Å; I868-I919 WeakPolarHBondContact O-CB 3.48Å; I868-I919 PolarHBondContact O-N 3.25Å; S870-I919 WeakPolarHBondContact OG-CD1 3.3Å; K917-I919 PolarHBondContact O-N 2.94Å; I919-I942 HydrophobicContact CG2-CD1 4.28Å
920	A	91	Very high	85.9	Confident	1 Å²	1	43.4 Å²	43.4	1%	0.008	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	152.7	179.7	0	0	0	0	0	110.1	V623 R867 I868 H925 I927 L954	V623-A920 HydrophobicContact CG2-CB 4.22Å; R867-A920 CarbonylContact C-O 3.5Å; R867-A920 VanDerWaalsContact CA-O 3.25Å; R867-A920 WeakPolarHBondContact CA-O 3.32Å; R867-A920 VanDerWaalsContact CB-O 3.3Å; R867-A920 WeakPolarHBondContact CB-O 3.31Å; I868-A920 HydrophobicContact CB-CB 4.39Å; I868-A920 HydrophobicContact CD1-CB 4.24Å; I868-A920 PolarHBondContact N-O 2.99Å; I868-A920 PolarHBondContact O-N 3.38Å; A920-H925 HydrophobicContact CB-CB 4.07Å; A920-I927 HydrophobicContact CB-CG1 3.95Å; A920-L954 HydrophobicContact CB-CD1 4Å
921	E	90.7	Very high	87.4	Confident	65 Å²	65	41.1 Å²	41.1	30%	0.304	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	165.7	178.4	59.7	176.1	163.6	0	0	110.6	R867 L918 G923 T924 H925 S926	R867-E921 HydrophobicContact CB-CB 3.99Å; L918-E921 HydrophobicContact CD1-CB 4.29Å; L918-E921 HydrophobicContact CD2-CB 4.43Å; L918-E921 HydrophobicContact CD2-CG 4.17Å; E921-G923 PolarHBondContact O-N 3.38Å; E921-T924 HydrophobicContact CG-CG2 4.25Å; E921-T924 WeakPolarHBondContact CG-OG1 3.47Å; E921-T924 PolarHBondContact O-N 3.07Å; E921-H925 PolarHBondContact O-N 2.95Å; E921-S926 PolarHBondContact O-N 3.2Å
922	K	87.3	Confident	88.5	Confident	75 Å²	75	41 Å²	41	33%	0.326	23%	0.229	S	C	.	.	H	α-helix	trans	-47.2	-40.7	173.2	177.1	167.1	159.8	172.8	0	114.6	H866 S926 I927 W928	H866-K922 HydrophobicContact CB-CB 4.02Å; H866-K922 HydrophobicContact CB-CD 4.22Å; H866-K922 PolarHBondContact O-N 3.16Å; H866-K922 VanDerWaalsContact O-N 3.08Å; K922-S926 VanDerWaalsContact O-CA 3.3Å; K922-S926 WeakPolarHBondContact O-CA 2.89Å; K922-S926 PolarHBondContact O-N 3.07Å; K922-I927 WeakPolarHBondContact CA-O 3.22Å; K922-I927 WeakPolarHBondContact CB-O 3.46Å; K922-I927 PolarHBondContact N-O 3.1Å; K922-W928 HydrophobicContact CD-CD2 3.63Å; K922-W928 VanDerWaalsContact CD-CE2 3.43Å; K922-W928 HydrophobicContact CD-CE3 3.97Å; K922-W928 HydrophobicContact CD-CG 4.26Å; K922-W928 HydrophobicContact CD-CH2 4.2Å; K922-W928 HydrophobicContact CD-CZ2 3.77Å; K922-W928 HydrophobicContact CD-CZ3 4.24Å; K922-W928 HydrophobicContact CG-CD2 4.17Å; K922-W928 HydrophobicContact CG-CG 4.39Å; K922-W928 HydrophobicContact CG-CZ2 4.35Å
923	G	80.5	Confident	89.2	Confident	70 Å²	70	38.1 Å²	38.1	72%	0.722	21%	0.213	S	C	*	.	H	α-helix	trans	-71.3	-34.1	-176.6	0	0	0	0	0	114.5	E921	E921-G923 PolarHBondContact O-N 3.38Å
924	T	81	Confident	89.7	Confident	86 Å²	86	38.5 Å²	38.5	53%	0.528	22%	0.216	S	C	.	.	H	α-helix	trans	-105.7	-35.3	-170.4	50.7	0	0	0	0	113.4	E921	E921-T924 HydrophobicContact CG-CG2 4.25Å; E921-T924 WeakPolarHBondContact CG-OG1 3.47Å; E921-T924 PolarHBondContact O-N 3.07Å
925	H	82.6	Confident	90.1	Very high	14 Å²	14	38.7 Å²	38.7	7%	0.065	22%	0.217	C	C	.	.	H	α-helix	trans	-121.6	3.2	-175.9	-61.7	87.3	0	0	0	113.2	C621 V623 A920 E921 I927	C621-H925 PolarHBondContact SG-CE1 2.85Å; C621-H925 PolarHBondContact SG-NE2 2.82Å; V623-H925 WeakPolarHBondContact CG2-NE2 3.3Å; V623-H925 PolarHBondContact O-NE2 2.91Å; A920-H925 HydrophobicContact CB-CB 4.07Å; E921-H925 PolarHBondContact O-N 2.95Å; H925-I927 HydrophobicContact CB-CG1 3.89Å; H925-I927 PolarHBondContact O-N 3.43Å
926	S	84.7	Confident	90.4	Very high	67 Å²	67	35.9 Å²	35.9	47%	0.469	20%	0.197	S	C	.	.			trans	55.6	36.3	-174.3	-52.6	0	0	0	0	112.5	E921 K922 K952	E921-S926 PolarHBondContact O-N 3.2Å; K922-S926 VanDerWaalsContact O-CA 3.3Å; K922-S926 WeakPolarHBondContact O-CA 2.89Å; K922-S926 PolarHBondContact O-N 3.07Å; S926-K952 VanDerWaalsContact O-CE 3.25Å; S926-K952 WeakPolarHBondContact O-CE 3.42Å; S926-K952 PolarHBondContact O-NZ 2.88Å
927	I	86.8	Confident	90.4	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	21%	0.212	C	C	.	.			trans	-79.4	116.6	173.9	-64.7	-76.5	0	0	0	109.1	I868 A920 K922 H925 P930 E946 K952 L954	I868-I927 HydrophobicContact CD1-CD1 4.16Å; I868-I927 HydrophobicContact CD1-CG1 4.42Å; I868-I927 HydrophobicContact CD1-CG2 4.39Å; I868-I927 HydrophobicContact CG1-CG2 4.3Å; A920-I927 HydrophobicContact CB-CG1 3.95Å; K922-I927 WeakPolarHBondContact CA-O 3.22Å; K922-I927 WeakPolarHBondContact CB-O 3.46Å; K922-I927 PolarHBondContact N-O 3.1Å; H925-I927 HydrophobicContact CB-CG1 3.89Å; H925-I927 PolarHBondContact O-N 3.43Å; I927-P930 HydrophobicContact CG2-CB 3.98Å; I927-P930 HydrophobicContact CG2-CG 4.01Å; I927-E946 WeakPolarHBondContact CA-OE1 3.43Å; I927-K952 HydrophobicContact CD1-CB 4.27Å; I927-K952 HydrophobicContact CD1-CD 3.59Å; I927-L954 HydrophobicContact CD1-CD1 4.1Å
928	W	88.9	Confident	90.4	Very high	117 Å²	117	40.4 Å²	40.4	44%	0.443	22%	0.223	S	C	.	.			trans	-121.2	129.4	179.8	-82.6	85.4	0	0	0	110.7	K922 E946	K922-W928 HydrophobicContact CD-CD2 3.63Å; K922-W928 VanDerWaalsContact CD-CE2 3.43Å; K922-W928 HydrophobicContact CD-CE3 3.97Å; K922-W928 HydrophobicContact CD-CG 4.26Å; K922-W928 HydrophobicContact CD-CH2 4.2Å; K922-W928 HydrophobicContact CD-CZ2 3.77Å; K922-W928 HydrophobicContact CD-CZ3 4.24Å; K922-W928 HydrophobicContact CG-CD2 4.17Å; K922-W928 HydrophobicContact CG-CG 4.39Å; K922-W928 HydrophobicContact CG-CZ2 4.35Å; W928-E946 PolarHBondContact N-OE1 3.16Å; W928-E946 WeakPolarHBondContact O-CB 3.37Å; W928-E946 WeakPolarHBondContact O-CG 3.29Å
929	H	90.5	Very high	90.4	Very high	63 Å²	63	41.4 Å²	41.4	29%	0.292	22%	0.224	S	C	.	.	S	Bend	trans	43.3	58.6	176.7	-59.8	100.8	0	0	0	112.9	H863 H866 M931 A947	H863-H929 AromaticContact CE1-CD2 3.77Å; H863-H929 AromaticContact NE2-CD2 3.84Å; H866-H929 AromaticContact CE1-CD2 3.4Å; H866-H929 PolarHBondContact CE1-CD2 3.09Å; H866-H929 VanDerWaalsContact CE1-CD2 3.4Å; H866-H929 AromaticContact CE1-CE1 3.4Å; H866-H929 PolarHBondContact CE1-CE1 3.39Å; H866-H929 VanDerWaalsContact CE1-CE1 3.4Å; H866-H929 AromaticContact CE1-CG 3.91Å; H866-H929 AromaticContact CE1-ND1 3.9Å; H866-H929 AromaticContact CE1-NE2 3.05Å; H866-H929 PolarHBondContact CE1-NE2 3.34Å; H866-H929 AromaticContact ND1-CD2 3.61Å; H866-H929 AromaticContact ND1-CE1 3.94Å; H866-H929 AromaticContact ND1-CG 3.79Å; H866-H929 AromaticContact ND1-ND1 3.98Å; H866-H929 AromaticContact ND1-NE2 3.72Å; H929-M931 PolarHBondContact O-N 3.17Å; H929-A947 HydrophobicContact CB-CB 3.85Å; H929-A947 PolarHBondContact O-N 3.4Å
930	P	95.2	Very high	90.4	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.8	130.4	179.7	27.4	-34.6	0	0	0	109.3	A861 H863 R867 I868 I927 V944	A861-P930 HydrophobicContact CB-CB 3.89Å; A861-P930 HydrophobicContact CB-CG 4.22Å; H863-P930 PolarHBondContact CD2-O 2.96Å; R867-P930 WeakPolarHBondContact O-CG 3.26Å; I868-P930 HydrophobicContact CG1-CB 4.47Å; I927-P930 HydrophobicContact CG2-CB 3.98Å; I927-P930 HydrophobicContact CG2-CG 4.01Å; P930-V944 HydrophobicContact CB-CG1 3.68Å
931	M	95	Very high	90.6	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	-102.9	179.3	-65.5	-176.9	67	0	0	108.5	W641 P642 T643 Y847 G848 A861 H929 T945 A947	W641-M931 HydrophobicContact CD2-CE 4.1Å; W641-M931 HydrophobicContact CG-CE 4.29Å; W641-M931 HydrophobicContact CZ2-CE 3.98Å; W641-M931 HydrophobicContact CZ2-SD 4.39Å; P642-M931 HydrophobicContact CG-SD 4.14Å; T643-M931 HydrophobicContact CG2-CE 3.71Å; Y847-M931 CarbonylContact C-O 3.51Å; Y847-M931 CarbonylContact O-C 3.42Å; G848-M931 PolarHBondContact N-O 3.35Å; A861-M931 WeakPolarHBondContact CB-O 3.37Å; H929-M931 PolarHBondContact O-N 3.17Å; M931-T945 PolarHBondContact N-O 2.99Å; M931-A947 VanDerWaalsContact SD-CA 3.58Å; M931-A947 HydrophobicContact SD-CB 4.06Å
932	A	96.6	Very high	90.8	Very high	4 Å²	4	43.7 Å²	43.7	3%	0.033	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	146.6	179.1	0	0	0	0	0	111.3	L645 V944 T945	L645-A932 HydrophobicContact CB-CB 3.59Å; A932-V944 WeakPolarHBondContact O-CA 3.43Å; A932-T945 WeakPolarHBondContact CB-OG1 3.46Å; A932-T945 PolarHBondContact N-OG1 3.07Å; A932-T945 PolarHBondContact O-N 2.72Å; A932-T945 PolarHBondContact O-OG1 3.32Å
933	I	97.3	Very high	91.3	Very high	9 Å²	9	40.3 Å²	40.3	5%	0.046	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	137.2	179.2	-171.4	167.8	0	0	0	109.3	L859 A861 I868 I942 I943 V944	L859-I933 HydrophobicContact CB-CD1 3.73Å; L859-I933 HydrophobicContact CD1-CD1 4.44Å; A861-I933 HydrophobicContact CB-CG2 4.34Å; I868-I933 HydrophobicContact CD1-CD1 4.22Å; I868-I933 HydrophobicContact CG1-CD1 4.33Å; I868-I933 HydrophobicContact CG2-CD1 3.65Å; I933-I942 HydrophobicContact CD1-CG2 3.92Å; I933-I942 HydrophobicContact CG1-CG2 4.02Å; I933-I943 WeakPolarHBondContact CA-O 3.4Å; I933-V944 HydrophobicContact CB-CG2 4.35Å; I933-V944 HydrophobicContact CD1-CG2 3.8Å; I933-V944 HydrophobicContact CG1-CG2 3.69Å
934	T	96.7	Very high	92	Very high	21 Å²	21	37 Å²	37	13%	0.129	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	177.3	176.1	-158.1	0	0	0	0	110.9	L645 V647 I943	L645-T934 HydrophobicContact CB-CG2 4.41Å; L645-T934 HydrophobicContact CD2-CG2 3.54Å; L645-T934 HydrophobicContact CG-CG2 3.63Å; V647-T934 HydrophobicContact CG2-CG2 3.71Å; T934-I943 HydrophobicContact CG2-CB 4.24Å; T934-I943 PolarHBondContact N-O 3.22Å; T934-I943 PolarHBondContact O-N 2.66Å
935	T	95.2	Very high	92.8	Very high	8 Å²	8	32.9 Å²	32.9	5%	0.049	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	138.9	-179.9	53.4	0	0	0	0	112.9	Q649 Y851 A852 W854 L859 R941	Q649-T935 PolarHBondContact NE2-O 3.14Å; Y851-T935 PolarHBondContact O-OG1 2.94Å; A852-T935 HydrophobicContact CB-CG2 4.03Å; W854-T935 VanDerWaalsContact CH2-CB 3.43Å; W854-T935 HydrophobicContact CH2-CG2 3.42Å; W854-T935 VanDerWaalsContact CH2-CG2 3.42Å; W854-T935 HydrophobicContact CZ2-CG2 4.21Å; W854-T935 HydrophobicContact CZ3-CG2 3.95Å; L859-T935 HydrophobicContact CD1-CG2 4.14Å; T935-R941 WeakPolarHBondContact CA-O 3.47Å
936	D	95	Very high	93.4	Very high	2 Å²	2	32.5 Å²	32.5	1%	0.011	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	103.1	157.5	178.2	-21.8	0	0	0	106.7	V647 Q938 R939 K940 R941 I943	V647-D936 HydrophobicContact CG1-CB 4.18Å; D936-Q938 VanDerWaalsContact C-N 3.34Å; D936-Q938 PolarHBondContact OD1-N 3.03Å; D936-Q938 VanDerWaalsContact OD1-N 3.11Å; D936-R939 PolarHBondContact OD1-N 3.47Å; D936-R939 IonicContact OD1-NH1 3.44Å; D936-R939 VanDerWaalsContact OD2-CD 3.3Å; D936-R939 WeakPolarHBondContact OD2-CD 3.44Å; D936-R939 WeakPolarHBondContact OD2-CG 3.44Å; D936-R939 IonicContact OD2-CZ 3.51Å; D936-R939 IonicContact OD2-NE 2.57Å; D936-R939 IonicContact OD2-NH1 3.93Å; D936-R939 PolarHBondContact OD2-NH1 3Å; D936-K940 WeakPolarHBondContact O-CA 3.5Å; D936-K940 PolarHBondContact O-N 3.49Å; D936-R941 HydrophobicContact CB-CB 4.2Å; D936-R941 PolarHBondContact N-O 3.05Å; D936-R941 PolarHBondContact O-N 3.44Å; D936-I943 HydrophobicContact CB-CD1 4.45Å
937	V	91.6	Very high	93.5	Very high	60 Å²	60	30.4 Å²	30.4	36%	0.364	14%	0.142	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-36.5	-174.1	-178	0	0	0	0	111.2	P853 W854 K940	P853-V937 HydrophobicContact CG-CG1 4.49Å; P853-V937 HydrophobicContact CG-CG2 4.33Å; W854-V937 HydrophobicContact CE3-CG1 4.3Å; W854-V937 HydrophobicContact CZ3-CB 4.23Å; W854-V937 HydrophobicContact CZ3-CG1 4.43Å; W854-V937 HydrophobicContact CZ3-CG2 4.08Å; V937-K940 PolarHBondContact O-N 2.96Å
938	Q	90	Very high	93.5	Very high	132 Å²	132	35.3 Å²	35.3	62%	0.617	17%	0.167	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-42.8	-179	-66.2	-169.1	-12.8	0	0	111.4	Q649 D936	Q649-Q938 PolarHBondContact O-NE2 2.69Å; Q649-Q938 PolarHBondContact O-OE1 3.32Å; D936-Q938 VanDerWaalsContact C-N 3.34Å; D936-Q938 PolarHBondContact OD1-N 3.03Å; D936-Q938 VanDerWaalsContact OD1-N 3.11Å
939	R	91.2	Very high	93.5	Very high	72 Å²	72	29.7 Å²	29.7	27%	0.272	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.7	-1.1	-179.5	-59.6	-176.6	-177.7	74.7	-4.2	113.5	N651 H669 D936 R941	N651-R939 PolarHBondContact O-NH2 2.78Å; H669-R939 PolarHBondContact CD2-NH2 2.92Å; D936-R939 PolarHBondContact OD1-N 3.47Å; D936-R939 IonicContact OD1-NH1 3.44Å; D936-R939 VanDerWaalsContact OD2-CD 3.3Å; D936-R939 WeakPolarHBondContact OD2-CD 3.44Å; D936-R939 WeakPolarHBondContact OD2-CG 3.44Å; D936-R939 IonicContact OD2-CZ 3.51Å; D936-R939 IonicContact OD2-NE 2.57Å; D936-R939 IonicContact OD2-NH1 3.93Å; D936-R939 PolarHBondContact OD2-NH1 3Å; R939-R941 VanDerWaalsContact C-N 3.26Å; R939-R941 HydrophobicContact CB-CG 3.89Å; R939-R941 PolarHBondContact O-N 3.5Å
940	K	91.7	Very high	93.7	Very high	82 Å²	82	29.1 Å²	29.1	36%	0.357	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.4	43.6	-174.7	-60.7	177.8	178.7	175.4	0	112.4	W854 D936 V937 S956 A959	W854-K940 HydrophobicContact CD2-CB 4.26Å; W854-K940 HydrophobicContact CD2-CG 4.19Å; W854-K940 HydrophobicContact CG-CD 4.48Å; W854-K940 HydrophobicContact CG-CG 4.19Å; W854-K940 HydrophobicContact CZ2-CB 4.31Å; D936-K940 WeakPolarHBondContact O-CA 3.5Å; D936-K940 PolarHBondContact O-N 3.49Å; V937-K940 PolarHBondContact O-N 2.96Å; K940-S956 PolarHBondContact O-N 3.27Å; K940-A959 HydrophobicContact CB-CB 3.91Å; K940-A959 HydrophobicContact CD-CB 3.58Å; K940-A959 HydrophobicContact CG-CB 4.41Å
941	R	94.4	Very high	93.7	Very high	36 Å²	36	29.1 Å²	29.1	14%	0.136	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	143.7	179.4	-62.8	167.7	171.2	174.9	0.6	110.7	E626 H669 T935 D936 R939 V953 L954	E626-R941 VanDerWaalsContact CD-NE 3.28Å; E626-R941 IonicContact OE1-CZ 3.91Å; E626-R941 VanDerWaalsContact OE1-CZ 3.26Å; E626-R941 IonicContact OE1-NE 2.76Å; E626-R941 PolarHBondContact OE1-NE 2.69Å; E626-R941 IonicContact OE1-NH2 2.86Å; E626-R941 PolarHBondContact OE1-NH2 3.38Å; E626-R941 WeakPolarHBondContact OE2-CD 3.26Å; E626-R941 WeakPolarHBondContact OE2-CG 3.5Å; E626-R941 IonicContact OE2-CZ 2.51Å; E626-R941 IonicContact OE2-NE 2.88Å; E626-R941 PolarHBondContact OE2-NE 2.81Å; E626-R941 IonicContact OE2-NH2 3.02Å; H669-R941 PolarHBondContact O-NH1 3.27Å; T935-R941 WeakPolarHBondContact CA-O 3.47Å; D936-R941 HydrophobicContact CB-CB 4.2Å; D936-R941 PolarHBondContact N-O 3.05Å; D936-R941 PolarHBondContact O-N 3.44Å; R939-R941 VanDerWaalsContact C-N 3.26Å; R939-R941 HydrophobicContact CB-CG 3.89Å; R939-R941 PolarHBondContact O-N 3.5Å; R941-V953 HydrophobicContact CB-CG1 3.98Å; R941-V953 HydrophobicContact CG-CG1 4.05Å; R941-L954 CarbonylContact C-O 3.57Å; R941-L954 WeakPolarHBondContact CA-O 3.32Å
942	I	95.3	Very high	93.7	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	125.5	169.3	-58.5	168.1	0	0	0	106.4	V623 W854 M855 L859 I919 I933 V944 L954	V623-I942 HydrophobicContact CG1-CD1 3.97Å; W854-I942 HydrophobicContact CZ2-CG1 4.26Å; M855-I942 HydrophobicContact SD-CD1 4.22Å; L859-I942 HydrophobicContact CD1-CB 4.37Å; L859-I942 HydrophobicContact CD1-CD1 3.58Å; L859-I942 HydrophobicContact CD1-CG1 3.61Å; L859-I942 HydrophobicContact CD1-CG2 3.88Å; L859-I942 HydrophobicContact CD2-CD1 4.43Å; I919-I942 HydrophobicContact CG2-CD1 4.28Å; I933-I942 HydrophobicContact CD1-CG2 3.92Å; I933-I942 HydrophobicContact CG1-CG2 4.02Å; I942-V944 HydrophobicContact CG2-CG2 3.9Å; I942-L954 HydrophobicContact CB-CB 4.31Å; I942-L954 PolarHBondContact N-O 3.34Å; I942-L954 PolarHBondContact O-N 2.98Å
943	I	96.7	Very high	93.7	Very high	3 Å²	3	29.2 Å²	29.2	2%	0.015	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	130	-180	-53.7	163.4	0	0	0	107.5	L645 V647 I654 I933 T934 D936 V951 K952 V953	L645-I943 HydrophobicContact CD1-CG2 4.46Å; L645-I943 HydrophobicContact CD2-CB 3.96Å; L645-I943 HydrophobicContact CD2-CG2 3.71Å; L645-I943 WeakPolarHBondContact CD2-O 3.36Å; V647-I943 HydrophobicContact CG2-CD1 3.44Å; V647-I943 VanDerWaalsContact CG2-CD1 3.44Å; I654-I943 HydrophobicContact CD1-CD1 3.89Å; I654-I943 HydrophobicContact CD1-CG2 4.41Å; I654-I943 HydrophobicContact CG1-CD1 4.02Å; I654-I943 HydrophobicContact CG2-CG2 4.41Å; I933-I943 WeakPolarHBondContact CA-O 3.4Å; T934-I943 HydrophobicContact CG2-CB 4.24Å; T934-I943 PolarHBondContact N-O 3.22Å; T934-I943 PolarHBondContact O-N 2.66Å; D936-I943 HydrophobicContact CB-CD1 4.45Å; I943-V951 HydrophobicContact CG2-CG1 3.64Å; I943-K952 WeakPolarHBondContact CA-O 3.27Å; I943-V953 HydrophobicContact CG1-CG1 4.22Å; I943-V953 HydrophobicContact CG1-CG2 4.24Å; I943-V953 HydrophobicContact CG2-CG2 4.32Å
944	V	97	Very high	93.5	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	133.6	-173.6	-175	0	0	0	0	108.3	I868 P930 A932 I933 I942 V951 K952	I868-V944 HydrophobicContact CD1-CB 4.23Å; I868-V944 HydrophobicContact CD1-CG1 4.18Å; I868-V944 HydrophobicContact CD1-CG2 3.3Å; I868-V944 HydrophobicContact CG1-CG2 4.39Å; P930-V944 HydrophobicContact CB-CG1 3.68Å; A932-V944 WeakPolarHBondContact O-CA 3.43Å; I933-V944 HydrophobicContact CB-CG2 4.35Å; I933-V944 HydrophobicContact CD1-CG2 3.8Å; I933-V944 HydrophobicContact CG1-CG2 3.69Å; I942-V944 HydrophobicContact CG2-CG2 3.9Å; V944-V951 WeakPolarHBondContact O-CA 3.49Å; V944-K952 PolarHBondContact N-O 3.16Å; V944-K952 PolarHBondContact O-N 3.14Å
945	T	97	Very high	93.1	Very high	0 Å²	0	31 Å²	31	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	145.6	168.7	65.1	0	0	0	0	110.1	P642 L645 V656 M931 A932 N950 V951	P642-T945 HydrophobicContact CB-CG2 3.92Å; P642-T945 HydrophobicContact CG-CG2 4.45Å; P642-T945 PolarHBondContact O-OG1 3.06Å; L645-T945 HydrophobicContact CB-CG2 4.32Å; L645-T945 HydrophobicContact CD1-CG2 3.75Å; L645-T945 HydrophobicContact CD2-CG2 4.08Å; L645-T945 HydrophobicContact CG-CG2 4.27Å; V656-T945 HydrophobicContact CG1-CG2 4.34Å; M931-T945 PolarHBondContact N-O 2.99Å; A932-T945 WeakPolarHBondContact CB-OG1 3.46Å; A932-T945 PolarHBondContact N-OG1 3.07Å; A932-T945 PolarHBondContact O-N 2.72Å; A932-T945 PolarHBondContact O-OG1 3.32Å; T945-N950 WeakPolarHBondContact CA-O 3.49Å; T945-V951 HydrophobicContact CG2-CG2 4.19Å
946	E	94.4	Very high	92.3	Very high	7 Å²	7	30.6 Å²	30.6	3%	0.033	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	155.6	174.5	-58.4	-171.7	141.7	0	0	109.8	P642 I927 W928 L948 G949 N950 K952	P642-E946 WeakPolarHBondContact CG-O 3.38Å; I927-E946 WeakPolarHBondContact CA-OE1 3.43Å; W928-E946 PolarHBondContact N-OE1 3.16Å; W928-E946 WeakPolarHBondContact O-CB 3.37Å; W928-E946 WeakPolarHBondContact O-CG 3.29Å; E946-L948 PolarHBondContact O-N 3.1Å; E946-G949 PolarHBondContact O-N 3.3Å; E946-G949 VanDerWaalsContact O-N 3.15Å; E946-N950 HydrophobicContact CB-CB 4.18Å; E946-N950 HydrophobicContact CG-CB 4.5Å; E946-N950 PolarHBondContact N-O 3.42Å; E946-K952 WeakPolarHBondContact OE1-CE 3.24Å; E946-K952 WeakPolarHBondContact OE2-CE 3.43Å
947	A	87.3	Confident	90.8	Very high	22 Å²	22	34.4 Å²	34.4	18%	0.182	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50.8	140.4	169.3	0	0	0	0	0	110.7	W641 H929 M931 G949	W641-A947 HydrophobicContact CH2-CB 4.36Å; W641-A947 HydrophobicContact CZ3-CB 4.24Å; H929-A947 HydrophobicContact CB-CB 3.85Å; H929-A947 PolarHBondContact O-N 3.4Å; M931-A947 VanDerWaalsContact SD-CA 3.58Å; M931-A947 HydrophobicContact SD-CB 4.06Å; A947-G949 VanDerWaalsContact C-N 3.32Å
948	L	86.8	Confident	89.2	Confident	103 Å²	103	38.1 Å²	38.1	54%	0.539	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	74.2	8.7	-177	-46.8	173.3	0	0	0	116.2	V640 E946	V640-L948 CarbonylContact O-C 3.57Å; V640-L948 WeakPolarHBondContact O-CA 3.26Å; E946-L948 PolarHBondContact O-N 3.1Å
949	G	88.7	Confident	86.7	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	16%	0.163	C	C	.	.	S	Bend	trans	103.5	1.7	160.8	0	0	0	0	0	117	A631 E946 A947	A631-G949 VanDerWaalsContact CB-O 3.22Å; A631-G949 WeakPolarHBondContact CB-O 3.38Å; A631-G949 PolarHBondContact N-O 3.11Å; E946-G949 PolarHBondContact O-N 3.3Å; E946-G949 VanDerWaalsContact O-N 3.15Å; A947-G949 VanDerWaalsContact C-N 3.32Å
950	N	94.1	Very high	83.9	Confident	51 Å²	51	37.2 Å²	37.2	27%	0.273	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	142.1	171.5	-68.1	-19	0	0	0	110.5	T945 E946	T945-N950 WeakPolarHBondContact CA-O 3.49Å; E946-N950 HydrophobicContact CB-CB 4.18Å; E946-N950 HydrophobicContact CG-CB 4.5Å; E946-N950 PolarHBondContact N-O 3.42Å
951	V	96.3	Very high	83.5	Confident	0 Å²	0	35 Å²	35	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	123.6	174.2	-173.7	0	0	0	0	108.5	E628 F629 A631 V656 I943 V944 T945	E628-V951 WeakPolarHBondContact CA-O 3.39Å; F629-V951 HydrophobicContact CD1-CB 4.19Å; F629-V951 HydrophobicContact CD1-CG1 4.48Å; F629-V951 HydrophobicContact CD2-CB 4.23Å; F629-V951 HydrophobicContact CD2-CG2 4.44Å; F629-V951 HydrophobicContact CE1-CB 3.78Å; F629-V951 HydrophobicContact CE1-CG1 3.67Å; F629-V951 HydrophobicContact CE2-CB 3.81Å; F629-V951 HydrophobicContact CE2-CG1 4.27Å; F629-V951 HydrophobicContact CE2-CG2 3.86Å; F629-V951 HydrophobicContact CG-CB 4.41Å; F629-V951 HydrophobicContact CZ-CB 3.58Å; F629-V951 HydrophobicContact CZ-CG1 3.54Å; F629-V951 HydrophobicContact CZ-CG2 3.99Å; F629-V951 PolarHBondContact N-O 3.39Å; F629-V951 PolarHBondContact O-N 3.06Å; A631-V951 HydrophobicContact CB-CG2 4.04Å; V656-V951 HydrophobicContact CG2-CG2 4.42Å; I943-V951 HydrophobicContact CG2-CG1 3.64Å; V944-V951 WeakPolarHBondContact O-CA 3.49Å; T945-V951 HydrophobicContact CG2-CG2 4.19Å
952	K	95.4	Very high	82.9	Confident	4 Å²	4	34.9 Å²	34.9	2%	0.017	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	133.3	178.3	-68.9	-180	-171.5	-110	0	110.4	E628 S926 I927 I943 V944 E946	E628-K952 HydrophobicContact CB-CG 4.39Å; E628-K952 HydrophobicContact CG-CG 3.93Å; E628-K952 VanDerWaalsContact OE1-CE 3.3Å; E628-K952 WeakPolarHBondContact OE1-CE 3.47Å; E628-K952 IonicContact OE1-NZ 3.55Å; E628-K952 PolarHBondContact OE1-NZ 3.38Å; E628-K952 WeakPolarHBondContact OE2-CE 3.44Å; E628-K952 IonicContact OE2-NZ 2.62Å; E628-K952 PolarHBondContact OE2-NZ 3.09Å; S926-K952 VanDerWaalsContact O-CE 3.25Å; S926-K952 WeakPolarHBondContact O-CE 3.42Å; S926-K952 PolarHBondContact O-NZ 2.88Å; I927-K952 HydrophobicContact CD1-CB 4.27Å; I927-K952 HydrophobicContact CD1-CD 3.59Å; I943-K952 WeakPolarHBondContact CA-O 3.27Å; V944-K952 PolarHBondContact N-O 3.16Å; V944-K952 PolarHBondContact O-N 3.14Å; E946-K952 WeakPolarHBondContact OE1-CE 3.24Å; E946-K952 WeakPolarHBondContact OE2-CE 3.43Å
953	V	95.4	Very high	82.2	Confident	1 Å²	1	36.9 Å²	36.9	1%	0.006	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	111.8	175.6	-175.5	0	0	0	0	107.6	N625 E626 L627 F629 R941 I943	N625-V953 PolarHBondContact OD1-O 3.39Å; E626-V953 PolarHBondContact N-O 3.46Å; L627-V953 HydrophobicContact CB-CB 4.01Å; L627-V953 HydrophobicContact CB-CG2 4.16Å; L627-V953 HydrophobicContact CD2-CG2 4.1Å; L627-V953 HydrophobicContact CG-CG2 4.37Å; L627-V953 PolarHBondContact N-O 3.34Å; L627-V953 PolarHBondContact O-N 2.92Å; F629-V953 HydrophobicContact CE1-CG2 4.29Å; R941-V953 HydrophobicContact CB-CG1 3.98Å; R941-V953 HydrophobicContact CG-CG1 4.05Å; I943-V953 HydrophobicContact CG1-CG1 4.22Å; I943-V953 HydrophobicContact CG1-CG2 4.24Å; I943-V953 HydrophobicContact CG2-CG2 4.32Å
954	L	93.8	Very high	81.4	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	129.4	-179.2	-51.4	177.2	0	0	0	109.3	V623 T624 N625 I868 A920 I927 R941 I942	V623-L954 HydrophobicContact CB-CB 4.16Å; V623-L954 HydrophobicContact CG2-CB 4.15Å; V623-L954 HydrophobicContact CG2-CD1 4.04Å; T624-L954 CarbonylContact O-C 3.54Å; T624-L954 VanDerWaalsContact O-CA 3.28Å; T624-L954 WeakPolarHBondContact O-CA 3.34Å; N625-L954 HydrophobicContact CB-CD2 4.22Å; I868-L954 HydrophobicContact CD1-CD1 3.99Å; A920-L954 HydrophobicContact CB-CD1 4Å; I927-L954 HydrophobicContact CD1-CD1 4.1Å; R941-L954 CarbonylContact C-O 3.57Å; R941-L954 WeakPolarHBondContact CA-O 3.32Å; I942-L954 HydrophobicContact CB-CB 4.31Å; I942-L954 PolarHBondContact N-O 3.34Å; I942-L954 PolarHBondContact O-N 2.98Å
955	K	88.6	Confident	80.4	Confident	67 Å²	67	41.3 Å²	41.3	29%	0.291	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	131.3	174.9	-169.4	171.1	-177.8	177.8	0	109.8	V623 T624 E626	V623-K955 CarbonylContact C-O 3.47Å; V623-K955 WeakPolarHBondContact CA-O 3.06Å; V623-K955 WeakPolarHBondContact CB-O 3.28Å; T624-K955 PolarHBondContact N-O 2.84Å; T624-K955 PolarHBondContact O-N 3.05Å; E626-K955 HydrophobicContact CB-CB 4.21Å
956	S	77.9	Confident	79.3	Confident	1 Å²	1	44.1 Å²	44.1	1%	0.007	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	132.7	174.9	-177.2	0	0	0	0	111	K940 E958 A959	K940-S956 PolarHBondContact O-N 3.27Å; S956-E958 PolarHBondContact O-N 3.31Å; S956-E958 PolarHBondContact OG-N 3.31Å; S956-A959 VanDerWaalsContact O-CB 3.29Å; S956-A959 WeakPolarHBondContact O-CB 3.4Å; S956-A959 PolarHBondContact O-N 3.47Å
957	M	64.5	Low	78.2	Confident	82 Å²	82	46.7 Å²	46.7	40%	0.404	24%	0.243	S	C	.	.	G	3₁₀ helix	trans	-68.3	-17.5	174.7	-71.2	-127.6	-145.8	0	0	112.7	C621 Q622 T624 A959 I960	C621-M957 HydrophobicContact CB-CE 4.17Å; C621-M957 VanDerWaalsContact O-CE 3.26Å; C621-M957 WeakPolarHBondContact O-CE 3.39Å; Q622-M957 WeakPolarHBondContact O-CB 3.35Å; Q622-M957 PolarHBondContact O-N 3.48Å; T624-M957 HydrophobicContact CG2-CE 3.78Å; T624-M957 HydrophobicContact CG2-CG 4.18Å; T624-M957 HydrophobicContact CG2-SD 4.2Å; M957-A959 PolarHBondContact O-N 3.42Å; M957-I960 PolarHBondContact O-N 2.82Å
958	E	57.5	Low	77.5	Confident	138 Å²	138	48.6 Å²	48.6	65%	0.645	25%	0.248	S	C	*	.	G	3₁₀ helix	trans	-70.8	-8.4	170.3	-68.7	-177.1	165	0	0	112.4	S956	S956-E958 PolarHBondContact O-N 3.31Å; S956-E958 PolarHBondContact OG-N 3.31Å
959	A	37.7	Very low	76.7	Confident	29 Å²	29	44.1 Å²	44.1	24%	0.24	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	-99.3	3.8	174.4	0	0	0	0	0	113.7	K940 S956 M957	K940-A959 HydrophobicContact CB-CB 3.91Å; K940-A959 HydrophobicContact CD-CB 3.58Å; K940-A959 HydrophobicContact CG-CB 4.41Å; S956-A959 VanDerWaalsContact O-CB 3.29Å; S956-A959 WeakPolarHBondContact O-CB 3.4Å; S956-A959 PolarHBondContact O-N 3.47Å; M957-A959 PolarHBondContact O-N 3.42Å
960	I	30.9	Very low	75.6	Confident	156 Å²	156	48.1 Å²	48.1	80%	0.8	24%	0.244	S	C	*	.			trans	-116.1	0	173.5	-54	175.3	0	0	0	107.4	M957	M957-I960 PolarHBondContact O-N 2.82Å

Retrieved 960 of 960 residues in 166.4 ms (Link to these results)

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