A0A087XVS1_POEFO Loading...

Phospholipid-transporting ATPase

AlphaFold DB , UniProt , Accession A0A087XVS1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,086 aa.

						>A0A087XVS1_POEFO|A0A087XVS1
MSRRRAHTPAPNDEEMPYSDDETDDELDEDLDEESESDADEPQDADRPAEAAARGPEIGWKVKANDREYHQLPEFKKKVFLCFKKSRYSGNAIKTYKYNVITFLPLNLYEQFKRVANIYFLALLILQIIPDISTLPWYTTLFPLVIVLGITAIKDLVDDLARHRMDKEVNNRKCEVLLDGRFKESKWMDVQVGDVVRMKKNDFIPADILLLSSSEPNSLCYVETAELDGETNLKFKMGLRVTDQRLQEERHLAQFNALIECEEPNNRLDKFTGTMLWDGERYPLELDNMLLRGCKIRNTDFCHGLVIFAGADTKIMRNGGKTRFKRTKIDELMNYMVYTIFALLILVSAGLAIGHSFWYQDIGTTSWYLNDGKDQTVAYRGFLSFWGYIIVLNTMVPISLYVSVEVIRLGQSKFINWDLQMYYSEKDTPAKARTTTLNEQLGQIQYIFSDKTGTLTQNIMQFKKCTIAGRSYGGPTTSEGASLDKIKPVDWTWNRHADRKFQFVDHFLVANIKSKKDKDALEFFKLLSLCHTVMVESNEGGELVYQAASPDEGALVTAARNFGFVFLSRTQDTITISEMGQEATYEMLALLDFNSDRKRMSIILKFPDGRIRLYCKGADTVIYERLSPNTQHKETTQTALDIFANETLRTLCLCYKDISASEFEAWSRRHKEAQLNMVDREAALDRVYEDIEKNLMLIGATAIEDKLQDGVPETIANLAKAGIKIWVLTGDKKETAENIGFSCQLLTDKMQIHYGEDVNGKLLARQAARRNEAPSHRLGKKKPDEPFFPGTINNALIITGGWLNEILYEKKKKRRRLRLRRLGRRQTPSNPQDPMDDQEKEMRQVDFVNMACECEAVICCRVTPKQKANVVSLVKKYKKAVTLSIGDGANDVNMIKTADIGVGISGQEGMQAVMSSDYAFAQFSYLQRLLLVHGRWSYIRMCKFLRFFFFKNFAFTLVHFWYSFFNGYSSQTAYEDWFITLYNLAYSSLPVLLVGLLDQDVNDELSLKVPTLYLPGQQGSLFNYKNFFISLFHGIFVSLIIFFIPYGAFLQTMGQDGEAPSDYQSFAVVTASSLVFIVNLQVRTGK
					

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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	29.3	Very low	28	Very low	247 Å²	247	168.5 Å²	168.5	100%	1.217	87%	0.873	S	S	*	*				0	102.6	0	-83.6	175.6	160	0	0	108.3
2	S	27	Very low	28.2	Very low	114 Å²	114	164.9 Å²	164.9	80%	0.797	86%	0.856	S	S	*	*				102.5	85	110.6	-167.4	0	0	0	0	110.1
3	R	27.1	Very low	28.3	Very low	243 Å²	243	165.2 Å²	165.2	92%	0.917	86%	0.859	S	S	*	*				100.8	96.7	89.1	-98.9	-173	176.4	178	-0.2	111
4	R	27.8	Very low	28.4	Very low	251 Å²	251	164.3 Å²	164.3	95%	0.947	85%	0.849	S	S	*	*			trans	-67	137.9	159.8	-74.4	176.4	172.4	177.2	-3.7	109.1
5	R	27.4	Very low	28.7	Very low	248 Å²	248	163.7 Å²	163.7	94%	0.936	84%	0.841	S	S	*	*			trans	-111.4	130.9	164.2	-101.7	-176.1	175.3	177	-1.6	109.3
6	A	26.4	Very low	28.5	Very low	98 Å²	98	163.4 Å²	163.4	81%	0.81	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-75.5	143.6	-176	0	0	0	0	0	111.9
7	H	26.3	Very low	28.4	Very low	194 Å²	194	160.6 Å²	160.6	90%	0.898	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-79.3	125.3	161.8	-89.3	-79.4	0	0	0	109
8	T	26.3	Very low	28.3	Very low	132 Å²	132	162.6 Å²	162.6	81%	0.81	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-74.7	140.1	168.9	5.4	0	0	0	0	110.1
9	P	31.4	Very low	28.1	Very low	123 Å²	123	159.3 Å²	159.3	80%	0.799	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-79.3	154.1	170.4	26.8	-21	0	0	0	111.6
10	A	30.3	Very low	28	Very low	84 Å²	84	157.2 Å²	157.2	69%	0.694	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-58.2	155.9	176.1	0	0	0	0	0	112.5
11	P	29.1	Very low	28	Very low	120 Å²	120	156.6 Å²	156.6	78%	0.779	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-74.7	130.4	174.3	30.5	-30.3	0	0	0	110.4
12	N	30.5	Very low	27.7	Very low	125 Å²	125	152.4 Å²	152.4	67%	0.668	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-69.1	130.1	166.2	-81.7	1.6	0	0	0	109.3	E14	N12-E14 HydrophobicContact CB-CB 4.41Å; N12-E14 HydrophobicContact CB-CG 4.3Å; N12-E14 PolarHBondContact ND2-OE2 3.38Å; N12-E14 VanDerWaalsContact ND2-OE2 3.11Å; N12-E14 PolarHBondContact O-N 3.09Å
13	D	28.6	Very low	28	Very low	168 Å²	168	152.6 Å²	152.6	90%	0.898	78%	0.784	S	S	*	*			trans	-77.8	60.5	166	-77.7	-31.1	0	0	0	110.4
14	E	29.8	Very low	27.9	Very low	153 Å²	153	147 Å²	147	72%	0.715	77%	0.773	S	S	*	*			trans	-107.4	108.6	175.8	-77.9	177.2	152.5	0	0	110.6	N12	N12-E14 HydrophobicContact CB-CB 4.41Å; N12-E14 HydrophobicContact CB-CG 4.3Å; N12-E14 PolarHBondContact ND2-OE2 3.38Å; N12-E14 VanDerWaalsContact ND2-OE2 3.11Å; N12-E14 PolarHBondContact O-N 3.09Å
15	E	33	Very low	28	Very low	155 Å²	155	141.5 Å²	141.5	72%	0.724	76%	0.762	S	S	*	*			trans	47.1	117.4	155.9	-67.1	-179	175	0	0	120.7
16	M	25.7	Very low	28	Very low	160 Å²	160	138.5 Å²	138.5	79%	0.788	76%	0.759	S	S	*	*			trans	-97.4	135.9	157.7	-78.8	-77.5	-71.8	0	0	109.4	Y18	M16-Y18 PolarHBondContact O-N 3.3Å
17	P	26.5	Very low	28.1	Very low	115 Å²	115	140.7 Å²	140.7	75%	0.747	76%	0.756	S	S	*	*			trans	-69.8	123.2	175.8	28.6	-31.7	0	0	0	109.7	S19	P17-S19 PolarHBondContact O-N 3.17Å; P17-S19 VanDerWaalsContact O-N 3.15Å
18	Y	27.3	Very low	28.1	Very low	196 Å²	196	137.2 Å²	137.2	77%	0.769	74%	0.744	S	S	*	*			trans	-73.1	102.8	176.2	-73.8	-90.5	0	0	0	110.1	M16 D20	M16-Y18 PolarHBondContact O-N 3.3Å; Y18-D20 PolarHBondContact O-N 2.92Å
19	S	23.7	Very low	28.2	Very low	101 Å²	101	139.7 Å²	139.7	71%	0.706	75%	0.746	S	S	*	*			trans	-86	96.8	160.3	62.8	0	0	0	0	108.8	P17 D21	P17-S19 PolarHBondContact O-N 3.17Å; P17-S19 VanDerWaalsContact O-N 3.15Å; S19-D21 PolarHBondContact O-N 3.28Å
20	D	26.8	Very low	28.1	Very low	117 Å²	117	141.5 Å²	141.5	63%	0.626	75%	0.749	S	S	*	*			trans	-76	54.8	170.9	-83	-13.7	0	0	0	111.7	Y18	Y18-D20 PolarHBondContact O-N 2.92Å
21	D	27	Very low	28	Very low	145 Å²	145	145.4 Å²	145.4	78%	0.775	76%	0.758	S	S	*	*			trans	-92.4	106.1	164.1	-86	-16.6	0	0	0	108.2	S19	S19-D21 PolarHBondContact O-N 3.28Å
22	E	24.4	Very low	28	Very low	159 Å²	159	147.1 Å²	147.1	74%	0.743	76%	0.76	S	S	*	*			trans	166.6	112.1	131.9	-88.9	176	173.4	0	0	110.3	K811	E22-K811 IonicContact OE2-NZ 2.94Å; E22-K811 PolarHBondContact OE2-NZ 3.23Å
23	T	32.5	Very low	28	Very low	118 Å²	118	149.9 Å²	149.9	72%	0.724	77%	0.769	S	S	*	*			trans	-44.9	138.6	163.8	45.7	0	0	0	0	114.1
24	D	26.1	Very low	27.9	Very low	125 Å²	125	151.3 Å²	151.3	67%	0.668	77%	0.771	S	S	*	*			trans	-134.7	113.7	150.5	-100.5	-17.4	0	0	0	109.3	K812	D24-K812 VanDerWaalsContact OD1-CE 3.23Å; D24-K812 WeakPolarHBondContact OD1-CE 3.31Å; D24-K812 IonicContact OD1-NZ 2.75Å; D24-K812 PolarHBondContact OD1-NZ 3.11Å; D24-K812 IonicContact OD2-NZ 2.64Å
25	D	28.2	Very low	27.8	Very low	136 Å²	136	149.3 Å²	149.3	73%	0.727	77%	0.774	S	S	*	*			trans	-60.8	141.7	173	-63.2	-60.3	0	0	0	112.4	L27	D25-L27 PolarHBondContact O-N 3.02Å
26	E	28.8	Very low	27.5	Very low	185 Å²	185	151.6 Å²	151.6	86%	0.864	78%	0.784	S	S	*	*			trans	-68.8	103.9	161.3	-70.4	-174.8	148.9	0	0	109.5
27	L	27.5	Very low	27.5	Very low	144 Å²	144	148.5 Å²	148.5	75%	0.754	78%	0.778	S	S	*	*			trans	-134	101.7	161.6	-79.6	171.5	0	0	0	110.1	D25	D25-L27 PolarHBondContact O-N 3.02Å
28	D	26	Very low	27.6	Very low	120 Å²	120	150.2 Å²	150.2	64%	0.642	78%	0.781	S	S	*	*			trans	-159.2	104.4	142.9	-88.1	-35.4	0	0	0	109	R814	D28-R814 VanDerWaalsContact CG-NH1 3.25Å; D28-R814 IonicContact OD1-CZ 2.99Å; D28-R814 VanDerWaalsContact OD1-CZ 3.26Å; D28-R814 IonicContact OD1-NH1 2.79Å; D28-R814 PolarHBondContact OD1-NH1 3.47Å; D28-R814 IonicContact OD1-NH2 3.35Å; D28-R814 PolarHBondContact OD1-NH2 3.46Å; D28-R814 IonicContact OD2-CZ 2.66Å; D28-R814 IonicContact OD2-NH1 3.35Å; D28-R814 PolarHBondContact OD2-NH1 3.16Å; D28-R814 IonicContact OD2-NH2 2.75Å; D28-R814 PolarHBondContact OD2-NH2 3.14Å
29	E	29.6	Very low	27.7	Very low	184 Å²	184	145.4 Å²	145.4	86%	0.86	78%	0.782	S	S	*	*	S	Bend	trans	156.7	83.8	138.1	-88.5	-179.8	-171	0	0	108.4
30	D	28.9	Very low	28	Very low	161 Å²	161	148.5 Å²	148.5	86%	0.861	79%	0.791	S	S	*	*			trans	-165.8	148.4	147.2	-88	-34	0	0	0	107.4
31	L	27.3	Very low	28.1	Very low	166 Å²	166	152.1 Å²	152.1	87%	0.869	80%	0.804	S	S	*	*			trans	104.3	78.7	175.4	-51.7	173.4	0	0	0	115.9
32	D	29.1	Very low	28.4	Very low	157 Å²	157	150.4 Å²	150.4	84%	0.84	80%	0.8	S	S	*	*			trans	-84.8	151.5	131.2	-78.4	-41	0	0	0	108.7
33	E	32.1	Very low	28.8	Very low	182 Å²	182	151.8 Å²	151.8	85%	0.85	81%	0.807	S	S	*	*			trans	75.6	103.1	173.2	-58.1	-176.1	174.1	0	0	117.3
34	E	26.8	Very low	28.6	Very low	199 Å²	199	154.5 Å²	154.5	93%	0.93	82%	0.817	S	S	*	*				-168.8	145.2	121.1	-102.8	172	-166.1	0	0	111.9
35	S	26.7	Very low	28.8	Very low	111 Å²	111	152.5 Å²	152.5	78%	0.776	82%	0.818	S	S	*	*			trans	-74.1	146.7	-165.6	47.3	0	0	0	0	115.6
36	E	26.5	Very low	28.9	Very low	202 Å²	202	153.4 Å²	153.4	94%	0.944	82%	0.823	S	S	*	*			trans	-73.6	125.4	169.1	-70.5	177.8	154.3	0	0	111.9
37	S	25.9	Very low	28.9	Very low	96 Å²	96	156.1 Å²	156.1	67%	0.671	83%	0.825	S	S	*	*			trans	-150.5	134.9	152.9	60.9	0	0	0	0	111.7
38	D	28.1	Very low	29.1	Very low	151 Å²	151	155.1 Å²	155.1	81%	0.807	83%	0.827	S	S	*	*			trans	77.7	108.5	158.2	-52.5	-29.3	0	0	0	117.6
39	A	30	Very low	29.3	Very low	95 Å²	95	154.4 Å²	154.4	79%	0.785	84%	0.838	S	S	*	*				92.3	116.8	63.2	0	0	0	0	0	111.9
40	D	29.1	Very low	29.2	Very low	166 Å²	166	154.2 Å²	154.2	89%	0.888	84%	0.837	S	S	*	*			trans	-53.9	140	178.7	-73	-55.2	0	0	0	113.7
41	E	29.3	Very low	29.2	Very low	192 Å²	192	151.6 Å²	151.6	90%	0.897	84%	0.838	S	S	*	*			trans	-153.1	151.7	137.7	-105.4	-173.8	-176.1	0	0	111.4
42	P	33.7	Very low	29.2	Very low	109 Å²	109	147.8 Å²	147.8	71%	0.708	83%	0.83	S	S	*	*			trans	-102.5	154.4	-153.7	38.2	-32.7	0	0	0	115.6
43	Q	32.7	Very low	29.2	Very low	189 Å²	189	144.8 Å²	144.8	88%	0.883	83%	0.827	S	S	*	*			trans	21.5	117.2	147.2	-66.7	177.1	-7.5	0	0	118.9
44	D	27.7	Very low	29	Very low	174 Å²	174	148 Å²	148	93%	0.93	83%	0.831	S	S	*	*			trans	-130.9	133.9	144.4	-111.3	-26.5	0	0	0	110.7
45	A	31.9	Very low	29	Very low	83 Å²	83	141 Å²	141	69%	0.686	81%	0.813	S	S	*	*			trans	-90.4	166.1	-177.5	0	0	0	0	0	111.5
46	D	30.1	Very low	29.4	Very low	155 Å²	155	141.8 Å²	141.8	83%	0.829	82%	0.816	S	S	*	*			trans	81.3	97.6	170.5	-63.9	-22.1	0	0	0	118.3
47	R	28	Very low	30	Very low	243 Å²	243	141.3 Å²	141.3	92%	0.917	81%	0.813	S	S	*	*				-158.1	149.4	129.8	-103.2	163	-159.9	-153	6.5	112.1
48	P	30.9	Very low	31.1	Very low	122 Å²	122	142.6 Å²	142.6	79%	0.792	81%	0.811	S	S	*	*			trans	-81	162	-161.6	-2.5	21.1	0	0	0	113.2	E50	P48-E50 PolarHBondContact O-N 3.03Å
49	A	31.9	Very low	33	Very low	105 Å²	105	136.8 Å²	136.8	87%	0.868	79%	0.788	S	S	*	*			trans	-48.1	100.3	177.3	0	0	0	0	0	114.2
50	E	26.9	Very low	35.6	Very low	181 Å²	181	132.6 Å²	132.6	85%	0.846	75%	0.751	S	S	*	*			trans	-99.3	100.2	146.9	-86.2	-178.1	159.8	0	0	107.4	P48 A52	P48-E50 PolarHBondContact O-N 3.03Å; E50-A52 PolarHBondContact O-N 3.45Å
51	A	28.6	Very low	38.5	Very low	106 Å²	106	127.5 Å²	127.5	88%	0.876	72%	0.721	S	S	*	*			trans	-65.7	75.7	159.9	0	0	0	0	0	108.2	A53	A51-A53 PolarHBondContact O-N 2.97Å; A51-A53 VanDerWaalsContact O-N 3.14Å
52	A	27	Very low	41.3	Very low	86 Å²	86	118.4 Å²	118.4	71%	0.711	68%	0.679	S	S	*	*			trans	-68.3	107.9	164.3	0	0	0	0	0	106.8	E50 R54	E50-A52 PolarHBondContact O-N 3.45Å; A52-R54 PolarHBondContact O-N 3.1Å
53	A	30.2	Very low	44	Very low	94 Å²	94	116.3 Å²	116.3	78%	0.777	66%	0.659	S	S	*	*			trans	-38	108.1	167.5	0	0	0	0	0	110.1	A51 G55	A51-A53 PolarHBondContact O-N 2.97Å; A51-A53 VanDerWaalsContact O-N 3.14Å; A53-G55 PolarHBondContact O-N 2.82Å
54	R	27.6	Very low	46.6	Very low	248 Å²	248	107.5 Å²	107.5	94%	0.936	62%	0.618	S	S	*	*			trans	-59.5	109.9	154	-77.2	-177.6	176.8	-177.8	-1.5	104.9	A52	A52-R54 PolarHBondContact O-N 3.1Å
55	G	26.4	Very low	49.3	Very low	53 Å²	53	101.7 Å²	101.7	55%	0.546	59%	0.587	S	S	.	*	P	Polyproline II helix	trans	-52	150.8	174	0	0	0	0	0	110.1	A53 E57	A53-G55 PolarHBondContact O-N 2.82Å; G55-E57 PolarHBondContact O-N 3.04Å
56	P	33.9	Very low	51.7	Low	128 Å²	128	99.6 Å²	99.6	83%	0.831	56%	0.564	S	S	*	*	P	Polyproline II helix	trans	-56	130.2	-179.6	24.4	-31.8	0	0	0	108.9	I58	P56-I58 PolarHBondContact O-N 3.48Å
57	E	40.3	Very low	54.3	Low	192 Å²	192	95.6 Å²	95.6	90%	0.897	54%	0.537	S	S	*	.	P	Polyproline II helix	trans	-48.9	132.1	171.3	-70.3	-179.5	158.5	0	0	109	G55 G59	G55-E57 PolarHBondContact O-N 3.04Å; E57-G59 PolarHBondContact O-N 3.36Å
58	I	49.5	Very low	56.7	Low	122 Å²	122	91.4 Å²	91.4	63%	0.626	53%	0.528	S	S	*	.			trans	-65.6	98.5	-165.6	-58.7	165.7	0	0	0	110.3	P56 R87	P56-I58 PolarHBondContact O-N 3.48Å; I58-R87 PolarHBondContact O-NH2 3.48Å
59	G	67.8	Low	59.2	Low	30 Å²	30	88 Å²	88	31%	0.309	50%	0.5	S	S	.	.			trans	-56.7	159.6	171.5	0	0	0	0	0	113.3	E57 K61	E57-G59 PolarHBondContact O-N 3.36Å; G59-K61 WeakPolarHBondContact O-CG 3.47Å; G59-K61 PolarHBondContact O-N 3.32Å
60	W	84.6	Confident	61.5	Low	7 Å²	7	83.4 Å²	83.4	3%	0.027	46%	0.461	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	121.6	178	-170.3	-95	0	0	0	109.4	R87 Y88 E260 C261 E262 P264 I307 F308	W60-R87 HydrophobicContact CZ3-CG 4.03Å; W60-Y88 HydrophobicContact CD2-CE1 4.23Å; W60-Y88 AromaticContact CE2-CD1 3.86Å; W60-Y88 AromaticContact CE2-CE1 3.62Å; W60-Y88 AromaticContact CH2-CD1 3.79Å; W60-Y88 HydrophobicContact CH2-CD1 3.79Å; W60-Y88 HydrophobicContact CH2-CE1 4.15Å; W60-Y88 AromaticContact CZ2-CD1 3.33Å; W60-Y88 HydrophobicContact CZ2-CD1 3.33Å; W60-Y88 AromaticContact CZ2-CE1 3.6Å; W60-Y88 HydrophobicContact CZ2-CE1 3.6Å; W60-Y88 HydrophobicContact CZ2-CG 4.43Å; W60-Y88 AromaticContact NE1-CE1 3.91Å; W60-E260 WeakPolarHBondContact O-CA 3.48Å; W60-C261 WeakPolarHBondContact CB-O 3.42Å; W60-C261 VanDerWaalsContact CD1-SG 3.59Å; W60-C261 PolarHBondContact N-O 2.83Å; W60-C261 PolarHBondContact O-N 3.03Å; W60-E262 WeakPolarHBondContact CB-O 3.37Å; W60-P264 HydrophobicContact CD2-CG 4.2Å; W60-P264 VanDerWaalsContact CE3-CD 3.45Å; W60-P264 HydrophobicContact CE3-CG 3.96Å; W60-P264 HydrophobicContact CH2-CG 3.72Å; W60-P264 HydrophobicContact CZ2-CG 3.95Å; W60-P264 HydrophobicContact CZ3-CG 3.72Å; W60-I307 PolarHBondContact NE1-O 3.47Å; W60-F308 AromaticContact CD1-CE1 3.61Å; W60-F308 HydrophobicContact CD2-CE1 4.18Å; W60-F308 AromaticContact CE2-CD1 3.85Å; W60-F308 AromaticContact CE2-CE1 3.82Å; W60-F308 HydrophobicContact CG-CE1 4.04Å; W60-F308 HydrophobicContact CZ2-CD1 4.09Å; W60-F308 HydrophobicContact CZ2-CE1 4.45Å; W60-F308 AromaticContact NE1-CD1 3.58Å; W60-F308 AromaticContact NE1-CE1 3.46Å
61	K	88.9	Confident	63.8	Low	59 Å²	59	80 Å²	80	26%	0.257	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	134.7	-177.5	-55	-161.5	-175.3	-155.2	0	110.8	G59 Y88 L258 I259 E260	G59-K61 WeakPolarHBondContact O-CG 3.47Å; G59-K61 PolarHBondContact O-N 3.32Å; K61-Y88 PolarHBondContact O-OH 3.19Å; K61-L258 HydrophobicContact CB-CD1 4.48Å; K61-I259 CarbonylContact C-O 3.46Å; K61-I259 WeakPolarHBondContact CA-O 3.21Å; K61-E260 HydrophobicContact CD-CG 4.36Å; K61-E260 VanDerWaalsContact CE-OE1 3.25Å; K61-E260 WeakPolarHBondContact CE-OE1 3.2Å; K61-E260 HydrophobicContact CG-CG 4.29Å; K61-E260 IonicContact NZ-OE1 2.66Å; K61-E260 PolarHBondContact NZ-OE1 3.44Å
62	V	88.9	Confident	66.2	Low	0 Å²	0	78.3 Å²	78.3	0%	0	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	130.9	177.3	179.1	0	0	0	0	108.9	V192 I259 I307	V62-V192 HydrophobicContact CB-CG1 4.26Å; V62-V192 HydrophobicContact CG1-CG1 3.73Å; V62-V192 HydrophobicContact CG2-CG1 3.6Å; V62-I259 HydrophobicContact CB-CB 4.38Å; V62-I259 PolarHBondContact N-O 3.43Å; V62-I259 PolarHBondContact O-N 2.79Å; V62-I307 HydrophobicContact CB-CD1 4.35Å; V62-I307 HydrophobicContact CG1-CD1 4.22Å; V62-I307 HydrophobicContact CG2-CG2 4.39Å
63	K	89.6	Confident	68.2	Low	66 Å²	66	78.5 Å²	78.5	29%	0.287	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	128.5	177.4	-169	177.3	173	-157.6	0	110.3	D66 Y69 H70 L258	K63-D66 HydrophobicContact CB-CB 4.29Å; K63-D66 HydrophobicContact CD-CB 3.95Å; K63-D66 WeakPolarHBondContact CD-OD2 3.45Å; K63-D66 WeakPolarHBondContact CE-OD2 3.46Å; K63-D66 HydrophobicContact CG-CB 4.04Å; K63-D66 IonicContact NZ-OD2 2.74Å; K63-D66 PolarHBondContact NZ-OD2 3.08Å; K63-Y69 HydrophobicContact CB-CD1 3.65Å; K63-Y69 HydrophobicContact CB-CE1 4.07Å; K63-Y69 HydrophobicContact CB-CG 4Å; K63-Y69 HydrophobicContact CD-CD1 4.46Å; K63-Y69 HydrophobicContact CD-CD2 4.06Å; K63-Y69 HydrophobicContact CD-CG 4Å; K63-H70 PolarHBondContact N-NE2 3.4Å; K63-H70 VanDerWaalsContact N-NE2 3.2Å; K63-H70 PolarHBondContact O-CE1 3Å; K63-H70 VanDerWaalsContact O-CE1 3.28Å; K63-L258 HydrophobicContact CB-CD1 4.38Å
64	A	87.9	Confident	70.2	Confident	3 Å²	3	82.1 Å²	82.1	3%	0.025	42%	0.415	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	137.5	-177.5	0	0	0	0	0	112.3	D66 F255 A257 L305	A64-D66 PolarHBondContact O-N 3.24Å; A64-D66 VanDerWaalsContact O-N 3.09Å; A64-F255 HydrophobicContact CB-CD1 3.45Å; A64-F255 VanDerWaalsContact CB-CD1 3.45Å; A64-F255 HydrophobicContact CB-CE1 3.58Å; A64-F255 HydrophobicContact CB-CG 4.41Å; A64-A257 PolarHBondContact N-O 2.92Å; A64-L305 HydrophobicContact CB-CD1 3.9Å; A64-L305 HydrophobicContact CB-CD2 4.06Å
65	N	84.7	Confident	72.4	Confident	53 Å²	53	70.9 Å²	70.9	28%	0.283	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.3	17.6	177.2	-62.4	-46.9	0	0	0	115.7	G193 V195 L252 F255	N65-G193 PolarHBondContact N-O 3.27Å; N65-V195 VanDerWaalsContact OD1-CG2 3.31Å; N65-V195 WeakPolarHBondContact OD1-CG2 3.47Å; N65-L252 PolarHBondContact ND2-O 2.75Å; N65-F255 PolarHBondContact ND2-O 3.09Å
66	D	82.9	Confident	74.6	Confident	38 Å²	38	72.6 Å²	72.6	20%	0.203	37%	0.366	C	S	.	.			trans	-122.3	87.7	-176.4	-167.8	-20.5	0	0	0	110.9	K63 A64 E68 Y69 H70	K63-D66 HydrophobicContact CB-CB 4.29Å; K63-D66 HydrophobicContact CD-CB 3.95Å; K63-D66 WeakPolarHBondContact CD-OD2 3.45Å; K63-D66 WeakPolarHBondContact CE-OD2 3.46Å; K63-D66 HydrophobicContact CG-CB 4.04Å; K63-D66 IonicContact NZ-OD2 2.74Å; K63-D66 PolarHBondContact NZ-OD2 3.08Å; A64-D66 PolarHBondContact O-N 3.24Å; A64-D66 VanDerWaalsContact O-N 3.09Å; D66-E68 VanDerWaalsContact C-N 3.3Å; D66-E68 PolarHBondContact O-N 3.08Å; D66-E68 PolarHBondContact OD1-N 3.4Å; D66-Y69 VanDerWaalsContact CG-CB 3.49Å; D66-Y69 WeakPolarHBondContact OD1-CB 3.41Å; D66-Y69 PolarHBondContact OD1-N 3.18Å; D66-H70 PolarHBondContact O-CE1 2.66Å; D66-H70 PolarHBondContact O-ND1 3.14Å
67	R	83.1	Confident	76.2	Confident	72 Å²	72	72.7 Å²	72.7	27%	0.272	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68	-29.9	177.3	-71.7	-177.2	174	-164.9	-9	112.6	H70 D194	R67-H70 PolarHBondContact O-N 2.96Å; R67-D194 IonicContact CZ-OD1 3.93Å; R67-D194 IonicContact CZ-OD2 3.45Å; R67-D194 IonicContact NE-OD1 3.42Å; R67-D194 PolarHBondContact NE-OD1 2.82Å; R67-D194 IonicContact NE-OD2 3.48Å; R67-D194 IonicContact NH2-OD1 2.73Å; R67-D194 PolarHBondContact NH2-OD1 2.88Å; R67-D194 IonicContact NH2-OD2 2.68Å; R67-D194 PolarHBondContact NH2-OD2 2.93Å
68	E	79.8	Confident	77.4	Confident	155 Å²	155	71.9 Å²	71.9	72%	0.724	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.1	-36.6	-176.7	-63.9	-170.7	169.7	0	0	111.7	D66 H70 Q71 L72	D66-E68 VanDerWaalsContact C-N 3.3Å; D66-E68 PolarHBondContact O-N 3.08Å; D66-E68 PolarHBondContact OD1-N 3.4Å; E68-H70 VanDerWaalsContact C-N 3.25Å; E68-H70 PolarHBondContact O-N 2.79Å; E68-Q71 PolarHBondContact O-N 2.89Å; E68-L72 PolarHBondContact O-N 2.88Å
69	Y	81.8	Confident	77.8	Confident	49 Å²	49	70.8 Å²	70.8	19%	0.192	35%	0.345	C	S	.	.	G	3₁₀ helix	trans	-52.3	-43.5	174.4	-178.9	-99.4	0	0	0	112.5	K63 D66 Q71 L72 F75	K63-Y69 HydrophobicContact CB-CD1 3.65Å; K63-Y69 HydrophobicContact CB-CE1 4.07Å; K63-Y69 HydrophobicContact CB-CG 4Å; K63-Y69 HydrophobicContact CD-CD1 4.46Å; K63-Y69 HydrophobicContact CD-CD2 4.06Å; K63-Y69 HydrophobicContact CD-CG 4Å; D66-Y69 VanDerWaalsContact CG-CB 3.49Å; D66-Y69 WeakPolarHBondContact OD1-CB 3.41Å; D66-Y69 PolarHBondContact OD1-N 3.18Å; Y69-Q71 PolarHBondContact O-N 3.01Å; Y69-L72 HydrophobicContact CD2-CD1 3.76Å; Y69-L72 HydrophobicContact CE2-CD1 4.18Å; Y69-L72 HydrophobicContact CG-CD1 4.39Å; Y69-L72 WeakPolarHBondContact O-CB 3.27Å; Y69-L72 WeakPolarHBondContact O-CD1 3.45Å; Y69-L72 VanDerWaalsContact O-CG 3.27Å; Y69-L72 WeakPolarHBondContact O-CG 3.43Å; Y69-L72 PolarHBondContact O-N 3.24Å; Y69-F75 HydrophobicContact CD1-CE2 4.29Å; Y69-F75 AromaticContact CE1-CE2 3.87Å; Y69-F75 HydrophobicContact CE1-CE2 3.87Å; Y69-F75 AromaticContact CE1-CZ 3.99Å; Y69-F75 HydrophobicContact CE1-CZ 3.99Å; Y69-F75 HydrophobicContact CE2-CE2 4.44Å; Y69-F75 AromaticContact CZ-CE2 3.95Å; Y69-F75 AromaticContact CZ-CZ 3.95Å; Y69-F75 WeakPolarHBondContact O-CD2 3.45Å; Y69-F75 WeakPolarHBondContact O-CE2 3.37Å
70	H	80.5	Confident	76.8	Confident	10 Å²	10	76.8 Å²	76.8	5%	0.046	36%	0.363	C	S	.	.	G	3₁₀ helix	trans	-74.6	-9.1	-179.4	-53.7	100.4	0	0	0	113.6	K63 D66 R67 E68 Y88 V192	K63-H70 PolarHBondContact N-NE2 3.4Å; K63-H70 VanDerWaalsContact N-NE2 3.2Å; K63-H70 PolarHBondContact O-CE1 3Å; K63-H70 VanDerWaalsContact O-CE1 3.28Å; D66-H70 PolarHBondContact O-CE1 2.66Å; D66-H70 PolarHBondContact O-ND1 3.14Å; R67-H70 PolarHBondContact O-N 2.96Å; E68-H70 VanDerWaalsContact C-N 3.25Å; E68-H70 PolarHBondContact O-N 2.79Å; H70-Y88 HydrophobicContact CB-CD2 3.85Å; H70-Y88 HydrophobicContact CB-CE2 3.91Å; H70-Y88 AromaticContact CD2-CE2 3.87Å; H70-Y88 AromaticContact CD2-CZ 3.69Å; H70-V192 PolarHBondContact CE1-O 3.24Å; H70-V192 PolarHBondContact ND1-O 2.81Å
71	Q	76.4	Confident	74.9	Confident	109 Å²	109	83 Å²	83	51%	0.509	40%	0.396	S	S	.	.	G	3₁₀ helix	trans	-101.4	1.9	176.4	-62.1	-174.4	15.4	0	0	113.4	E68 Y69 K76	E68-Q71 PolarHBondContact O-N 2.89Å; Y69-Q71 PolarHBondContact O-N 3.01Å; Q71-K76 WeakPolarHBondContact O-CE 3.4Å; Q71-K76 PolarHBondContact O-NZ 2.99Å
72	L	78.7	Confident	73.3	Confident	71 Å²	71	86.3 Å²	86.3	37%	0.372	43%	0.425	S	S	.	.	S	Bend	trans	-57.3	148	176.9	-72.5	171.3	0	0	0	111.6	E68 Y69 E74 F75	E68-L72 PolarHBondContact O-N 2.88Å; Y69-L72 HydrophobicContact CD2-CD1 3.76Å; Y69-L72 HydrophobicContact CE2-CD1 4.18Å; Y69-L72 HydrophobicContact CG-CD1 4.39Å; Y69-L72 WeakPolarHBondContact O-CB 3.27Å; Y69-L72 WeakPolarHBondContact O-CD1 3.45Å; Y69-L72 VanDerWaalsContact O-CG 3.27Å; Y69-L72 WeakPolarHBondContact O-CG 3.43Å; Y69-L72 PolarHBondContact O-N 3.24Å; L72-E74 PolarHBondContact O-N 2.82Å; L72-F75 HydrophobicContact CB-CD2 4.04Å; L72-F75 HydrophobicContact CB-CE2 4.39Å; L72-F75 HydrophobicContact CD1-CE2 4.47Å; L72-F75 PolarHBondContact O-N 2.83Å
73	P	69.9	Low	71.7	Confident	90 Å²	90	94 Å²	94	58%	0.584	46%	0.459	S	S	*	.	G	3₁₀ helix	trans	-61.5	-25.3	-176.3	22.3	-31.4	0	0	0	113.6	F75 K76	P73-F75 PolarHBondContact O-N 3.36Å; P73-K76 PolarHBondContact O-N 2.69Å
74	E	72	Confident	70.4	Confident	170 Å²	170	97.4 Å²	97.4	79%	0.794	47%	0.474	S	S	*	.	G	3₁₀ helix	trans	-63.4	-26.7	176.1	-62.1	178.8	-177.5	0	0	112.8	L72	L72-E74 PolarHBondContact O-N 2.82Å
75	F	72.4	Confident	69.6	Low	12 Å²	12	104.2 Å²	104.2	5%	0.053	50%	0.503	C	S	.	.	G	3₁₀ helix	trans	-97.3	13.9	177.7	-56.1	-62.3	0	0	0	113	Y69 L72 P73 R87 Y88	Y69-F75 HydrophobicContact CD1-CE2 4.29Å; Y69-F75 AromaticContact CE1-CE2 3.87Å; Y69-F75 HydrophobicContact CE1-CE2 3.87Å; Y69-F75 AromaticContact CE1-CZ 3.99Å; Y69-F75 HydrophobicContact CE1-CZ 3.99Å; Y69-F75 HydrophobicContact CE2-CE2 4.44Å; Y69-F75 AromaticContact CZ-CE2 3.95Å; Y69-F75 AromaticContact CZ-CZ 3.95Å; Y69-F75 WeakPolarHBondContact O-CD2 3.45Å; Y69-F75 WeakPolarHBondContact O-CE2 3.37Å; L72-F75 HydrophobicContact CB-CD2 4.04Å; L72-F75 HydrophobicContact CB-CE2 4.39Å; L72-F75 HydrophobicContact CD1-CE2 4.47Å; L72-F75 PolarHBondContact O-N 2.83Å; P73-F75 PolarHBondContact O-N 3.36Å; F75-R87 HydrophobicContact CB-CB 4.3Å; F75-R87 WeakPolarHBondContact O-CA 3.35Å; F75-R87 WeakPolarHBondContact O-CB 3.36Å; F75-R87 PolarHBondContact O-N 3.4Å; F75-Y88 HydrophobicContact CB-CD2 4.5Å; F75-Y88 HydrophobicContact CB-CE2 3.91Å; F75-Y88 HydrophobicContact CD1-CE2 4.2Å; F75-Y88 HydrophobicContact CD2-CE2 4.27Å; F75-Y88 AromaticContact CG-CE2 3.88Å; F75-Y88 HydrophobicContact CG-CE2 3.88Å
76	K	73.3	Confident	69.2	Low	89 Å²	89	104 Å²	104	39%	0.387	51%	0.505	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	121.2	179.1	-69.6	-178.5	-175.5	167.9	0	112	Q71 P73 K84 K85	Q71-K76 WeakPolarHBondContact O-CE 3.4Å; Q71-K76 PolarHBondContact O-NZ 2.99Å; P73-K76 PolarHBondContact O-N 2.69Å; K76-K84 HydrophobicContact CB-CB 4.22Å; K76-K84 HydrophobicContact CD-CB 4.25Å; K76-K84 HydrophobicContact CD-CD 4.43Å; K76-K85 CarbonylContact C-O 3.56Å; K76-K85 WeakPolarHBondContact CA-O 3.31Å
77	K	67	Low	69	Low	130 Å²	130	104.2 Å²	104.2	57%	0.565	50%	0.503	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.4	139.7	171.8	-70	-174.2	176.4	-177.4	0	110.7	K84 K85	K77-K84 WeakPolarHBondContact O-CA 3.48Å; K77-K85 PolarHBondContact N-O 3.26Å; K77-K85 PolarHBondContact O-N 2.95Å
78	K	66.4	Low	69.1	Low	174 Å²	174	101.6 Å²	101.6	76%	0.757	49%	0.493	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.8	124.1	169.6	-71.1	-178.6	179.7	177.5	0	108.2
79	V	58.1	Low	69.1	Low	100 Å²	100	96 Å²	96	61%	0.606	47%	0.471	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.9	-41.8	-174.8	-177.3	0	0	0	0	111.9	F83 K85	V79-F83 PolarHBondContact N-O 3.39Å; V79-K85 HydrophobicContact CG2-CB 3.77Å; V79-K85 HydrophobicContact CG2-CD 4.37Å
80	F	45.7	Very low	69.4	Low	156 Å²	156	96.1 Å²	96.1	68%	0.684	49%	0.488	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-170.2	147	172	-162.2	-111.5	0	0	0	110.2	C82 F83	F80-C82 PolarHBondContact O-N 2.54Å; F80-F83 WeakPolarHBondContact O-CB 3.43Å; F80-F83 PolarHBondContact O-N 3.34Å
81	L	45.3	Very low	69.8	Low	137 Å²	137	95.6 Å²	95.6	72%	0.717	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	41.8	55.8	169.3	-128.3	114.6	0	0	0	116	F83	L81-F83 WeakPolarHBondContact O-CD2 3.42Å; L81-F83 PolarHBondContact O-N 3.1Å
82	C	54	Low	70.4	Confident	129 Å²	129	92.2 Å²	92.2	87%	0.872	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.5	2.5	-178.5	-65.2	0	0	0	0	117.4	F80 K84	F80-C82 PolarHBondContact O-N 2.54Å; C82-K84 PolarHBondContact O-N 3.29Å
83	F	55.9	Low	70.6	Confident	162 Å²	162	89.9 Å²	89.9	71%	0.711	46%	0.464	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.1	116.9	172.1	-72.5	-86.3	0	0	0	111.1	V79 F80 L81	V79-F83 PolarHBondContact N-O 3.39Å; F80-F83 WeakPolarHBondContact O-CB 3.43Å; F80-F83 PolarHBondContact O-N 3.34Å; L81-F83 WeakPolarHBondContact O-CD2 3.42Å; L81-F83 PolarHBondContact O-N 3.1Å
84	K	63.7	Low	71.1	Confident	137 Å²	137	92.8 Å²	92.8	60%	0.596	47%	0.467	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93	121.3	173.4	-69.9	-177.3	-178.5	-179.5	0	109.3	K76 K77 C82	K76-K84 HydrophobicContact CB-CB 4.22Å; K76-K84 HydrophobicContact CD-CB 4.25Å; K76-K84 HydrophobicContact CD-CD 4.43Å; K77-K84 WeakPolarHBondContact O-CA 3.48Å; C82-K84 PolarHBondContact O-N 3.29Å
85	K	69.9	Low	71.2	Confident	146 Å²	146	88.2 Å²	88.2	64%	0.635	45%	0.451	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.9	142.4	174.8	-164.5	177.1	177.4	-174.1	0	109.5	K76 K77 V79	K76-K85 CarbonylContact C-O 3.56Å; K76-K85 WeakPolarHBondContact CA-O 3.31Å; K77-K85 PolarHBondContact N-O 3.26Å; K77-K85 PolarHBondContact O-N 2.95Å; V79-K85 HydrophobicContact CG2-CB 3.77Å; V79-K85 HydrophobicContact CG2-CD 4.37Å
86	S	75.6	Confident	71.6	Confident	47 Å²	47	90.9 Å²	90.9	33%	0.329	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.1	145.7	173.8	-173.8	0	0	0	0	110.9	Y88	S86-Y88 PolarHBondContact OG-N 3.26Å
87	R	80.1	Confident	71.6	Confident	43 Å²	43	92 Å²	92	16%	0.162	47%	0.466	C	S	.	.	S	Bend	trans	-64.3	-30.5	170.9	-178.9	179.5	-174.8	-178.6	0.3	111.1	I58 W60 F75 E263	I58-R87 PolarHBondContact O-NH2 3.48Å; W60-R87 HydrophobicContact CZ3-CG 4.03Å; F75-R87 HydrophobicContact CB-CB 4.3Å; F75-R87 WeakPolarHBondContact O-CA 3.35Å; F75-R87 WeakPolarHBondContact O-CB 3.36Å; F75-R87 PolarHBondContact O-N 3.4Å; R87-E263 IonicContact CZ-OE1 3.11Å; R87-E263 IonicContact NH2-OE1 2.73Å; R87-E263 PolarHBondContact NH2-OE1 3.46Å
88	Y	84.1	Confident	72.3	Confident	17 Å²	17	86.3 Å²	86.3	7%	0.067	44%	0.441	C	S	.	.	S	Bend	trans	-87.6	128	178.2	-54.5	-84.7	0	0	0	110.7	W60 K61 H70 F75 S86 V192	W60-Y88 HydrophobicContact CD2-CE1 4.23Å; W60-Y88 AromaticContact CE2-CD1 3.86Å; W60-Y88 AromaticContact CE2-CE1 3.62Å; W60-Y88 AromaticContact CH2-CD1 3.79Å; W60-Y88 HydrophobicContact CH2-CD1 3.79Å; W60-Y88 HydrophobicContact CH2-CE1 4.15Å; W60-Y88 AromaticContact CZ2-CD1 3.33Å; W60-Y88 HydrophobicContact CZ2-CD1 3.33Å; W60-Y88 AromaticContact CZ2-CE1 3.6Å; W60-Y88 HydrophobicContact CZ2-CE1 3.6Å; W60-Y88 HydrophobicContact CZ2-CG 4.43Å; W60-Y88 AromaticContact NE1-CE1 3.91Å; K61-Y88 PolarHBondContact O-OH 3.19Å; H70-Y88 HydrophobicContact CB-CD2 3.85Å; H70-Y88 HydrophobicContact CB-CE2 3.91Å; H70-Y88 AromaticContact CD2-CE2 3.87Å; H70-Y88 AromaticContact CD2-CZ 3.69Å; F75-Y88 HydrophobicContact CB-CD2 4.5Å; F75-Y88 HydrophobicContact CB-CE2 3.91Å; F75-Y88 HydrophobicContact CD1-CE2 4.2Å; F75-Y88 HydrophobicContact CD2-CE2 4.27Å; F75-Y88 AromaticContact CG-CE2 3.88Å; F75-Y88 HydrophobicContact CG-CE2 3.88Å; S86-Y88 PolarHBondContact OG-N 3.26Å; Y88-V192 HydrophobicContact CD1-CB 4.09Å; Y88-V192 HydrophobicContact CD1-CG1 3.92Å; Y88-V192 HydrophobicContact CD1-CG2 4.04Å; Y88-V192 HydrophobicContact CE1-CG1 4.1Å
89	S	81.4	Confident	73.3	Confident	37 Å²	37	82 Å²	82	26%	0.259	43%	0.426	S	S	.	.	P	Polyproline II helix	trans	-73	146	173.2	-59.5	0	0	0	0	111.6	D312	S89-D312 WeakPolarHBondContact CB-OD2 3.4Å; S89-D312 PolarHBondContact N-OD2 3.28Å; S89-D312 PolarHBondContact OG-OD2 3.35Å
90	G	86.9	Confident	74.5	Confident	52 Å²	52	83.6 Å²	83.6	54%	0.536	44%	0.436	S	S	.	.	P	Polyproline II helix	trans	-72.4	157.9	166.2	0	0	0	0	0	111.1	A92 G310	G90-A92 PolarHBondContact O-N 2.74Å; G90-G310 WeakPolarHBondContact O-CA 3.46Å
91	N	90.1	Very high	76.6	Confident	0 Å²	0	83 Å²	83	0%	0	44%	0.439	C	S	.	.	S	Bend	trans	-79.2	-0.1	-173	-161.7	34.2	0	0	0	115.6	I93 W187 V190 P205 R292 A309 G310	N91-I93 PolarHBondContact O-N 3.39Å; N91-W187 VanDerWaalsContact CB-O 3.28Å; N91-W187 WeakPolarHBondContact CB-O 3.5Å; N91-W187 PolarHBondContact ND2-O 2.93Å; N91-V190 HydrophobicContact CB-CB 4.22Å; N91-V190 VanDerWaalsContact CB-O 3.25Å; N91-V190 WeakPolarHBondContact CB-O 3.49Å; N91-P205 PolarHBondContact ND2-O 2.8Å; N91-P205 VanDerWaalsContact ND2-O 3.12Å; N91-P205 PolarHBondContact OD1-O 3.31Å; N91-R292 PolarHBondContact OD1-NH1 2.87Å; N91-A309 HydrophobicContact CB-CB 4.14Å; N91-G310 PolarHBondContact OD1-N 2.97Å
92	A	87.6	Confident	78.6	Confident	38 Å²	38	79.5 Å²	79.5	31%	0.314	42%	0.423	S	S	.	.			trans	-70.6	125.2	178.1	0	0	0	0	0	112.2	G90 N170 M188	G90-A92 PolarHBondContact O-N 2.74Å; A92-N170 WeakPolarHBondContact CA-OD1 3.28Å; A92-M188 HydrophobicContact CB-CB 4.09Å
93	I	82.4	Confident	80.4	Confident	22 Å²	22	74.8 Å²	74.8	11%	0.113	39%	0.388	C	S	.	.			trans	-85.7	136.2	172.4	-67.3	178	0	0	0	109.6	N91 T95 V169 N170 R292 M316	N91-I93 PolarHBondContact O-N 3.39Å; I93-T95 HydrophobicContact CG2-CG2 3.76Å; I93-V169 HydrophobicContact CD1-CG1 4.18Å; I93-N170 PolarHBondContact N-OD1 3.42Å; I93-N170 PolarHBondContact O-ND2 2.84Å; I93-R292 VanDerWaalsContact CD1-CZ 3.43Å; I93-M316 HydrophobicContact CD1-SD 4.08Å; I93-M316 HydrophobicContact CG1-CE 4.4Å; I93-M316 HydrophobicContact CG1-SD 4.38Å; I93-M316 HydrophobicContact CG2-CE 4.17Å
94	K	81.2	Confident	82	Confident	151 Å²	151	72.3 Å²	72.3	66%	0.657	38%	0.381	S	S	*	.			trans	-132.9	105.1	173.8	-61.1	-178.9	-176.6	-179.9	0	109.4	Y96	K94-Y96 HydrophobicContact CB-CE1 4.19Å; K94-Y96 HydrophobicContact CG-CE1 4.16Å
95	T	74.2	Confident	83.3	Confident	73 Å²	73	69.5 Å²	69.5	45%	0.448	38%	0.377	S	S	.	.			trans	-106.5	-19.4	176.8	69.7	0	0	0	0	113	I93 D166	I93-T95 HydrophobicContact CG2-CG2 3.76Å; T95-D166 WeakPolarHBondContact CB-OD1 3.27Å; T95-D166 WeakPolarHBondContact CG2-OD1 3.22Å; T95-D166 PolarHBondContact N-OD2 3.39Å; T95-D166 PolarHBondContact OG1-OD1 2.81Å; T95-D166 PolarHBondContact OG1-OD2 2.93Å; T95-D166 VanDerWaalsContact OG1-OD2 3.1Å
96	Y	80	Confident	84.1	Confident	68 Å²	68	66 Å²	66	27%	0.267	37%	0.365	S	S	.	.			trans	-62.7	148	172.5	67.5	-99	0	0	0	112	K94 Y98 H163 D166	K94-Y96 HydrophobicContact CB-CE1 4.19Å; K94-Y96 HydrophobicContact CG-CE1 4.16Å; Y96-Y98 WeakPolarHBondContact CD2-O 3.16Å; Y96-H163 WeakPolarHBondContact CB-NE2 3.44Å; Y96-H163 AromaticContact CD1-CE1 3.36Å; Y96-H163 WeakPolarHBondContact CD1-CE1 3.38Å; Y96-H163 AromaticContact CD1-ND1 3.49Å; Y96-H163 WeakPolarHBondContact CD1-ND1 3.46Å; Y96-H163 AromaticContact CD1-NE2 3.95Å; Y96-H163 AromaticContact CD2-CE1 3.18Å; Y96-H163 WeakPolarHBondContact CD2-CE1 3.04Å; Y96-H163 AromaticContact CD2-NE2 3.28Å; Y96-H163 VanDerWaalsContact CD2-NE2 3.28Å; Y96-H163 WeakPolarHBondContact CD2-NE2 3.25Å; Y96-H163 AromaticContact CE1-CE1 3.65Å; Y96-H163 AromaticContact CE1-ND1 3.86Å; Y96-H163 AromaticContact CE2-CE1 3.46Å; Y96-H163 VanDerWaalsContact CE2-CE1 3.46Å; Y96-H163 WeakPolarHBondContact CE2-CE1 3.24Å; Y96-H163 AromaticContact CE2-NE2 3.97Å; Y96-H163 AromaticContact CG-CD2 3.87Å; Y96-H163 AromaticContact CG-CE1 3.13Å; Y96-H163 AromaticContact CG-ND1 3.65Å; Y96-H163 AromaticContact CG-NE2 3.27Å; Y96-H163 VanDerWaalsContact CG-NE2 3.27Å; Y96-H163 AromaticContact CZ-CE1 3.69Å; Y96-D166 VanDerWaalsContact CD1-OD2 3.28Å; Y96-D166 WeakPolarHBondContact CD1-OD2 3.21Å; Y96-D166 PolarHBondContact N-OD2 2.95Å
97	K	74.9	Confident	84.7	Confident	113 Å²	113	64 Å²	64	49%	0.491	35%	0.35	S	S	.	.			trans	-92.4	-38.6	-178.8	-69.8	-176.3	177.7	-173.3	0	112.6	D159	K97-D159 PolarHBondContact N-OD1 2.69Å
98	Y	81.1	Confident	85.1	Confident	10 Å²	10	64.9 Å²	64.9	4%	0.039	36%	0.358	C	S	.	.			trans	-112.3	145	-169.7	-45.8	-73.7	0	0	0	111.4	Y96 F103 L106 E110 D159 H163	Y96-Y98 WeakPolarHBondContact CD2-O 3.16Å; Y98-F103 HydrophobicContact CD1-CD2 4.49Å; Y98-F103 AromaticContact CD2-CD2 3.84Å; Y98-F103 HydrophobicContact CD2-CD2 3.84Å; Y98-F103 HydrophobicContact CD2-CE2 4.24Å; Y98-F103 AromaticContact CG-CD2 3.82Å; Y98-F103 HydrophobicContact CG-CD2 3.82Å; Y98-L106 HydrophobicContact CD1-CB 4.11Å; Y98-L106 HydrophobicContact CD1-CD2 3.9Å; Y98-L106 HydrophobicContact CE1-CB 4.26Å; Y98-L106 HydrophobicContact CE1-CD2 3.98Å; Y98-L106 HydrophobicContact CE1-CG 4.46Å; Y98-E110 PolarHBondContact OH-OE2 3.42Å; Y98-D159 HydrophobicContact CD2-CB 3.88Å; Y98-D159 WeakPolarHBondContact CD2-OD2 3.47Å; Y98-D159 HydrophobicContact CE2-CB 4.43Å; Y98-D159 PolarHBondContact N-OD2 2.91Å; Y98-H163 PolarHBondContact O-NE2 2.78Å
99	N	86.2	Confident	85.3	Confident	83 Å²	83	70.9 Å²	70.9	44%	0.444	38%	0.382	S	S	.	.			trans	-98.9	163	164.2	-162.7	1.4	0	0	0	108.6	I101 T102 F103	N99-I101 PolarHBondContact O-N 2.97Å; N99-I101 VanDerWaalsContact O-N 3.09Å; N99-T102 HydrophobicContact CB-CG2 4.43Å; N99-T102 WeakPolarHBondContact CB-OG1 3.49Å; N99-T102 PolarHBondContact N-OG1 3.1Å; N99-T102 PolarHBondContact O-N 3.14Å; N99-T102 PolarHBondContact O-OG1 2.75Å; N99-F103 WeakPolarHBondContact O-CB 3.48Å; N99-F103 PolarHBondContact O-N 3.17Å
100	V	85.1	Confident	85.3	Confident	134 Å²	134	72.2 Å²	72.2	81%	0.812	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.2	-38.7	-177	-179.1	0	0	0	0	112
101	I	88.6	Confident	85.2	Confident	145 Å²	145	70 Å²	70	74%	0.744	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83	-36.3	180	-56.9	169.7	0	0	0	111.9	N99 F103 P105	N99-I101 PolarHBondContact O-N 2.97Å; N99-I101 VanDerWaalsContact O-N 3.09Å; I101-F103 VanDerWaalsContact C-N 3.34Å; I101-P105 VanDerWaalsContact O-CD 3.31Å; I101-P105 WeakPolarHBondContact O-CD 3.46Å
102	T	88.7	Confident	85	Confident	62 Å²	62	72.6 Å²	72.6	38%	0.38	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-12.8	-177.2	61.8	0	0	0	0	112.9	N99 P105 L106	N99-T102 HydrophobicContact CB-CG2 4.43Å; N99-T102 WeakPolarHBondContact CB-OG1 3.49Å; N99-T102 PolarHBondContact N-OG1 3.1Å; N99-T102 PolarHBondContact O-N 3.14Å; N99-T102 PolarHBondContact O-OG1 2.75Å; T102-P105 WeakPolarHBondContact O-CD 3.33Å; T102-L106 WeakPolarHBondContact O-CB 3.09Å; T102-L106 PolarHBondContact O-N 3.01Å
103	F	90.1	Very high	84.7	Confident	31 Å²	31	76.8 Å²	76.8	14%	0.136	38%	0.382	C	S	.	.	H	α-helix	trans	-55.9	-59.9	-178.8	174.7	-101.2	0	0	0	111.8	Y98 N99 I101 N107 A152 L156	Y98-F103 HydrophobicContact CD1-CD2 4.49Å; Y98-F103 AromaticContact CD2-CD2 3.84Å; Y98-F103 HydrophobicContact CD2-CD2 3.84Å; Y98-F103 HydrophobicContact CD2-CE2 4.24Å; Y98-F103 AromaticContact CG-CD2 3.82Å; Y98-F103 HydrophobicContact CG-CD2 3.82Å; N99-F103 WeakPolarHBondContact O-CB 3.48Å; N99-F103 PolarHBondContact O-N 3.17Å; I101-F103 VanDerWaalsContact C-N 3.34Å; F103-N107 HydrophobicContact CE2-CB 4.39Å; F103-N107 WeakPolarHBondContact CE2-ND2 3.45Å; F103-N107 WeakPolarHBondContact CZ-ND2 3.45Å; F103-N107 WeakPolarHBondContact O-CA 3.42Å; F103-N107 WeakPolarHBondContact O-CB 3.38Å; F103-N107 PolarHBondContact O-N 3.07Å; F103-A152 HydrophobicContact CZ-CB 4.45Å; F103-A152 WeakPolarHBondContact CZ-O 3.43Å; F103-L156 HydrophobicContact CD2-CD1 4.24Å; F103-L156 HydrophobicContact CE1-CB 4.38Å; F103-L156 HydrophobicContact CE1-CD1 4.38Å; F103-L156 HydrophobicContact CE2-CB 3.87Å; F103-L156 HydrophobicContact CE2-CD1 4.05Å; F103-L156 HydrophobicContact CG-CD1 4.49Å; F103-L156 HydrophobicContact CZ-CB 3.61Å; F103-L156 HydrophobicContact CZ-CD1 4.14Å; F103-L156 HydrophobicContact CZ-CG 4.35Å
104	L	89.9	Confident	84.4	Confident	109 Å²	109	80.3 Å²	80.3	57%	0.571	39%	0.394	S	S	*	.	H	α-helix	trans	-59.7	-53.4	-176.6	-172.8	68.6	0	0	0	113.2	L108	L104-L108 HydrophobicContact CD1-CD1 3.91Å; L104-L108 HydrophobicContact CD1-CG 4.22Å; L104-L108 HydrophobicContact CG-CD1 3.95Å; L104-L108 VanDerWaalsContact O-CB 3.32Å; L104-L108 WeakPolarHBondContact O-CB 3.06Å; L104-L108 VanDerWaalsContact O-CG 3.25Å; L104-L108 WeakPolarHBondContact O-CG 3.36Å; L104-L108 PolarHBondContact O-N 3.17Å
105	P	91.1	Very high	84.3	Confident	79 Å²	79	77 Å²	77	51%	0.513	39%	0.386	S	S	.	.	H	α-helix	trans	-67.4	-40.4	-177.1	23	-31.3	0	0	0	113	I101 T102 Y109	I101-P105 VanDerWaalsContact O-CD 3.31Å; I101-P105 WeakPolarHBondContact O-CD 3.46Å; T102-P105 WeakPolarHBondContact O-CD 3.33Å; P105-Y109 VanDerWaalsContact O-CB 3.23Å; P105-Y109 WeakPolarHBondContact O-CB 3.47Å; P105-Y109 PolarHBondContact O-N 2.92Å
106	L	86.6	Confident	84.5	Confident	73 Å²	73	73.9 Å²	73.9	38%	0.382	37%	0.368	S	S	.	.	H	α-helix	trans	-73.7	-39.1	-178.9	-150.8	81.1	0	0	0	111.5	Y98 T102 Y109 E110	Y98-L106 HydrophobicContact CD1-CB 4.11Å; Y98-L106 HydrophobicContact CD1-CD2 3.9Å; Y98-L106 HydrophobicContact CE1-CB 4.26Å; Y98-L106 HydrophobicContact CE1-CD2 3.98Å; Y98-L106 HydrophobicContact CE1-CG 4.46Å; T102-L106 WeakPolarHBondContact O-CB 3.09Å; T102-L106 PolarHBondContact O-N 3.01Å; L106-Y109 PolarHBondContact O-N 2.86Å; L106-E110 WeakPolarHBondContact O-CB 3.48Å; L106-E110 WeakPolarHBondContact O-CG 3.42Å; L106-E110 PolarHBondContact O-N 3.29Å
107	N	88.6	Confident	84.7	Confident	3 Å²	3	71.3 Å²	71.3	2%	0.016	36%	0.358	C	S	.	.	H	α-helix	trans	-64.8	-48	175.9	-173.5	-1.9	0	0	0	111	F103 Y109 E110 Q111 A152	F103-N107 HydrophobicContact CE2-CB 4.39Å; F103-N107 WeakPolarHBondContact CE2-ND2 3.45Å; F103-N107 WeakPolarHBondContact CZ-ND2 3.45Å; F103-N107 WeakPolarHBondContact O-CA 3.42Å; F103-N107 WeakPolarHBondContact O-CB 3.38Å; F103-N107 PolarHBondContact O-N 3.07Å; N107-Y109 VanDerWaalsContact C-N 3.32Å; N107-Y109 PolarHBondContact O-N 2.78Å; N107-E110 PolarHBondContact O-N 3.2Å; N107-E110 VanDerWaalsContact O-N 3.16Å; N107-Q111 WeakPolarHBondContact O-CG 3.25Å; N107-Q111 PolarHBondContact O-N 2.79Å; N107-Q111 PolarHBondContact OD1-NE2 3.29Å; N107-A152 WeakPolarHBondContact ND2-CA 3.37Å
108	L	88.5	Confident	85.2	Confident	63 Å²	63	70.1 Å²	70.1	33%	0.33	36%	0.357	S	S	.	.	H	α-helix	trans	-59.2	-44.9	174.8	-73	174	0	0	0	111.2	L104 E110 Q111 F112	L104-L108 HydrophobicContact CD1-CD1 3.91Å; L104-L108 HydrophobicContact CD1-CG 4.22Å; L104-L108 HydrophobicContact CG-CD1 3.95Å; L104-L108 VanDerWaalsContact O-CB 3.32Å; L104-L108 WeakPolarHBondContact O-CB 3.06Å; L104-L108 VanDerWaalsContact O-CG 3.25Å; L104-L108 WeakPolarHBondContact O-CG 3.36Å; L104-L108 PolarHBondContact O-N 3.17Å; L108-E110 VanDerWaalsContact C-N 3.32Å; L108-E110 PolarHBondContact O-N 2.86Å; L108-Q111 PolarHBondContact O-N 3.34Å; L108-F112 HydrophobicContact CB-CD2 4.47Å; L108-F112 HydrophobicContact CD2-CE2 4.34Å; L108-F112 WeakPolarHBondContact O-CD2 3.47Å; L108-F112 PolarHBondContact O-N 3.18Å
109	Y	88.1	Confident	85.4	Confident	143 Å²	143	71 Å²	71	56%	0.561	36%	0.36	S	S	*	.	H	α-helix	trans	-57	-44.7	175.4	176.7	-110.7	0	0	0	112.1	P105 L106 N107 F112 K113	P105-Y109 VanDerWaalsContact O-CB 3.23Å; P105-Y109 WeakPolarHBondContact O-CB 3.47Å; P105-Y109 PolarHBondContact O-N 2.92Å; L106-Y109 PolarHBondContact O-N 2.86Å; N107-Y109 VanDerWaalsContact C-N 3.32Å; N107-Y109 PolarHBondContact O-N 2.78Å; Y109-F112 PolarHBondContact O-N 2.71Å; Y109-K113 HydrophobicContact CE1-CD 4.46Å; Y109-K113 VanDerWaalsContact CZ-CE 3.45Å; Y109-K113 WeakPolarHBondContact O-CG 3.4Å; Y109-K113 PolarHBondContact O-N 3.27Å; Y109-K113 VanDerWaalsContact O-N 3.11Å
110	E	82.2	Confident	85.4	Confident	64 Å²	64	67.2 Å²	67.2	30%	0.299	34%	0.339	S	S	.	.	H	α-helix	trans	-65.5	-38.5	176.3	-74.9	-178.8	166.6	0	0	113.1	Y98 L106 N107 L108 K113	Y98-E110 PolarHBondContact OH-OE2 3.42Å; L106-E110 WeakPolarHBondContact O-CB 3.48Å; L106-E110 WeakPolarHBondContact O-CG 3.42Å; L106-E110 PolarHBondContact O-N 3.29Å; N107-E110 PolarHBondContact O-N 3.2Å; N107-E110 VanDerWaalsContact O-N 3.16Å; L108-E110 VanDerWaalsContact C-N 3.32Å; L108-E110 PolarHBondContact O-N 2.86Å; E110-K113 WeakPolarHBondContact O-CB 3.42Å; E110-K113 PolarHBondContact O-N 3.38Å
111	Q	84.3	Confident	85.6	Confident	6 Å²	6	64.1 Å²	64.1	3%	0.028	32%	0.318	C	S	.	.	H	α-helix	trans	-67.1	-39.5	175.2	-69	-175.8	27.5	0	0	111.5	N107 L108 K113 R114 N117 L148 T151	N107-Q111 WeakPolarHBondContact O-CG 3.25Å; N107-Q111 PolarHBondContact O-N 2.79Å; N107-Q111 PolarHBondContact OD1-NE2 3.29Å; L108-Q111 PolarHBondContact O-N 3.34Å; Q111-K113 VanDerWaalsContact C-N 3.28Å; Q111-K113 PolarHBondContact O-N 3.48Å; Q111-R114 WeakPolarHBondContact O-CB 3.44Å; Q111-R114 WeakPolarHBondContact O-CG 3.48Å; Q111-R114 PolarHBondContact O-N 2.97Å; Q111-R114 VanDerWaalsContact O-N 3.16Å; Q111-N117 PolarHBondContact O-ND2 2.78Å; Q111-L148 HydrophobicContact CB-CD2 4.19Å; Q111-L148 PolarHBondContact OE1-O 3.37Å; Q111-T151 HydrophobicContact CG-CG2 4.27Å
112	F	85.6	Confident	85.6	Confident	54 Å²	54	59.4 Å²	59.4	24%	0.237	30%	0.301	C	S	.	.	H	α-helix	trans	-76.9	-6.7	177.3	-78.7	-70.4	0	0	0	114.2	L108 Y109 R114 N117 I118 L121 L148	L108-F112 HydrophobicContact CB-CD2 4.47Å; L108-F112 HydrophobicContact CD2-CE2 4.34Å; L108-F112 WeakPolarHBondContact O-CD2 3.47Å; L108-F112 PolarHBondContact O-N 3.18Å; Y109-F112 PolarHBondContact O-N 2.71Å; F112-R114 PolarHBondContact O-N 3.3Å; F112-N117 HydrophobicContact CD1-CB 3.81Å; F112-N117 HydrophobicContact CE1-CB 4.05Å; F112-I118 VanDerWaalsContact O-CD1 3.3Å; F112-I118 WeakPolarHBondContact O-CD1 3.47Å; F112-I118 WeakPolarHBondContact O-CG1 3.42Å; F112-L121 HydrophobicContact CD1-CD2 4.33Å; F112-L121 HydrophobicContact CE1-CB 4.03Å; F112-L121 HydrophobicContact CE1-CD2 4.01Å; F112-L121 HydrophobicContact CE1-CG 4.49Å; F112-L148 HydrophobicContact CE2-CD1 4.29Å; F112-L148 HydrophobicContact CZ-CD1 3.95Å
113	K	81.7	Confident	85.6	Confident	127 Å²	127	56.6 Å²	56.6	55%	0.552	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-15.5	163.3	-72	178.2	-178.7	180	0	112.6	Y109 E110 Q111	Y109-K113 HydrophobicContact CE1-CD 4.46Å; Y109-K113 VanDerWaalsContact CZ-CE 3.45Å; Y109-K113 WeakPolarHBondContact O-CG 3.4Å; Y109-K113 PolarHBondContact O-N 3.27Å; Y109-K113 VanDerWaalsContact O-N 3.11Å; E110-K113 WeakPolarHBondContact O-CB 3.42Å; E110-K113 PolarHBondContact O-N 3.38Å; Q111-K113 VanDerWaalsContact C-N 3.28Å; Q111-K113 PolarHBondContact O-N 3.48Å
114	R	76.4	Confident	85.5	Confident	96 Å²	96	56.5 Å²	56.5	36%	0.362	28%	0.284	S	S	.	.	S	Bend	trans	-80.3	125	175.2	-57.9	-177.5	-174.6	-167.2	4.3	109.9	Q111 F112 A116 N117 I118 E405	Q111-R114 WeakPolarHBondContact O-CB 3.44Å; Q111-R114 WeakPolarHBondContact O-CG 3.48Å; Q111-R114 PolarHBondContact O-N 2.97Å; Q111-R114 VanDerWaalsContact O-N 3.16Å; F112-R114 PolarHBondContact O-N 3.3Å; R114-A116 VanDerWaalsContact C-N 3.25Å; R114-A116 PolarHBondContact O-N 3.04Å; R114-N117 PolarHBondContact O-N 3.41Å; R114-I118 PolarHBondContact O-N 3.18Å; R114-E405 IonicContact CZ-OE1 3.63Å; R114-E405 IonicContact NH1-OE1 3.96Å; R114-E405 PolarHBondContact NH1-OE1 3.21Å; R114-E405 IonicContact NH2-OE1 2.72Å; R114-E405 PolarHBondContact NH2-OE1 3.47Å
115	V	78.4	Confident	85.6	Confident	82 Å²	82	56.1 Å²	56.1	50%	0.497	28%	0.282	S	S	.	.	H	α-helix	trans	-56.2	-37.2	-176.7	-178.4	0	0	0	0	112.9	N117 I118 Y119 Y338	V115-N117 VanDerWaalsContact C-N 3.34Å; V115-N117 PolarHBondContact O-N 3.28Å; V115-I118 PolarHBondContact O-N 3Å; V115-Y119 PolarHBondContact O-N 3.43Å; V115-Y338 HydrophobicContact CG1-CE1 4.13Å
116	A	78.3	Confident	85.5	Confident	7 Å²	7	54.1 Å²	54.1	6%	0.058	27%	0.266	C	S	.	.	H	α-helix	trans	-61.3	-40.3	177.6	0	0	0	0	0	112.8	R114 I118 Y119 F120 Y401	R114-A116 VanDerWaalsContact C-N 3.25Å; R114-A116 PolarHBondContact O-N 3.04Å; A116-I118 VanDerWaalsContact C-N 3.34Å; A116-Y119 WeakPolarHBondContact O-CB 3.26Å; A116-Y119 PolarHBondContact O-N 3.47Å; A116-F120 HydrophobicContact CB-CE2 4.32Å; A116-F120 WeakPolarHBondContact O-CD2 3.38Å; A116-F120 PolarHBondContact O-N 3.15Å; A116-Y401 HydrophobicContact CB-CD2 4.2Å; A116-Y401 HydrophobicContact CB-CE2 3.5Å
117	N	83.7	Confident	85.6	Confident	13 Å²	13	50.9 Å²	50.9	7%	0.07	25%	0.249	C	C	.	.	H	α-helix	trans	-68.9	-35.8	179.1	-69.6	-15.5	0	0	0	111.4	Q111 F112 R114 V115 Y119 F120 L121	Q111-N117 PolarHBondContact O-ND2 2.78Å; F112-N117 HydrophobicContact CD1-CB 3.81Å; F112-N117 HydrophobicContact CE1-CB 4.05Å; R114-N117 PolarHBondContact O-N 3.41Å; V115-N117 VanDerWaalsContact C-N 3.34Å; V115-N117 PolarHBondContact O-N 3.28Å; N117-Y119 VanDerWaalsContact C-N 3.35Å; N117-F120 PolarHBondContact O-N 3.32Å; N117-L121 WeakPolarHBondContact O-CB 3.21Å; N117-L121 PolarHBondContact O-N 2.98Å
118	I	86.3	Confident	85.5	Confident	89 Å²	89	56.3 Å²	56.3	46%	0.456	28%	0.277	S	S	.	.	H	α-helix	trans	-62.8	-43	172.2	-58.7	175.3	0	0	0	110.5	F112 R114 V115 A116 L121 A122	F112-I118 VanDerWaalsContact O-CD1 3.3Å; F112-I118 WeakPolarHBondContact O-CD1 3.47Å; F112-I118 WeakPolarHBondContact O-CG1 3.42Å; R114-I118 PolarHBondContact O-N 3.18Å; V115-I118 PolarHBondContact O-N 3Å; A116-I118 VanDerWaalsContact C-N 3.34Å; I118-L121 PolarHBondContact O-N 3.22Å; I118-A122 PolarHBondContact O-N 3.33Å
119	Y	85.9	Confident	85.5	Confident	29 Å²	29	56.6 Å²	56.6	11%	0.114	28%	0.278	C	S	.	.	H	α-helix	trans	-60	-47.3	177.3	165.5	-104.1	0	0	0	112.4	V115 A116 N117 L121 A122 L123 F341 L344 V396	V115-Y119 PolarHBondContact O-N 3.43Å; A116-Y119 WeakPolarHBondContact O-CB 3.26Å; A116-Y119 PolarHBondContact O-N 3.47Å; N117-Y119 VanDerWaalsContact C-N 3.35Å; Y119-L121 VanDerWaalsContact C-N 3.33Å; Y119-L121 PolarHBondContact O-N 3.03Å; Y119-A122 PolarHBondContact O-N 3.49Å; Y119-L123 HydrophobicContact CD1-CD1 4.07Å; Y119-L123 HydrophobicContact CD2-CD1 4.47Å; Y119-L123 HydrophobicContact CD2-CG 4.45Å; Y119-L123 HydrophobicContact CE1-CD1 3.43Å; Y119-L123 VanDerWaalsContact CE1-CD1 3.43Å; Y119-L123 HydrophobicContact CE1-CG 4.37Å; Y119-L123 HydrophobicContact CE2-CD1 3.87Å; Y119-L123 HydrophobicContact CE2-CD2 4.35Å; Y119-L123 HydrophobicContact CE2-CG 4.01Å; Y119-L123 PolarHBondContact O-N 3.32Å; Y119-F341 HydrophobicContact CD2-CD2 4Å; Y119-F341 AromaticContact CD2-CE2 3.65Å; Y119-F341 HydrophobicContact CD2-CE2 3.65Å; Y119-F341 AromaticContact CE2-CD2 3.78Å; Y119-F341 HydrophobicContact CE2-CD2 3.78Å; Y119-F341 AromaticContact CE2-CE2 3.53Å; Y119-F341 HydrophobicContact CE2-CE2 3.53Å; Y119-L344 WeakPolarHBondContact OH-CD2 3.29Å; Y119-V396 HydrophobicContact CD1-CB 4.44Å; Y119-V396 HydrophobicContact CD1-CG1 4.12Å; Y119-V396 HydrophobicContact CE1-CB 3.72Å; Y119-V396 HydrophobicContact CE1-CG1 3.9Å; Y119-V396 HydrophobicContact CE1-CG2 4.12Å
120	F	86.6	Confident	85.4	Confident	2 Å²	2	55.1 Å²	55.1	1%	0.009	29%	0.286	C	S	.	.	H	α-helix	trans	-68.4	-32	178.2	-63.7	-57.8	0	0	0	113.2	A116 N117 L123 L124 L144 V396 I398	A116-F120 HydrophobicContact CB-CE2 4.32Å; A116-F120 WeakPolarHBondContact O-CD2 3.38Å; A116-F120 PolarHBondContact O-N 3.15Å; N117-F120 PolarHBondContact O-N 3.32Å; F120-L123 HydrophobicContact CD1-CD1 4Å; F120-L123 HydrophobicContact CE1-CD1 4.45Å; F120-L123 PolarHBondContact O-N 2.99Å; F120-L124 WeakPolarHBondContact O-CB 3.37Å; F120-L124 PolarHBondContact O-N 3.41Å; F120-L144 HydrophobicContact CB-CD1 4.13Å; F120-L144 HydrophobicContact CB-CD2 4.31Å; F120-V396 WeakPolarHBondContact CE1-O 3.49Å; F120-V396 HydrophobicContact CZ-CB 4.47Å; F120-V396 HydrophobicContact CZ-CG1 3.94Å; F120-V396 VanDerWaalsContact CZ-O 3.25Å; F120-V396 WeakPolarHBondContact CZ-O 3.42Å; F120-I398 HydrophobicContact CD1-CD1 3.9Å; F120-I398 HydrophobicContact CD1-CG1 3.45Å; F120-I398 VanDerWaalsContact CD1-CG1 3.45Å; F120-I398 HydrophobicContact CD2-CB 4.43Å; F120-I398 HydrophobicContact CD2-CG1 3.92Å; F120-I398 HydrophobicContact CD2-CG2 4.2Å; F120-I398 HydrophobicContact CE1-CB 4.27Å; F120-I398 HydrophobicContact CE1-CD1 3.94Å; F120-I398 HydrophobicContact CE1-CG1 3.11Å; F120-I398 HydrophobicContact CE2-CB 3.97Å; F120-I398 HydrophobicContact CE2-CG1 3.62Å; F120-I398 HydrophobicContact CE2-CG2 4.14Å; F120-I398 HydrophobicContact CG-CD1 4.4Å; F120-I398 HydrophobicContact CG-CG1 3.86Å; F120-I398 HydrophobicContact CZ-CB 3.89Å; F120-I398 HydrophobicContact CZ-CD1 4.45Å; F120-I398 HydrophobicContact CZ-CG1 3.2Å
121	L	87.9	Confident	85.3	Confident	69 Å²	69	56.4 Å²	56.4	36%	0.361	30%	0.295	S	S	.	.	H	α-helix	trans	-64.9	-43.8	171.8	-177.2	63.6	0	0	0	111.4	F112 N117 I118 Y119 L123 L124 I125	F112-L121 HydrophobicContact CD1-CD2 4.33Å; F112-L121 HydrophobicContact CE1-CB 4.03Å; F112-L121 HydrophobicContact CE1-CD2 4.01Å; F112-L121 HydrophobicContact CE1-CG 4.49Å; N117-L121 WeakPolarHBondContact O-CB 3.21Å; N117-L121 PolarHBondContact O-N 2.98Å; I118-L121 PolarHBondContact O-N 3.22Å; Y119-L121 VanDerWaalsContact C-N 3.33Å; Y119-L121 PolarHBondContact O-N 3.03Å; L121-L123 VanDerWaalsContact C-N 3.33Å; L121-L123 PolarHBondContact O-N 3.16Å; L121-L124 PolarHBondContact O-N 3.18Å; L121-I125 HydrophobicContact CG-CD1 4.4Å; L121-I125 WeakPolarHBondContact O-CG1 3.35Å; L121-I125 PolarHBondContact O-N 3.47Å
122	A	89.2	Confident	85.4	Confident	46 Å²	46	57 Å²	57	38%	0.38	30%	0.298	S	S	.	.	H	α-helix	trans	-62.1	-41.1	175.5	0	0	0	0	0	111.8	I118 Y119 I125 L126	I118-A122 PolarHBondContact O-N 3.33Å; Y119-A122 PolarHBondContact O-N 3.49Å; A122-I125 PolarHBondContact O-N 3.49Å; A122-L126 WeakPolarHBondContact O-CG 3.42Å; A122-L126 PolarHBondContact O-N 3.23Å
123	L	88.3	Confident	85.4	Confident	3 Å²	3	56.3 Å²	56.3	2%	0.016	30%	0.3	C	S	.	.	H	α-helix	trans	-62.4	-41.8	174	-76.7	176	0	0	0	113	Y119 F120 L121 I125 L126 Q127 I389 N393	Y119-L123 HydrophobicContact CD1-CD1 4.07Å; Y119-L123 HydrophobicContact CD2-CD1 4.47Å; Y119-L123 HydrophobicContact CD2-CG 4.45Å; Y119-L123 HydrophobicContact CE1-CD1 3.43Å; Y119-L123 VanDerWaalsContact CE1-CD1 3.43Å; Y119-L123 HydrophobicContact CE1-CG 4.37Å; Y119-L123 HydrophobicContact CE2-CD1 3.87Å; Y119-L123 HydrophobicContact CE2-CD2 4.35Å; Y119-L123 HydrophobicContact CE2-CG 4.01Å; Y119-L123 PolarHBondContact O-N 3.32Å; F120-L123 HydrophobicContact CD1-CD1 4Å; F120-L123 HydrophobicContact CE1-CD1 4.45Å; F120-L123 PolarHBondContact O-N 2.99Å; L121-L123 VanDerWaalsContact C-N 3.33Å; L121-L123 PolarHBondContact O-N 3.16Å; L123-I125 VanDerWaalsContact C-N 3.28Å; L123-I125 PolarHBondContact O-N 3.03Å; L123-L126 HydrophobicContact CD2-CD1 4.48Å; L123-L126 PolarHBondContact O-N 3.34Å; L123-L126 VanDerWaalsContact O-N 3.16Å; L123-Q127 WeakPolarHBondContact O-CG 3.09Å; L123-Q127 PolarHBondContact O-N 2.96Å; L123-I389 HydrophobicContact CD2-CG2 3.88Å; L123-N393 HydrophobicContact CD1-CB 3.67Å; L123-N393 HydrophobicContact CD2-CB 4.48Å
124	L	89	Confident	85.5	Confident	29 Å²	29	52.4 Å²	52.4	15%	0.152	29%	0.287	C	S	.	.	H	α-helix	trans	-60.8	-41.5	176.3	-174.8	72	0	0	0	110.9	F120 L121 L126 Q127 I128 W137 L141	F120-L124 WeakPolarHBondContact O-CB 3.37Å; F120-L124 PolarHBondContact O-N 3.41Å; L121-L124 PolarHBondContact O-N 3.18Å; L124-L126 VanDerWaalsContact C-N 3.33Å; L124-L126 PolarHBondContact O-N 3.05Å; L124-Q127 PolarHBondContact O-N 3.4Å; L124-I128 WeakPolarHBondContact O-CG1 3.39Å; L124-I128 PolarHBondContact O-N 3.35Å; L124-W137 HydrophobicContact CD1-CB 4.5Å; L124-L141 HydrophobicContact CD1-CB 3.94Å; L124-L141 HydrophobicContact CD1-CD1 4.4Å; L124-L141 HydrophobicContact CD2-CD1 3.83Å
125	I	90.3	Very high	85.9	Confident	102 Å²	102	48 Å²	48	52%	0.523	27%	0.27	S	S	.	.	H	α-helix	trans	-62.3	-41.7	175	-65.9	165.3	0	0	0	110.8	L121 A122 L123 I128	L121-I125 HydrophobicContact CG-CD1 4.4Å; L121-I125 WeakPolarHBondContact O-CG1 3.35Å; L121-I125 PolarHBondContact O-N 3.47Å; A122-I125 PolarHBondContact O-N 3.49Å; L123-I125 VanDerWaalsContact C-N 3.28Å; L123-I125 PolarHBondContact O-N 3.03Å; I125-I128 PolarHBondContact O-N 2.87Å
126	L	89.3	Confident	86.3	Confident	37 Å²	37	45.7 Å²	45.7	19%	0.194	26%	0.257	C	S	.	.	H	α-helix	trans	-65.7	-37.6	176.9	-69.2	169.5	0	0	0	112.6	A122 L123 L124 I128 I129 W386	A122-L126 WeakPolarHBondContact O-CG 3.42Å; A122-L126 PolarHBondContact O-N 3.23Å; L123-L126 HydrophobicContact CD2-CD1 4.48Å; L123-L126 PolarHBondContact O-N 3.34Å; L123-L126 VanDerWaalsContact O-N 3.16Å; L124-L126 VanDerWaalsContact C-N 3.33Å; L124-L126 PolarHBondContact O-N 3.05Å; L126-I128 PolarHBondContact O-N 2.73Å; L126-I129 WeakPolarHBondContact O-CB 3.23Å; L126-I129 PolarHBondContact O-N 3.44Å; L126-I129 VanDerWaalsContact O-N 3.14Å; L126-W386 HydrophobicContact CD1-CE3 3.75Å; L126-W386 HydrophobicContact CD1-CZ3 3.61Å; L126-W386 HydrophobicContact CD2-CE3 4.2Å; L126-W386 HydrophobicContact CD2-CZ3 4.27Å
127	Q	89.1	Confident	86.7	Confident	5 Å²	5	52.3 Å²	52.3	2%	0.023	28%	0.281	C	S	.	.	H	α-helix	trans	-68.4	-17.3	177.7	-76.3	170.8	-3.4	0	0	114.1	L123 L124 S133 T140 I390 N393	L123-Q127 WeakPolarHBondContact O-CG 3.09Å; L123-Q127 PolarHBondContact O-N 2.96Å; L124-Q127 PolarHBondContact O-N 3.4Å; Q127-S133 VanDerWaalsContact O-CB 3.29Å; Q127-S133 WeakPolarHBondContact O-CB 3.47Å; Q127-S133 PolarHBondContact O-OG 2.88Å; Q127-T140 PolarHBondContact NE2-OG1 3.28Å; Q127-T140 PolarHBondContact OE1-OG1 2.78Å; Q127-I390 HydrophobicContact CG-CD1 3.92Å; Q127-I390 HydrophobicContact CG-CG1 4.16Å; Q127-I390 HydrophobicContact CG-CG2 4.01Å; Q127-N393 PolarHBondContact NE2-ND2 2.95Å
128	I	87.3	Confident	86.8	Confident	116 Å²	116	55 Å²	55	60%	0.595	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.1	-21.6	173.9	-67.5	167.2	0	0	0	111	L124 I125 L126 P130	L124-I128 WeakPolarHBondContact O-CG1 3.39Å; L124-I128 PolarHBondContact O-N 3.35Å; I125-I128 PolarHBondContact O-N 2.87Å; L126-I128 PolarHBondContact O-N 2.73Å; I128-P130 VanDerWaalsContact O-CD 3.26Å; I128-P130 WeakPolarHBondContact O-CD 3.47Å
129	I	88.6	Confident	86.8	Confident	70 Å²	70	51.1 Å²	51.1	36%	0.359	27%	0.271	S	S	.	.			trans	-80.3	112	-179.1	-56	174.9	0	0	0	109.7	L126 D131 I132 S133	L126-I129 WeakPolarHBondContact O-CB 3.23Å; L126-I129 PolarHBondContact O-N 3.44Å; L126-I129 VanDerWaalsContact O-N 3.14Å; I129-D131 VanDerWaalsContact C-N 3.33Å; I129-D131 PolarHBondContact O-N 2.71Å; I129-I132 HydrophobicContact CD1-CD1 4.43Å; I129-I132 HydrophobicContact CG2-CB 4.44Å; I129-I132 HydrophobicContact CG2-CD1 4.11Å; I129-I132 HydrophobicContact CG2-CG1 4.26Å; I129-I132 PolarHBondContact O-N 2.87Å; I129-S133 VanDerWaalsContact O-CB 3.32Å; I129-S133 WeakPolarHBondContact O-CB 3.44Å; I129-S133 PolarHBondContact O-N 2.99Å
130	P	84.4	Confident	86.7	Confident	111 Å²	111	49.9 Å²	49.9	72%	0.721	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-32.9	-172.3	-23.2	34.6	0	0	0	114.5	I128 I132	I128-P130 VanDerWaalsContact O-CD 3.26Å; I128-P130 WeakPolarHBondContact O-CD 3.47Å; P130-I132 PolarHBondContact O-N 2.66Å
131	D	81.3	Confident	86.8	Confident	91 Å²	91	52.5 Å²	52.5	49%	0.487	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72	-13.3	-177.7	-66	-55.4	0	0	0	113.9	I129 K373 L383	I129-D131 VanDerWaalsContact C-N 3.33Å; I129-D131 PolarHBondContact O-N 2.71Å; D131-K373 IonicContact OD1-NZ 3.33Å; D131-L383 HydrophobicContact CB-CD2 4.44Å
132	I	86.1	Confident	86.7	Confident	18 Å²	18	54 Å²	54	9%	0.092	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-115.9	-24.9	-176.6	-65.2	173.8	0	0	0	111.3	I129 P130 T134 L383 W386 I390	I129-I132 HydrophobicContact CD1-CD1 4.43Å; I129-I132 HydrophobicContact CG2-CB 4.44Å; I129-I132 HydrophobicContact CG2-CD1 4.11Å; I129-I132 HydrophobicContact CG2-CG1 4.26Å; I129-I132 PolarHBondContact O-N 2.87Å; P130-I132 PolarHBondContact O-N 2.66Å; I132-T134 PolarHBondContact O-N 2.97Å; I132-T134 VanDerWaalsContact O-N 3.09Å; I132-L383 HydrophobicContact CD1-CD2 4.23Å; I132-L383 HydrophobicContact CG1-CD2 3.67Å; I132-W386 HydrophobicContact CB-CB 4.43Å; I132-W386 HydrophobicContact CD1-CB 4.16Å; I132-W386 HydrophobicContact CD1-CG 4.31Å; I132-W386 HydrophobicContact CG1-CB 4.34Å; I132-W386 HydrophobicContact CG2-CB 3.27Å; I132-W386 HydrophobicContact CG2-CG 4.37Å; I132-I390 HydrophobicContact CG2-CD1 3.81Å
133	S	85.4	Confident	86.4	Confident	40 Å²	40	52.7 Å²	52.7	28%	0.28	27%	0.271	S	S	.	.			trans	-71.8	103.5	-171.3	-163	0	0	0	0	112.1	Q127 I129 L135	Q127-S133 VanDerWaalsContact O-CB 3.29Å; Q127-S133 WeakPolarHBondContact O-CB 3.47Å; Q127-S133 PolarHBondContact O-OG 2.88Å; I129-S133 VanDerWaalsContact O-CB 3.32Å; I129-S133 WeakPolarHBondContact O-CB 3.44Å; I129-S133 PolarHBondContact O-N 2.99Å; S133-L135 PolarHBondContact OG-O 2.95Å
134	T	83.3	Confident	86.3	Confident	45 Å²	45	52.8 Å²	52.8	28%	0.276	27%	0.272	S	S	.	.	S	Bend	trans	-90.3	-16.5	174.2	49.1	0	0	0	0	113	I132 G387 I390 V391	I132-T134 PolarHBondContact O-N 2.97Å; I132-T134 VanDerWaalsContact O-N 3.09Å; T134-G387 PolarHBondContact OG1-O 3.29Å; T134-I390 WeakPolarHBondContact OG1-CG2 3.28Å; T134-V391 HydrophobicContact CG2-CG2 4.34Å; T134-V391 VanDerWaalsContact OG1-CG2 3.29Å; T134-V391 WeakPolarHBondContact OG1-CG2 3.45Å
135	L	84.8	Confident	86.2	Confident	3 Å²	3	55.5 Å²	55.5	2%	0.016	29%	0.29	C	S	.	.	S	Bend	trans	-127.4	139.6	179.6	-75.7	172.3	0	0	0	109.9	S133 I390 T972 I979	S133-L135 PolarHBondContact OG-O 2.95Å; L135-I390 HydrophobicContact CB-CG2 3.87Å; L135-I390 HydrophobicContact CD1-CG2 4.02Å; L135-I390 HydrophobicContact CG-CG2 4.18Å; L135-T972 HydrophobicContact CD2-CG2 3.54Å; L135-T972 HydrophobicContact CG-CG2 4.12Å; L135-I979 HydrophobicContact CD2-CD1 3.62Å
136	P	87	Confident	86	Confident	34 Å²	34	53.2 Å²	53.2	22%	0.221	28%	0.278	C	S	.	.			trans	-59.7	142.7	174.8	-24.9	35	0	0	0	112.6	Y138 T139 D976	P136-Y138 HydrophobicContact CB-CD1 3.52Å; P136-Y138 HydrophobicContact CB-CD2 4.32Å; P136-Y138 HydrophobicContact CB-CE1 3.13Å; P136-Y138 HydrophobicContact CB-CE2 3.98Å; P136-Y138 HydrophobicContact CB-CG 4.11Å; P136-Y138 HydrophobicContact CG-CE1 3.78Å; P136-Y138 HydrophobicContact CG-CE2 4.34Å; P136-Y138 WeakPolarHBondContact CG-OH 3.17Å; P136-Y138 PolarHBondContact O-N 3.13Å; P136-T139 HydrophobicContact CB-CG2 4.4Å; P136-T139 WeakPolarHBondContact O-CB 3.49Å; P136-T139 VanDerWaalsContact O-CG2 3.32Å; P136-T139 WeakPolarHBondContact O-CG2 3.43Å; P136-T139 PolarHBondContact O-N 2.88Å; P136-T139 PolarHBondContact O-OG1 2.69Å; P136-D976 WeakPolarHBondContact CG-OD2 3.36Å
137	W	86.9	Confident	85.7	Confident	147 Å²	147	52 Å²	52	56%	0.557	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.4	-27.6	-178.4	58.3	-95.2	0	0	0	114	L124 T139 T140 L141	L124-W137 HydrophobicContact CD1-CB 4.5Å; W137-T139 PolarHBondContact O-N 3.34Å; W137-T140 PolarHBondContact O-N 2.77Å; W137-L141 HydrophobicContact CE3-CB 4.28Å; W137-L141 HydrophobicContact CE3-CD2 3.81Å; W137-L141 HydrophobicContact CZ3-CD2 3.56Å; W137-L141 WeakPolarHBondContact O-CB 3.48Å; W137-L141 PolarHBondContact O-N 2.92Å; W137-L141 VanDerWaalsContact O-N 3.12Å
138	Y	86.1	Confident	85.6	Confident	68 Å²	68	52.7 Å²	52.7	27%	0.267	28%	0.276	S	S	.	.	H	α-helix	trans	-66.2	-25.6	179.6	58.5	-108.7	0	0	0	113	P136 T140 F142 D976	P136-Y138 HydrophobicContact CB-CD1 3.52Å; P136-Y138 HydrophobicContact CB-CD2 4.32Å; P136-Y138 HydrophobicContact CB-CE1 3.13Å; P136-Y138 HydrophobicContact CB-CE2 3.98Å; P136-Y138 HydrophobicContact CB-CG 4.11Å; P136-Y138 HydrophobicContact CG-CE1 3.78Å; P136-Y138 HydrophobicContact CG-CE2 4.34Å; P136-Y138 WeakPolarHBondContact CG-OH 3.17Å; P136-Y138 PolarHBondContact O-N 3.13Å; Y138-T140 PolarHBondContact O-N 2.9Å; Y138-F142 VanDerWaalsContact O-CB 3.28Å; Y138-F142 WeakPolarHBondContact O-CB 3.42Å; Y138-F142 PolarHBondContact O-N 2.87Å; Y138-F142 VanDerWaalsContact O-N 3.09Å; Y138-D976 HydrophobicContact CE2-CB 4.46Å
139	T	85.4	Confident	85.7	Confident	9 Å²	9	48.6 Å²	48.6	6%	0.055	26%	0.262	C	S	.	.	H	α-helix	trans	-63.3	-29.9	-179	63.1	0	0	0	0	112.4	P136 W137 P143 T980	P136-T139 HydrophobicContact CB-CG2 4.4Å; P136-T139 WeakPolarHBondContact O-CB 3.49Å; P136-T139 VanDerWaalsContact O-CG2 3.32Å; P136-T139 WeakPolarHBondContact O-CG2 3.43Å; P136-T139 PolarHBondContact O-N 2.88Å; P136-T139 PolarHBondContact O-OG1 2.69Å; W137-T139 PolarHBondContact O-N 3.34Å; T139-P143 VanDerWaalsContact O-CD 3.22Å; T139-P143 WeakPolarHBondContact O-CD 3.48Å; T139-P143 WeakPolarHBondContact O-CG 3.49Å; T139-T980 WeakPolarHBondContact CA-OG1 3.37Å; T139-T980 WeakPolarHBondContact CG2-OG1 3.42Å
140	T	85.1	Confident	85.5	Confident	2 Å²	2	48.7 Å²	48.7	1%	0.012	26%	0.262	C	S	.	.	H	α-helix	trans	-102.7	-37.5	179.3	-57.3	0	0	0	0	112	Q127 W137 Y138 L144 N393 I398	Q127-T140 PolarHBondContact NE2-OG1 3.28Å; Q127-T140 PolarHBondContact OE1-OG1 2.78Å; W137-T140 PolarHBondContact O-N 2.77Å; Y138-T140 PolarHBondContact O-N 2.9Å; T140-L144 WeakPolarHBondContact O-CB 3.21Å; T140-L144 PolarHBondContact O-N 2.64Å; T140-N393 PolarHBondContact OG1-ND2 3.26Å; T140-I398 HydrophobicContact CG2-CD1 4.32Å
141	L	87.6	Confident	85.3	Confident	57 Å²	57	43.6 Å²	43.6	30%	0.298	23%	0.229	S	C	.	.	H	α-helix	trans	-63	-45.4	179.2	-175.7	68.8	0	0	0	112.1	L124 W137 L144 V145	L124-L141 HydrophobicContact CD1-CB 3.94Å; L124-L141 HydrophobicContact CD1-CD1 4.4Å; L124-L141 HydrophobicContact CD2-CD1 3.83Å; W137-L141 HydrophobicContact CE3-CB 4.28Å; W137-L141 HydrophobicContact CE3-CD2 3.81Å; W137-L141 HydrophobicContact CZ3-CD2 3.56Å; W137-L141 WeakPolarHBondContact O-CB 3.48Å; W137-L141 PolarHBondContact O-N 2.92Å; W137-L141 VanDerWaalsContact O-N 3.12Å; L141-L144 PolarHBondContact O-N 3.4Å; L141-V145 HydrophobicContact CD1-CG2 3.85Å; L141-V145 HydrophobicContact CG-CG2 4.02Å; L141-V145 WeakPolarHBondContact O-CG2 3.07Å; L141-V145 PolarHBondContact O-N 2.98Å
142	F	86.4	Confident	85.6	Confident	102 Å²	102	40.3 Å²	40.3	45%	0.447	22%	0.215	S	C	.	.	H	α-helix	trans	-63.1	-49.7	-173.6	-179.2	-99.8	0	0	0	112.5	Y138 L144 V145 I146 T980 L984	Y138-F142 VanDerWaalsContact O-CB 3.28Å; Y138-F142 WeakPolarHBondContact O-CB 3.42Å; Y138-F142 PolarHBondContact O-N 2.87Å; Y138-F142 VanDerWaalsContact O-N 3.09Å; F142-L144 VanDerWaalsContact C-N 3.34Å; F142-L144 PolarHBondContact O-N 3.25Å; F142-V145 PolarHBondContact O-N 2.79Å; F142-I146 HydrophobicContact CD1-CD1 3.87Å; F142-I146 HydrophobicContact CD2-CD1 4.41Å; F142-I146 HydrophobicContact CE1-CD1 3.44Å; F142-I146 VanDerWaalsContact CE1-CD1 3.44Å; F142-I146 HydrophobicContact CE2-CD1 4.03Å; F142-I146 HydrophobicContact CG-CD1 4.35Å; F142-I146 HydrophobicContact CZ-CD1 3.54Å; F142-I146 WeakPolarHBondContact O-CG1 3.46Å; F142-I146 PolarHBondContact O-N 2.82Å; F142-T980 HydrophobicContact CD1-CG2 4.15Å; F142-L984 HydrophobicContact CD1-CD2 4.05Å; F142-L984 HydrophobicContact CE1-CD2 3.48Å; F142-L984 VanDerWaalsContact CE1-CD2 3.48Å; F142-L984 HydrophobicContact CZ-CD2 4.49Å
143	P	82.7	Confident	85.7	Confident	17 Å²	17	44.7 Å²	44.7	11%	0.11	24%	0.237	C	C	.	.	H	α-helix	trans	-59.7	-40.7	172.4	-25	35.2	0	0	0	113.4	T139 I146 V147 I398 T980	T139-P143 VanDerWaalsContact O-CD 3.22Å; T139-P143 WeakPolarHBondContact O-CD 3.48Å; T139-P143 WeakPolarHBondContact O-CG 3.49Å; P143-I146 PolarHBondContact O-N 2.89Å; P143-V147 VanDerWaalsContact O-CB 3.31Å; P143-V147 WeakPolarHBondContact O-CB 3.21Å; P143-V147 VanDerWaalsContact O-CG2 3.24Å; P143-V147 WeakPolarHBondContact O-CG2 3.36Å; P143-V147 PolarHBondContact O-N 2.78Å; P143-I398 HydrophobicContact CB-CD1 4.03Å; P143-I398 HydrophobicContact CB-CG2 4.41Å; P143-T980 HydrophobicContact CG-CG2 4.43Å
144	L	85.6	Confident	85.6	Confident	6 Å²	6	44.8 Å²	44.8	3%	0.031	23%	0.233	C	C	.	.	H	α-helix	trans	-63.8	-46.2	-178.9	-177.4	64	0	0	0	111.8	F120 T140 L141 F142 I146 V147 L148	F120-L144 HydrophobicContact CB-CD1 4.13Å; F120-L144 HydrophobicContact CB-CD2 4.31Å; T140-L144 WeakPolarHBondContact O-CB 3.21Å; T140-L144 PolarHBondContact O-N 2.64Å; L141-L144 PolarHBondContact O-N 3.4Å; F142-L144 VanDerWaalsContact C-N 3.34Å; F142-L144 PolarHBondContact O-N 3.25Å; L144-I146 PolarHBondContact O-N 3.26Å; L144-V147 PolarHBondContact O-N 3.33Å; L144-L148 HydrophobicContact CD1-CD1 4.02Å; L144-L148 HydrophobicContact CD1-CD2 4.49Å; L144-L148 HydrophobicContact CD1-CG 4.11Å; L144-L148 HydrophobicContact CG-CD1 3.91Å; L144-L148 HydrophobicContact CG-CG 4.36Å; L144-L148 VanDerWaalsContact O-CG 3.28Å; L144-L148 WeakPolarHBondContact O-CG 3.37Å; L144-L148 PolarHBondContact O-N 2.83Å
145	V	88.5	Confident	85.5	Confident	86 Å²	86	44.2 Å²	44.2	52%	0.521	23%	0.228	S	C	.	.	H	α-helix	trans	-62.7	-43	179	169.7	0	0	0	0	111.4	L141 F142 V147 G149	L141-V145 HydrophobicContact CD1-CG2 3.85Å; L141-V145 HydrophobicContact CG-CG2 4.02Å; L141-V145 WeakPolarHBondContact O-CG2 3.07Å; L141-V145 PolarHBondContact O-N 2.98Å; F142-V145 PolarHBondContact O-N 2.79Å; V145-V147 VanDerWaalsContact C-N 3.32Å; V145-V147 PolarHBondContact O-N 3.06Å; V145-G149 PolarHBondContact O-N 2.8Å
146	I	85.7	Confident	85.6	Confident	53 Å²	53	47.3 Å²	47.3	27%	0.272	24%	0.244	S	C	.	.	H	α-helix	trans	-61.3	-44.9	176.1	-70.1	172.2	0	0	0	110.5	F142 P143 L144 G149 I150 L984	F142-I146 HydrophobicContact CD1-CD1 3.87Å; F142-I146 HydrophobicContact CD2-CD1 4.41Å; F142-I146 HydrophobicContact CE1-CD1 3.44Å; F142-I146 VanDerWaalsContact CE1-CD1 3.44Å; F142-I146 HydrophobicContact CE2-CD1 4.03Å; F142-I146 HydrophobicContact CG-CD1 4.35Å; F142-I146 HydrophobicContact CZ-CD1 3.54Å; F142-I146 WeakPolarHBondContact O-CG1 3.46Å; F142-I146 PolarHBondContact O-N 2.82Å; P143-I146 PolarHBondContact O-N 2.89Å; L144-I146 PolarHBondContact O-N 3.26Å; I146-G149 PolarHBondContact O-N 2.87Å; I146-I150 HydrophobicContact CG2-CD1 3.84Å; I146-I150 HydrophobicContact CG2-CG1 4.5Å; I146-I150 WeakPolarHBondContact O-CG1 3.45Å; I146-I150 PolarHBondContact O-N 3.34Å; I146-L984 HydrophobicContact CD1-CD1 4.35Å; I146-L984 HydrophobicContact CD1-CD2 3.74Å; I146-L984 HydrophobicContact CG2-CD1 4.36Å
147	V	82.3	Confident	85.4	Confident	12 Å²	12	49.9 Å²	49.9	7%	0.073	26%	0.259	C	S	.	.	H	α-helix	trans	-62.5	-52	-178.7	153.6	0	0	0	0	111.6	P143 L144 V145 G149 I150 T151 I398 V402	P143-V147 VanDerWaalsContact O-CB 3.31Å; P143-V147 WeakPolarHBondContact O-CB 3.21Å; P143-V147 VanDerWaalsContact O-CG2 3.24Å; P143-V147 WeakPolarHBondContact O-CG2 3.36Å; P143-V147 PolarHBondContact O-N 2.78Å; L144-V147 PolarHBondContact O-N 3.33Å; V145-V147 VanDerWaalsContact C-N 3.32Å; V145-V147 PolarHBondContact O-N 3.06Å; V147-G149 VanDerWaalsContact C-N 3.27Å; V147-G149 PolarHBondContact O-N 3.04Å; V147-I150 PolarHBondContact O-N 2.74Å; V147-T151 PolarHBondContact O-N 2.88Å; V147-T151 PolarHBondContact O-OG1 3.15Å; V147-I398 HydrophobicContact CB-CG2 4.5Å; V147-I398 HydrophobicContact CG2-CG2 4.14Å; V147-V402 HydrophobicContact CB-CG2 3.67Å; V147-V402 HydrophobicContact CG1-CG2 3.29Å; V147-V402 HydrophobicContact CG2-CB 4.08Å; V147-V402 HydrophobicContact CG2-CG2 3.6Å
148	L	86.8	Confident	84.8	Confident	20 Å²	20	46.3 Å²	46.3	11%	0.105	25%	0.251	C	S	.	.	H	α-helix	trans	-63.3	-35.7	177.5	-61.8	174	0	0	0	111.4	Q111 F112 L144 A152	Q111-L148 HydrophobicContact CB-CD2 4.19Å; Q111-L148 PolarHBondContact OE1-O 3.37Å; F112-L148 HydrophobicContact CE2-CD1 4.29Å; F112-L148 HydrophobicContact CZ-CD1 3.95Å; L144-L148 HydrophobicContact CD1-CD1 4.02Å; L144-L148 HydrophobicContact CD1-CD2 4.49Å; L144-L148 HydrophobicContact CD1-CG 4.11Å; L144-L148 HydrophobicContact CG-CD1 3.91Å; L144-L148 HydrophobicContact CG-CG 4.36Å; L144-L148 VanDerWaalsContact O-CG 3.28Å; L144-L148 WeakPolarHBondContact O-CG 3.37Å; L144-L148 PolarHBondContact O-N 2.83Å; L148-A152 VanDerWaalsContact O-CB 3.25Å; L148-A152 WeakPolarHBondContact O-CB 3.44Å; L148-A152 PolarHBondContact O-N 3.48Å
149	G	89.4	Confident	84.6	Confident	29 Å²	29	43.3 Å²	43.3	30%	0.299	24%	0.239	S	C	.	.	H	α-helix	trans	-64.3	-46.2	177.4	0	0	0	0	0	113.3	V145 I146 V147 A152 I153	V145-G149 PolarHBondContact O-N 2.8Å; I146-G149 PolarHBondContact O-N 2.87Å; V147-G149 VanDerWaalsContact C-N 3.27Å; V147-G149 PolarHBondContact O-N 3.04Å; G149-A152 PolarHBondContact O-N 3.48Å; G149-I153 VanDerWaalsContact O-CG1 3.3Å; G149-I153 WeakPolarHBondContact O-CG1 3.49Å; G149-I153 PolarHBondContact O-N 3.31Å
150	I	84.4	Confident	84.5	Confident	72 Å²	72	46.7 Å²	46.7	37%	0.369	26%	0.257	S	S	.	.	H	α-helix	trans	-61.9	-46.8	177.6	-70.2	167.8	0	0	0	110.7	I146 V147 A152 I153 K154 V402	I146-I150 HydrophobicContact CG2-CD1 3.84Å; I146-I150 HydrophobicContact CG2-CG1 4.5Å; I146-I150 WeakPolarHBondContact O-CG1 3.45Å; I146-I150 PolarHBondContact O-N 3.34Å; V147-I150 PolarHBondContact O-N 2.74Å; I150-A152 VanDerWaalsContact C-N 3.33Å; I150-A152 PolarHBondContact O-N 3.05Å; I150-I153 PolarHBondContact O-N 3.38Å; I150-K154 PolarHBondContact O-N 2.93Å; I150-K154 VanDerWaalsContact O-N 3.11Å; I150-V402 HydrophobicContact CB-CG1 4.25Å; I150-V402 HydrophobicContact CD1-CG1 3.97Å; I150-V402 HydrophobicContact CG2-CG1 3.99Å
151	T	81.4	Confident	84.1	Confident	5 Å²	5	48.8 Å²	48.8	3%	0.031	27%	0.274	C	S	.	.	H	α-helix	trans	-63.2	-40.9	177.3	-59.5	0	0	0	0	111.1	Q111 V147 K154 D155 E405	Q111-T151 HydrophobicContact CG-CG2 4.27Å; V147-T151 PolarHBondContact O-N 2.88Å; V147-T151 PolarHBondContact O-OG1 3.15Å; T151-K154 PolarHBondContact O-N 2.86Å; T151-D155 PolarHBondContact O-N 2.92Å; T151-E405 PolarHBondContact OG1-OE2 2.9Å
152	A	87.9	Confident	83.6	Confident	21 Å²	21	50.2 Å²	50.2	17%	0.174	28%	0.276	C	S	.	.	H	α-helix	trans	-63.2	-44.1	177	0	0	0	0	0	112.8	F103 N107 L148 G149 I150 K154 D155 L156	F103-A152 HydrophobicContact CZ-CB 4.45Å; F103-A152 WeakPolarHBondContact CZ-O 3.43Å; N107-A152 WeakPolarHBondContact ND2-CA 3.37Å; L148-A152 VanDerWaalsContact O-CB 3.25Å; L148-A152 WeakPolarHBondContact O-CB 3.44Å; L148-A152 PolarHBondContact O-N 3.48Å; G149-A152 PolarHBondContact O-N 3.48Å; I150-A152 VanDerWaalsContact C-N 3.33Å; I150-A152 PolarHBondContact O-N 3.05Å; A152-K154 VanDerWaalsContact C-N 3.31Å; A152-K154 PolarHBondContact O-N 3.29Å; A152-D155 PolarHBondContact O-N 2.6Å; A152-L156 WeakPolarHBondContact O-CB 3.44Å; A152-L156 PolarHBondContact O-N 3.41Å
153	I	88.3	Confident	83.4	Confident	110 Å²	110	48.1 Å²	48.1	56%	0.564	27%	0.267	S	S	*	.	H	α-helix	trans	-60.1	-43.6	177.4	-70.7	165.6	0	0	0	110.7	G149 I150 L156 V157	G149-I153 VanDerWaalsContact O-CG1 3.3Å; G149-I153 WeakPolarHBondContact O-CG1 3.49Å; G149-I153 PolarHBondContact O-N 3.31Å; I150-I153 PolarHBondContact O-N 3.38Å; I153-L156 WeakPolarHBondContact O-CB 3.23Å; I153-L156 PolarHBondContact O-N 2.91Å; I153-V157 WeakPolarHBondContact O-CG2 3.47Å; I153-V157 PolarHBondContact O-N 2.86Å
154	K	81.6	Confident	83.5	Confident	43 Å²	43	56.2 Å²	56.2	19%	0.187	30%	0.295	C	S	.	.	H	α-helix	trans	-60.3	-51.3	177.3	179.7	-137.5	166.7	-159.1	0	111.3	I150 T151 A152 L156 V157 D158 L409	I150-K154 PolarHBondContact O-N 2.93Å; I150-K154 VanDerWaalsContact O-N 3.11Å; T151-K154 PolarHBondContact O-N 2.86Å; A152-K154 VanDerWaalsContact C-N 3.31Å; A152-K154 PolarHBondContact O-N 3.29Å; K154-L156 PolarHBondContact O-N 2.83Å; K154-V157 PolarHBondContact O-N 3.05Å; K154-V157 VanDerWaalsContact O-N 3.13Å; K154-D158 PolarHBondContact O-N 3.26Å; K154-D158 VanDerWaalsContact O-N 3.12Å; K154-L409 HydrophobicContact CD-CD1 4.41Å; K154-L409 HydrophobicContact CG-CD1 4.2Å
155	D	81.2	Confident	82.8	Confident	32 Å²	32	61.5 Å²	61.5	17%	0.171	32%	0.321	C	S	.	.	H	α-helix	trans	-64.3	-31	-179	-67.2	-20.8	0	0	0	112.1	T151 A152 D159	T151-D155 PolarHBondContact O-N 2.92Å; A152-D155 PolarHBondContact O-N 2.6Å; D155-D159 WeakPolarHBondContact O-CB 3.48Å; D155-D159 PolarHBondContact O-N 3.29Å
156	L	86.6	Confident	82.5	Confident	68 Å²	68	57.9 Å²	57.9	36%	0.356	30%	0.299	S	S	.	.	H	α-helix	trans	-64.4	-45.6	172.2	-178.2	61.6	0	0	0	112.1	F103 A152 I153 K154 D158 D159 L160	F103-L156 HydrophobicContact CD2-CD1 4.24Å; F103-L156 HydrophobicContact CE1-CB 4.38Å; F103-L156 HydrophobicContact CE1-CD1 4.38Å; F103-L156 HydrophobicContact CE2-CB 3.87Å; F103-L156 HydrophobicContact CE2-CD1 4.05Å; F103-L156 HydrophobicContact CG-CD1 4.49Å; F103-L156 HydrophobicContact CZ-CB 3.61Å; F103-L156 HydrophobicContact CZ-CD1 4.14Å; F103-L156 HydrophobicContact CZ-CG 4.35Å; A152-L156 WeakPolarHBondContact O-CB 3.44Å; A152-L156 PolarHBondContact O-N 3.41Å; I153-L156 WeakPolarHBondContact O-CB 3.23Å; I153-L156 PolarHBondContact O-N 2.91Å; K154-L156 PolarHBondContact O-N 2.83Å; L156-D158 VanDerWaalsContact C-N 3.32Å; L156-D158 PolarHBondContact O-N 3.35Å; L156-D159 PolarHBondContact O-N 2.87Å; L156-L160 HydrophobicContact CD1-CD1 4.27Å; L156-L160 HydrophobicContact CD1-CG 4.17Å; L156-L160 HydrophobicContact CG-CD1 4.01Å; L156-L160 HydrophobicContact CG-CG 4.35Å; L156-L160 WeakPolarHBondContact O-CB 3.33Å; L156-L160 VanDerWaalsContact O-CG 3.24Å; L156-L160 WeakPolarHBondContact O-CG 3.49Å; L156-L160 PolarHBondContact O-N 2.89Å
157	V	84.4	Confident	82.5	Confident	88 Å²	88	62.2 Å²	62.2	53%	0.533	32%	0.316	S	S	.	.	H	α-helix	trans	-61.1	-44.3	178.9	170.5	0	0	0	0	110.6	I153 K154 L160 A161	I153-V157 WeakPolarHBondContact O-CG2 3.47Å; I153-V157 PolarHBondContact O-N 2.86Å; K154-V157 PolarHBondContact O-N 3.05Å; K154-V157 VanDerWaalsContact O-N 3.13Å; V157-L160 PolarHBondContact O-N 3.25Å; V157-A161 PolarHBondContact O-N 3.18Å; V157-A161 VanDerWaalsContact O-N 3.16Å
158	D	73.9	Confident	82.6	Confident	72 Å²	72	68 Å²	68	39%	0.385	34%	0.342	S	S	.	.	H	α-helix	trans	-63.7	-42.2	178.8	-73.6	-16	0	0	0	111.8	K154 L156 A161 R162	K154-D158 PolarHBondContact O-N 3.26Å; K154-D158 VanDerWaalsContact O-N 3.12Å; L156-D158 VanDerWaalsContact C-N 3.32Å; L156-D158 PolarHBondContact O-N 3.35Å; D158-A161 PolarHBondContact O-N 2.9Å; D158-R162 PolarHBondContact O-N 2.86Å
159	D	81	Confident	82.3	Confident	5 Å²	5	68.8 Å²	68.8	3%	0.027	35%	0.348	C	S	.	.	H	α-helix	trans	-73.9	-35.4	180	-151.3	58.4	0	0	0	112.3	K97 Y98 D155 L156 A161 R162 H163	K97-D159 PolarHBondContact N-OD1 2.69Å; Y98-D159 HydrophobicContact CD2-CB 3.88Å; Y98-D159 WeakPolarHBondContact CD2-OD2 3.47Å; Y98-D159 HydrophobicContact CE2-CB 4.43Å; Y98-D159 PolarHBondContact N-OD2 2.91Å; D155-D159 WeakPolarHBondContact O-CB 3.48Å; D155-D159 PolarHBondContact O-N 3.29Å; L156-D159 PolarHBondContact O-N 2.87Å; D159-A161 VanDerWaalsContact C-N 3.26Å; D159-A161 PolarHBondContact O-N 3.09Å; D159-R162 WeakPolarHBondContact O-CB 3.35Å; D159-R162 PolarHBondContact O-N 3.01Å; D159-R162 VanDerWaalsContact O-N 3.09Å; D159-R162 IonicContact OD1-NH1 2.91Å; D159-H163 PolarHBondContact O-CD2 2.93Å; D159-H163 VanDerWaalsContact O-CD2 3.26Å; D159-H163 PolarHBondContact O-N 3.4Å; D159-H163 IonicContact OD2-CD2 2.65Å; D159-H163 IonicContact OD2-NE2 2.88Å
160	L	84.9	Confident	82.3	Confident	81 Å²	81	68.3 Å²	68.3	42%	0.424	34%	0.338	S	S	.	.	H	α-helix	trans	-60.5	-36.1	172.7	-76.6	174.6	0	0	0	112.3	L156 V157 H163 R164	L156-L160 HydrophobicContact CD1-CD1 4.27Å; L156-L160 HydrophobicContact CD1-CG 4.17Å; L156-L160 HydrophobicContact CG-CD1 4.01Å; L156-L160 HydrophobicContact CG-CG 4.35Å; L156-L160 WeakPolarHBondContact O-CB 3.33Å; L156-L160 VanDerWaalsContact O-CG 3.24Å; L156-L160 WeakPolarHBondContact O-CG 3.49Å; L156-L160 PolarHBondContact O-N 2.89Å; V157-L160 PolarHBondContact O-N 3.25Å; L160-H163 PolarHBondContact O-N 3.15Å; L160-R164 WeakPolarHBondContact O-CG 3.5Å; L160-R164 PolarHBondContact O-N 2.8Å; L160-R164 VanDerWaalsContact O-N 3.1Å
161	A	76.5	Confident	82.5	Confident	46 Å²	46	67.8 Å²	67.8	38%	0.38	34%	0.336	S	S	.	.	H	α-helix	trans	-63.7	-41.4	173.8	0	0	0	0	0	111.6	V157 D158 D159 R164 M165	V157-A161 PolarHBondContact O-N 3.18Å; V157-A161 VanDerWaalsContact O-N 3.16Å; D158-A161 PolarHBondContact O-N 2.9Å; D159-A161 VanDerWaalsContact C-N 3.26Å; D159-A161 PolarHBondContact O-N 3.09Å; A161-R164 PolarHBondContact O-N 2.81Å; A161-M165 WeakPolarHBondContact O-CG 3.4Å; A161-M165 PolarHBondContact O-N 2.89Å
162	R	75.3	Confident	82.8	Confident	87 Å²	87	71.2 Å²	71.2	33%	0.328	35%	0.349	S	S	.	.	H	α-helix	trans	-64.6	-42.9	174.7	-65.3	-175.5	-168.6	132.8	8.5	112.4	D158 D159 R164 M165 D166	D158-R162 PolarHBondContact O-N 2.86Å; D159-R162 WeakPolarHBondContact O-CB 3.35Å; D159-R162 PolarHBondContact O-N 3.01Å; D159-R162 VanDerWaalsContact O-N 3.09Å; D159-R162 IonicContact OD1-NH1 2.91Å; R162-R164 VanDerWaalsContact C-N 3.28Å; R162-R164 PolarHBondContact O-N 3.24Å; R162-M165 PolarHBondContact O-N 3Å; R162-M165 VanDerWaalsContact O-N 3.16Å; R162-D166 PolarHBondContact O-N 3.4Å
163	H	83.2	Confident	83	Confident	58 Å²	58	76.6 Å²	76.6	27%	0.269	37%	0.368	S	S	.	.	H	α-helix	trans	-56.9	-40.9	174.8	-87.2	-78.6	0	0	0	112.5	Y96 Y98 D159 L160 K167	Y96-H163 WeakPolarHBondContact CB-NE2 3.44Å; Y96-H163 AromaticContact CD1-CE1 3.36Å; Y96-H163 WeakPolarHBondContact CD1-CE1 3.38Å; Y96-H163 AromaticContact CD1-ND1 3.49Å; Y96-H163 WeakPolarHBondContact CD1-ND1 3.46Å; Y96-H163 AromaticContact CD1-NE2 3.95Å; Y96-H163 AromaticContact CD2-CE1 3.18Å; Y96-H163 WeakPolarHBondContact CD2-CE1 3.04Å; Y96-H163 AromaticContact CD2-NE2 3.28Å; Y96-H163 VanDerWaalsContact CD2-NE2 3.28Å; Y96-H163 WeakPolarHBondContact CD2-NE2 3.25Å; Y96-H163 AromaticContact CE1-CE1 3.65Å; Y96-H163 AromaticContact CE1-ND1 3.86Å; Y96-H163 AromaticContact CE2-CE1 3.46Å; Y96-H163 VanDerWaalsContact CE2-CE1 3.46Å; Y96-H163 WeakPolarHBondContact CE2-CE1 3.24Å; Y96-H163 AromaticContact CE2-NE2 3.97Å; Y96-H163 AromaticContact CG-CD2 3.87Å; Y96-H163 AromaticContact CG-CE1 3.13Å; Y96-H163 AromaticContact CG-ND1 3.65Å; Y96-H163 AromaticContact CG-NE2 3.27Å; Y96-H163 VanDerWaalsContact CG-NE2 3.27Å; Y96-H163 AromaticContact CZ-CE1 3.69Å; Y98-H163 PolarHBondContact O-NE2 2.78Å; D159-H163 PolarHBondContact O-CD2 2.93Å; D159-H163 VanDerWaalsContact O-CD2 3.26Å; D159-H163 PolarHBondContact O-N 3.4Å; D159-H163 IonicContact OD2-CD2 2.65Å; D159-H163 IonicContact OD2-NE2 2.88Å; L160-H163 PolarHBondContact O-N 3.15Å; H163-K167 VanDerWaalsContact O-CB 3.23Å; H163-K167 WeakPolarHBondContact O-CB 3.49Å; H163-K167 PolarHBondContact O-N 3.22Å
164	R	83.8	Confident	83.1	Confident	187 Å²	187	71.9 Å²	71.9	71%	0.706	35%	0.345	S	S	*	.	H	α-helix	trans	-63.5	-46	176.2	-71.3	175.2	-172.6	-179.4	2.7	111.5	L160 A161 R162 K167 E168	L160-R164 WeakPolarHBondContact O-CG 3.5Å; L160-R164 PolarHBondContact O-N 2.8Å; L160-R164 VanDerWaalsContact O-N 3.1Å; A161-R164 PolarHBondContact O-N 2.81Å; R162-R164 VanDerWaalsContact C-N 3.28Å; R162-R164 PolarHBondContact O-N 3.24Å; R164-K167 PolarHBondContact O-N 3.19Å; R164-E168 PolarHBondContact O-N 2.87Å
165	M	71.9	Confident	83.7	Confident	117 Å²	117	71 Å²	71	58%	0.576	34%	0.341	S	S	*	.	H	α-helix	trans	-63.4	-47.4	178.2	-68.9	177.2	171.3	0	0	112.1	A161 R162 K167 E168 V169	A161-M165 WeakPolarHBondContact O-CG 3.4Å; A161-M165 PolarHBondContact O-N 2.89Å; R162-M165 PolarHBondContact O-N 3Å; R162-M165 VanDerWaalsContact O-N 3.16Å; M165-K167 VanDerWaalsContact C-N 3.29Å; M165-K167 PolarHBondContact O-N 3.03Å; M165-E168 WeakPolarHBondContact O-CB 3.33Å; M165-E168 PolarHBondContact O-N 2.83Å; M165-E168 VanDerWaalsContact O-N 3.16Å; M165-V169 PolarHBondContact O-N 3.26Å; M165-V169 VanDerWaalsContact O-N 3.07Å
166	D	81.3	Confident	84.3	Confident	10 Å²	10	69.5 Å²	69.5	5%	0.053	33%	0.333	C	S	.	.	H	α-helix	trans	-60.6	-40.8	177.2	-74.4	-10.6	0	0	0	111.4	T95 Y96 R162 E168 V169 N170	T95-D166 WeakPolarHBondContact CB-OD1 3.27Å; T95-D166 WeakPolarHBondContact CG2-OD1 3.22Å; T95-D166 PolarHBondContact N-OD2 3.39Å; T95-D166 PolarHBondContact OG1-OD1 2.81Å; T95-D166 PolarHBondContact OG1-OD2 2.93Å; T95-D166 VanDerWaalsContact OG1-OD2 3.1Å; Y96-D166 VanDerWaalsContact CD1-OD2 3.28Å; Y96-D166 WeakPolarHBondContact CD1-OD2 3.21Å; Y96-D166 PolarHBondContact N-OD2 2.95Å; R162-D166 PolarHBondContact O-N 3.4Å; D166-E168 VanDerWaalsContact C-N 3.32Å; D166-E168 PolarHBondContact O-N 2.95Å; D166-V169 PolarHBondContact O-N 3.23Å; D166-N170 VanDerWaalsContact O-CB 3.23Å; D166-N170 WeakPolarHBondContact O-CB 3.45Å; D166-N170 PolarHBondContact O-N 2.85Å; D166-N170 PolarHBondContact O-ND2 2.9Å
167	K	86.7	Confident	84.5	Confident	144 Å²	144	66.7 Å²	66.7	63%	0.626	32%	0.319	S	S	*	.	H	α-helix	trans	-64.6	-38.3	177.3	-172.4	176.3	-178.5	-179.4	0	111.5	H163 R164 M165 N171	H163-K167 VanDerWaalsContact O-CB 3.23Å; H163-K167 WeakPolarHBondContact O-CB 3.49Å; H163-K167 PolarHBondContact O-N 3.22Å; R164-K167 PolarHBondContact O-N 3.19Å; M165-K167 VanDerWaalsContact C-N 3.29Å; M165-K167 PolarHBondContact O-N 3.03Å; K167-N171 VanDerWaalsContact CG-ND2 3.28Å; K167-N171 WeakPolarHBondContact CG-ND2 3.34Å; K167-N171 WeakPolarHBondContact O-CB 3.45Å; K167-N171 PolarHBondContact O-N 3.27Å; K167-N171 PolarHBondContact O-ND2 2.97Å
168	E	84.2	Confident	84.6	Confident	132 Å²	132	64.4 Å²	64.4	62%	0.617	30%	0.303	S	S	*	.	H	α-helix	trans	-63.6	-49.8	176.9	-170.1	-177.8	160.3	0	0	111.4	R164 M165 D166 N171 R172	R164-E168 PolarHBondContact O-N 2.87Å; M165-E168 WeakPolarHBondContact O-CB 3.33Å; M165-E168 PolarHBondContact O-N 2.83Å; M165-E168 VanDerWaalsContact O-N 3.16Å; D166-E168 VanDerWaalsContact C-N 3.32Å; D166-E168 PolarHBondContact O-N 2.95Å; E168-N171 PolarHBondContact O-N 3.31Å; E168-R172 PolarHBondContact O-N 3.02Å
169	V	81.5	Confident	85	Confident	38 Å²	38	67.9 Å²	67.9	23%	0.23	32%	0.322	C	S	.	.	H	α-helix	trans	-65.1	-45.1	179.8	179.8	0	0	0	0	111.8	I93 M165 D166 N171 R172 W187	I93-V169 HydrophobicContact CD1-CG1 4.18Å; M165-V169 PolarHBondContact O-N 3.26Å; M165-V169 VanDerWaalsContact O-N 3.07Å; D166-V169 PolarHBondContact O-N 3.23Å; V169-N171 VanDerWaalsContact C-N 3.27Å; V169-N171 PolarHBondContact O-N 2.8Å; V169-R172 WeakPolarHBondContact O-CB 3.49Å; V169-R172 PolarHBondContact O-N 3.2Å; V169-W187 HydrophobicContact CG1-CE3 3.9Å; V169-W187 HydrophobicContact CG1-CZ3 3.93Å
170	N	88.2	Confident	85.1	Confident	19 Å²	19	69.4 Å²	69.4	10%	0.102	34%	0.339	C	S	.	.	H	α-helix	trans	-68.4	-24.4	-177.2	-73.2	-35.5	0	0	0	113.6	A92 I93 D166 M188	A92-N170 WeakPolarHBondContact CA-OD1 3.28Å; I93-N170 PolarHBondContact N-OD1 3.42Å; I93-N170 PolarHBondContact O-ND2 2.84Å; D166-N170 VanDerWaalsContact O-CB 3.23Å; D166-N170 WeakPolarHBondContact O-CB 3.45Å; D166-N170 PolarHBondContact O-N 2.85Å; D166-N170 PolarHBondContact O-ND2 2.9Å; N170-M188 HydrophobicContact CB-CB 4.2Å; N170-M188 PolarHBondContact O-N 3.18Å
171	N	89.7	Confident	85.3	Confident	60 Å²	60	74.3 Å²	74.3	32%	0.321	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.8	2.8	177.6	-73.4	-66.4	0	0	0	113.8	K167 E168 V169 K186	K167-N171 VanDerWaalsContact CG-ND2 3.28Å; K167-N171 WeakPolarHBondContact CG-ND2 3.34Å; K167-N171 WeakPolarHBondContact O-CB 3.45Å; K167-N171 PolarHBondContact O-N 3.27Å; K167-N171 PolarHBondContact O-ND2 2.97Å; E168-N171 PolarHBondContact O-N 3.31Å; V169-N171 VanDerWaalsContact C-N 3.27Å; V169-N171 PolarHBondContact O-N 2.8Å; N171-K186 PolarHBondContact OD1-NZ 3.08Å
172	R	86.6	Confident	86	Confident	77 Å²	77	73.3 Å²	73.3	29%	0.291	34%	0.339	S	S	.	.			trans	-57.8	145.6	167.6	-69.8	-177.1	-177.9	-174.1	0.7	109.4	E168 V169 K186 W187	E168-R172 PolarHBondContact O-N 3.02Å; V169-R172 WeakPolarHBondContact O-CB 3.49Å; V169-R172 PolarHBondContact O-N 3.2Å; R172-K186 CarbonylContact O-C 3.56Å; R172-K186 WeakPolarHBondContact O-CA 3.45Å; R172-W187 HydrophobicContact CB-CD2 3.65Å; R172-W187 HydrophobicContact CB-CE3 4.25Å; R172-W187 HydrophobicContact CB-CG 3.76Å; R172-W187 HydrophobicContact CB-CZ2 4.28Å; R172-W187 PolarHBondContact O-N 3Å
173	K	91.4	Very high	86.8	Confident	134 Å²	134	73.5 Å²	73.5	58%	0.583	34%	0.342	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.2	149.6	-176.3	-65.2	-179.2	168.2	-163.9	0	110.6	E184 S185 W187	K173-E184 WeakPolarHBondContact CD-OE2 3.22Å; K173-E184 IonicContact NZ-OE2 3.51Å; K173-E184 PolarHBondContact NZ-OE2 2.99Å; K173-S185 CarbonylContact C-O 3.44Å; K173-S185 WeakPolarHBondContact CA-O 3.45Å; K173-W187 PolarHBondContact O-NE1 2.86Å
174	C	91.4	Very high	87.3	Confident	11 Å²	11	76.8 Å²	76.8	7%	0.074	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	161.3	167.9	59.8	0	0	0	0	109.8	S185 V190	C174-S185 PolarHBondContact N-O 3.02Å; C174-S185 PolarHBondContact O-N 2.72Å; C174-S185 VanDerWaalsContact O-O 3.1Å; C174-V190 WeakPolarHBondContact SG-CG2 3.39Å
175	E	94.1	Very high	87.7	Confident	25 Å²	25	68.8 Å²	68.8	12%	0.117	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	123.1	177.3	-66.5	175.5	163.7	0	0	109.6	F182 K183 V196 R197 K199	E175-F182 HydrophobicContact CB-CB 4.46Å; E175-F182 HydrophobicContact CB-CD1 4.42Å; E175-K183 WeakPolarHBondContact CA-O 3.45Å; E175-V196 CarbonylContact O-C 3.47Å; E175-V196 VanDerWaalsContact O-CA 3.29Å; E175-V196 WeakPolarHBondContact O-CA 3.31Å; E175-R197 HydrophobicContact CB-CB 4.18Å; E175-R197 VanDerWaalsContact CD-NH2 3.3Å; E175-R197 PolarHBondContact O-N 2.8Å; E175-R197 IonicContact OE1-NH2 3.9Å; E175-R197 PolarHBondContact OE1-NH2 2.8Å; E175-R197 IonicContact OE2-CZ 3.01Å; E175-R197 IonicContact OE2-NE 2.71Å; E175-R197 PolarHBondContact OE2-NE 3.12Å; E175-R197 IonicContact OE2-NH2 2.75Å; E175-R197 PolarHBondContact OE2-NH2 3.37Å; E175-K199 VanDerWaalsContact OE1-CE 3.26Å; E175-K199 WeakPolarHBondContact OE1-CE 3.3Å; E175-K199 IonicContact OE1-NZ 2.69Å; E175-K199 PolarHBondContact OE1-NZ 3.26Å; E175-K199 WeakPolarHBondContact OE2-CE 3.31Å; E175-K199 IonicContact OE2-NZ 3.89Å
176	V	93.1	Very high	88.8	Confident	0 Å²	0	67.4 Å²	67.4	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	138.1	-178.5	-173.4	0	0	0	0	109.2	L178 F182 K183 V190 D194 V196	V176-L178 HydrophobicContact CB-CD1 4.49Å; V176-L178 HydrophobicContact CB-CG 4.34Å; V176-L178 HydrophobicContact CG1-CD2 4.18Å; V176-L178 HydrophobicContact CG1-CG 4.06Å; V176-L178 PolarHBondContact O-N 2.77Å; V176-F182 WeakPolarHBondContact O-CA 3.31Å; V176-K183 PolarHBondContact N-O 3.21Å; V176-K183 PolarHBondContact O-N 2.88Å; V176-V190 HydrophobicContact CG2-CG2 4.22Å; V176-D194 HydrophobicContact CG1-CB 3.83Å; V176-V196 HydrophobicContact CG2-CG1 4.14Å
177	L	91.5	Very high	89.2	Confident	10 Å²	10	67.5 Å²	67.5	5%	0.052	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	107	176.1	-169.1	68.5	0	0	0	109.7	F182 V195 L252 A253	L177-F182 HydrophobicContact CB-CD1 4.14Å; L177-F182 HydrophobicContact CB-CE1 3.82Å; L177-F182 HydrophobicContact CB-CZ 4.36Å; L177-F182 HydrophobicContact CD1-CD1 4.32Å; L177-F182 HydrophobicContact CD1-CD2 4.2Å; L177-F182 HydrophobicContact CD1-CE1 4.19Å; L177-F182 HydrophobicContact CD1-CE2 4.1Å; L177-F182 HydrophobicContact CD1-CG 4.32Å; L177-F182 HydrophobicContact CD1-CZ 4.09Å; L177-V195 HydrophobicContact CB-CB 3.98Å; L177-V195 HydrophobicContact CB-CG1 4.38Å; L177-V195 WeakPolarHBondContact CB-O 3.42Å; L177-V195 HydrophobicContact CD2-CB 4.12Å; L177-V195 HydrophobicContact CD2-CG1 4.32Å; L177-V195 PolarHBondContact N-O 2.95Å; L177-L252 HydrophobicContact CD2-CB 3.95Å; L177-L252 WeakPolarHBondContact CD2-O 2.98Å; L177-A253 HydrophobicContact CD2-CB 4.35Å
178	L	86.4	Confident	89.5	Confident	40 Å²	40	64.4 Å²	64.4	21%	0.209	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	131.1	-179	-64.6	173.7	0	0	0	109.5	V176 G180 R181 K183	V176-L178 HydrophobicContact CB-CD1 4.49Å; V176-L178 HydrophobicContact CB-CG 4.34Å; V176-L178 HydrophobicContact CG1-CD2 4.18Å; V176-L178 HydrophobicContact CG1-CG 4.06Å; V176-L178 PolarHBondContact O-N 2.77Å; L178-G180 PolarHBondContact O-N 2.83Å; L178-R181 PolarHBondContact N-O 2.95Å; L178-R181 PolarHBondContact O-N 3.18Å; L178-R181 VanDerWaalsContact O-N 3.16Å; L178-K183 HydrophobicContact CB-CD 4.13Å
179	D	82.5	Confident	89.9	Confident	144 Å²	144	61.7 Å²	61.7	77%	0.77	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.5	35.4	-177.9	-44.9	-51.2	0	0	0	113.1	R181 K183	D179-R181 PolarHBondContact O-N 3.12Å; D179-K183 IonicContact OD2-NZ 2.75Å; D179-K183 PolarHBondContact OD2-NZ 2.83Å
180	G	82.3	Confident	90.3	Very high	37 Å²	37	60 Å²	60	38%	0.381	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.9	13.4	179.4	0	0	0	0	0	115.7	L178	L178-G180 PolarHBondContact O-N 2.83Å
181	R	89.4	Confident	90.5	Very high	184 Å²	184	62.3 Å²	62.3	69%	0.694	30%	0.299	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-140	151.6	173.4	-65.4	-172.9	-178	-173.6	0.3	112	L178 D179 K183	L178-R181 PolarHBondContact N-O 2.95Å; L178-R181 PolarHBondContact O-N 3.18Å; L178-R181 VanDerWaalsContact O-N 3.16Å; D179-R181 PolarHBondContact O-N 3.12Å; R181-K183 PolarHBondContact O-N 3.34Å
182	F	91.1	Very high	90.6	Very high	26 Å²	26	59.8 Å²	59.8	11%	0.114	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	122.9	172.6	-73.2	-71.8	0	0	0	110.8	E175 V176 L177 R197 E249 L252 H303	E175-F182 HydrophobicContact CB-CB 4.46Å; E175-F182 HydrophobicContact CB-CD1 4.42Å; V176-F182 WeakPolarHBondContact O-CA 3.31Å; L177-F182 HydrophobicContact CB-CD1 4.14Å; L177-F182 HydrophobicContact CB-CE1 3.82Å; L177-F182 HydrophobicContact CB-CZ 4.36Å; L177-F182 HydrophobicContact CD1-CD1 4.32Å; L177-F182 HydrophobicContact CD1-CD2 4.2Å; L177-F182 HydrophobicContact CD1-CE1 4.19Å; L177-F182 HydrophobicContact CD1-CE2 4.1Å; L177-F182 HydrophobicContact CD1-CG 4.32Å; L177-F182 HydrophobicContact CD1-CZ 4.09Å; F182-R197 HydrophobicContact CD1-CB 3.72Å; F182-R197 HydrophobicContact CE1-CB 3.51Å; F182-R197 HydrophobicContact CE2-CB 4.4Å; F182-R197 HydrophobicContact CG-CB 4.28Å; F182-R197 HydrophobicContact CZ-CB 3.88Å; F182-E249 HydrophobicContact CD2-CG 4.06Å; F182-E249 WeakPolarHBondContact CD2-OE1 3.12Å; F182-E249 HydrophobicContact CE2-CG 3.94Å; F182-L252 HydrophobicContact CE2-CD1 4.32Å; F182-L252 HydrophobicContact CZ-CD1 4.14Å; F182-H303 AromaticContact CZ-CD2 3.63Å
183	K	92.9	Very high	90.8	Very high	91 Å²	91	56.1 Å²	56.1	40%	0.396	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	144	175.6	-62.9	-177.8	-173	172.7	0	109.3	E175 V176 L178 D179 R181 S185	E175-K183 WeakPolarHBondContact CA-O 3.45Å; V176-K183 PolarHBondContact N-O 3.21Å; V176-K183 PolarHBondContact O-N 2.88Å; L178-K183 HydrophobicContact CB-CD 4.13Å; D179-K183 IonicContact OD2-NZ 2.75Å; D179-K183 PolarHBondContact OD2-NZ 2.83Å; R181-K183 PolarHBondContact O-N 3.34Å; K183-S185 PolarHBondContact O-N 2.74Å
184	E	93.1	Very high	90.8	Very high	126 Å²	126	49.9 Å²	49.9	59%	0.589	25%	0.245	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-65.5	126.6	170.1	-74.3	-166	168.4	0	0	109.9	K173	K173-E184 WeakPolarHBondContact CD-OE2 3.22Å; K173-E184 IonicContact NZ-OE2 3.51Å; K173-E184 PolarHBondContact NZ-OE2 2.99Å
185	S	92.9	Very high	90.9	Very high	19 Å²	19	49.4 Å²	49.4	13%	0.133	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	158.7	173.3	-165	0	0	0	0	110	K173 C174 K183 D189	K173-S185 CarbonylContact C-O 3.44Å; K173-S185 WeakPolarHBondContact CA-O 3.45Å; C174-S185 PolarHBondContact N-O 3.02Å; C174-S185 PolarHBondContact O-N 2.72Å; C174-S185 VanDerWaalsContact O-O 3.1Å; K183-S185 PolarHBondContact O-N 2.74Å; S185-D189 WeakPolarHBondContact OG-CB 3.47Å
186	K	93.5	Very high	90.9	Very high	89 Å²	89	48.2 Å²	48.2	39%	0.387	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	152.7	172.8	-63	178.1	177.6	-170.5	0	109.8	N171 R172 M188 D189	N171-K186 PolarHBondContact OD1-NZ 3.08Å; R172-K186 CarbonylContact O-C 3.56Å; R172-K186 WeakPolarHBondContact O-CA 3.45Å; K186-M188 HydrophobicContact CB-CG 3.97Å; K186-M188 HydrophobicContact CD-SD 4.43Å; K186-M188 PolarHBondContact O-N 3.23Å; K186-D189 PolarHBondContact O-N 2.93Å
187	W	91.6	Very high	91	Very high	12 Å²	12	50.7 Å²	50.7	5%	0.045	25%	0.245	C	C	.	.	G	3₁₀ helix	trans	-54.2	-39.7	177	-81.7	23.8	0	0	0	112.5	N91 V169 R172 K173 D189 V190 F203 P205	N91-W187 VanDerWaalsContact CB-O 3.28Å; N91-W187 WeakPolarHBondContact CB-O 3.5Å; N91-W187 PolarHBondContact ND2-O 2.93Å; V169-W187 HydrophobicContact CG1-CE3 3.9Å; V169-W187 HydrophobicContact CG1-CZ3 3.93Å; R172-W187 HydrophobicContact CB-CD2 3.65Å; R172-W187 HydrophobicContact CB-CE3 4.25Å; R172-W187 HydrophobicContact CB-CG 3.76Å; R172-W187 HydrophobicContact CB-CZ2 4.28Å; R172-W187 PolarHBondContact O-N 3Å; K173-W187 PolarHBondContact O-NE1 2.86Å; W187-D189 PolarHBondContact O-N 2.95Å; W187-V190 WeakPolarHBondContact O-CB 3.08Å; W187-V190 PolarHBondContact O-N 3.2Å; W187-F203 HydrophobicContact CH2-CB 3.67Å; W187-F203 HydrophobicContact CZ2-CB 3.71Å; W187-F203 WeakPolarHBondContact CZ2-O 3.37Å; W187-P205 HydrophobicContact CD2-CB 3.94Å; W187-P205 HydrophobicContact CG-CB 4.06Å; W187-P205 HydrophobicContact CZ2-CB 4.22Å
188	M	91.6	Very high	91.1	Very high	78 Å²	78	50.4 Å²	50.4	38%	0.384	24%	0.243	S	C	.	.	G	3₁₀ helix	trans	-62.3	-22.9	178.2	63.4	-176.6	-68.9	0	0	114.8	A92 N170 K186	A92-M188 HydrophobicContact CB-CB 4.09Å; N170-M188 HydrophobicContact CB-CB 4.2Å; N170-M188 PolarHBondContact O-N 3.18Å; K186-M188 HydrophobicContact CB-CG 3.97Å; K186-M188 HydrophobicContact CD-SD 4.43Å; K186-M188 PolarHBondContact O-N 3.23Å
189	D	92.1	Very high	91.4	Very high	76 Å²	76	53 Å²	53	41%	0.406	25%	0.253	S	S	.	.	G	3₁₀ helix	trans	-96.6	-2.6	-175.1	-60.2	-39.7	0	0	0	112.8	S185 K186 W187	S185-D189 WeakPolarHBondContact OG-CB 3.47Å; K186-D189 PolarHBondContact O-N 2.93Å; W187-D189 PolarHBondContact O-N 2.95Å
190	V	91.4	Very high	91.7	Very high	1 Å²	1	49.6 Å²	49.6	1%	0.006	23%	0.232	C	C	.	.			trans	-71.4	135.6	174.7	179.2	0	0	0	0	110.1	N91 C174 V176 W187 V306	N91-V190 HydrophobicContact CB-CB 4.22Å; N91-V190 VanDerWaalsContact CB-O 3.25Å; N91-V190 WeakPolarHBondContact CB-O 3.49Å; C174-V190 WeakPolarHBondContact SG-CG2 3.39Å; V176-V190 HydrophobicContact CG2-CG2 4.22Å; W187-V190 WeakPolarHBondContact O-CB 3.08Å; W187-V190 PolarHBondContact O-N 3.2Å; V190-V306 HydrophobicContact CG1-CG1 4.42Å; V190-V306 HydrophobicContact CG1-CG2 3.72Å
191	Q	91.6	Very high	91.8	Very high	69 Å²	69	51.1 Å²	51.1	32%	0.322	23%	0.231	S	C	.	.			trans	-124.1	160.9	-178.7	-59.5	-175.4	19.6	0	0	111.7	D194 V306	Q191-D194 PolarHBondContact N-OD2 2.86Å; Q191-D194 WeakPolarHBondContact O-CB 3.28Å; Q191-D194 PolarHBondContact O-N 2.83Å; Q191-V306 WeakPolarHBondContact O-CB 3.45Å; Q191-V306 WeakPolarHBondContact O-CG1 3.32Å
192	V	91.8	Very high	91.8	Very high	6 Å²	6	45.5 Å²	45.5	4%	0.036	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63	134.4	173.3	176.9	0	0	0	0	109.5	V62 H70 Y88 I307 A309	V62-V192 HydrophobicContact CB-CG1 4.26Å; V62-V192 HydrophobicContact CG1-CG1 3.73Å; V62-V192 HydrophobicContact CG2-CG1 3.6Å; H70-V192 PolarHBondContact CE1-O 3.24Å; H70-V192 PolarHBondContact ND1-O 2.81Å; Y88-V192 HydrophobicContact CD1-CB 4.09Å; Y88-V192 HydrophobicContact CD1-CG1 3.92Å; Y88-V192 HydrophobicContact CD1-CG2 4.04Å; Y88-V192 HydrophobicContact CE1-CG1 4.1Å; V192-I307 WeakPolarHBondContact CG1-O 3.43Å; V192-A309 HydrophobicContact CG2-CB 3.83Å
193	G	90.8	Very high	91.6	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	90.7	-6.5	-175.6	0	0	0	0	0	115.2	N65 L305 V306	N65-G193 PolarHBondContact N-O 3.27Å; G193-L305 WeakPolarHBondContact O-CD1 3.36Å; G193-V306 PolarHBondContact N-O 3.07Å
194	D	92.3	Very high	91.6	Very high	4 Å²	4	42.8 Å²	42.8	2%	0.021	20%	0.203	C	C	.	.			trans	-73.4	139.1	175.3	-73.2	-18	0	0	0	111.5	R67 V176 Q191 V306	R67-D194 IonicContact CZ-OD1 3.93Å; R67-D194 IonicContact CZ-OD2 3.45Å; R67-D194 IonicContact NE-OD1 3.42Å; R67-D194 PolarHBondContact NE-OD1 2.82Å; R67-D194 IonicContact NE-OD2 3.48Å; R67-D194 IonicContact NH2-OD1 2.73Å; R67-D194 PolarHBondContact NH2-OD1 2.88Å; R67-D194 IonicContact NH2-OD2 2.68Å; R67-D194 PolarHBondContact NH2-OD2 2.93Å; V176-D194 HydrophobicContact CG1-CB 3.83Å; Q191-D194 PolarHBondContact N-OD2 2.86Å; Q191-D194 WeakPolarHBondContact O-CB 3.28Å; Q191-D194 PolarHBondContact O-N 2.83Å; D194-V306 HydrophobicContact CB-CG2 4.33Å; D194-V306 WeakPolarHBondContact O-CG2 3.25Å; D194-V306 PolarHBondContact O-N 2.85Å
195	V	93.8	Very high	91.5	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	126.4	168.1	176.4	0	0	0	0	109.1	N65 L177 L211 L252 G304 L305	N65-V195 VanDerWaalsContact OD1-CG2 3.31Å; N65-V195 WeakPolarHBondContact OD1-CG2 3.47Å; L177-V195 HydrophobicContact CB-CB 3.98Å; L177-V195 HydrophobicContact CB-CG1 4.38Å; L177-V195 WeakPolarHBondContact CB-O 3.42Å; L177-V195 HydrophobicContact CD2-CB 4.12Å; L177-V195 HydrophobicContact CD2-CG1 4.32Å; L177-V195 PolarHBondContact N-O 2.95Å; V195-L211 HydrophobicContact CG1-CD1 4.34Å; V195-L211 HydrophobicContact CG2-CD1 4.26Å; V195-L252 HydrophobicContact CG1-CD2 4.26Å; V195-G304 CarbonylContact C-O 3.58Å; V195-G304 WeakPolarHBondContact CA-O 3.43Å; V195-L305 HydrophobicContact CG2-CD1 3.92Å
196	V	94.3	Very high	91.5	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	141.2	-178.6	-60.4	0	0	0	0	110.9	E175 V176 M198 I208 H303 G304 V306	E175-V196 CarbonylContact O-C 3.47Å; E175-V196 VanDerWaalsContact O-CA 3.29Å; E175-V196 WeakPolarHBondContact O-CA 3.31Å; V176-V196 HydrophobicContact CG2-CG1 4.14Å; V196-M198 HydrophobicContact CG2-CE 4.3Å; V196-M198 HydrophobicContact CG2-CG 4.41Å; V196-M198 HydrophobicContact CG2-SD 4.23Å; V196-I208 HydrophobicContact CG2-CD1 4.41Å; V196-I208 HydrophobicContact CG2-CG2 3.99Å; V196-H303 WeakPolarHBondContact O-CA 3.36Å; V196-G304 WeakPolarHBondContact CG2-O 3.16Å; V196-G304 PolarHBondContact N-O 2.92Å; V196-G304 PolarHBondContact O-N 3.15Å; V196-V306 HydrophobicContact CG1-CG2 3.9Å; V196-V306 HydrophobicContact CG2-CG2 4.49Å
197	R	94.1	Very high	91.6	Very high	53 Å²	53	31.7 Å²	31.7	20%	0.2	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	132.1	168.4	-174.2	171.7	69.9	-165.9	-0.7	108.6	E175 F182 E249	E175-R197 HydrophobicContact CB-CB 4.18Å; E175-R197 VanDerWaalsContact CD-NH2 3.3Å; E175-R197 PolarHBondContact O-N 2.8Å; E175-R197 IonicContact OE1-NH2 3.9Å; E175-R197 PolarHBondContact OE1-NH2 2.8Å; E175-R197 IonicContact OE2-CZ 3.01Å; E175-R197 IonicContact OE2-NE 2.71Å; E175-R197 PolarHBondContact OE2-NE 3.12Å; E175-R197 IonicContact OE2-NH2 2.75Å; E175-R197 PolarHBondContact OE2-NH2 3.37Å; F182-R197 HydrophobicContact CD1-CB 3.72Å; F182-R197 HydrophobicContact CE1-CB 3.51Å; F182-R197 HydrophobicContact CE2-CB 4.4Å; F182-R197 HydrophobicContact CG-CB 4.28Å; F182-R197 HydrophobicContact CZ-CB 3.88Å; R197-E249 IonicContact NH1-OE1 2.75Å; R197-E249 PolarHBondContact NH1-OE1 3.14Å
198	M	93.3	Very high	91.7	Very high	3 Å²	3	31.1 Å²	31.1	2%	0.015	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	143.6	179.7	-54.3	151.4	-69.8	0	0	109	V196 D202 I204 I208 L290 I296 F301 C302	V196-M198 HydrophobicContact CG2-CE 4.3Å; V196-M198 HydrophobicContact CG2-CG 4.41Å; V196-M198 HydrophobicContact CG2-SD 4.23Å; M198-D202 HydrophobicContact CB-CB 4.45Å; M198-I204 HydrophobicContact SD-CG1 3.93Å; M198-I208 HydrophobicContact CE-CD1 3.21Å; M198-I208 HydrophobicContact SD-CD1 3.22Å; M198-I208 WeakPolarHBondContact SD-CD1 3.26Å; M198-L290 HydrophobicContact CE-CD1 4.3Å; M198-I296 HydrophobicContact CB-CD1 3.23Å; M198-I296 HydrophobicContact CE-CD1 4.11Å; M198-I296 HydrophobicContact CG-CD1 4Å; M198-I296 HydrophobicContact SD-CD1 3.67Å; M198-F301 CarbonylContact O-C 3.45Å; M198-F301 WeakPolarHBondContact O-CA 3.43Å; M198-C302 WeakPolarHBondContact CE-SG 3.47Å; M198-C302 PolarHBondContact N-O 3.19Å; M198-C302 PolarHBondContact O-N 2.88Å
199	K	93	Very high	91.9	Very high	94 Å²	94	27.5 Å²	27.5	41%	0.409	13%	0.13	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	168.7	-176.8	-62.3	174.5	-175.1	165.1	0	111.2	E175 N201 D202 D300	E175-K199 VanDerWaalsContact OE1-CE 3.26Å; E175-K199 WeakPolarHBondContact OE1-CE 3.3Å; E175-K199 IonicContact OE1-NZ 2.69Å; E175-K199 PolarHBondContact OE1-NZ 3.26Å; E175-K199 WeakPolarHBondContact OE2-CE 3.31Å; E175-K199 IonicContact OE2-NZ 3.89Å; K199-N201 PolarHBondContact O-N 3.3Å; K199-D202 WeakPolarHBondContact CB-OD2 3.4Å; K199-D202 PolarHBondContact N-OD2 3.42Å; K199-D202 WeakPolarHBondContact O-CB 3.42Å; K199-D202 PolarHBondContact O-N 3.39Å; K199-D300 CarbonylContact C-O 3.59Å; K199-D300 WeakPolarHBondContact CA-O 3.1Å
200	K	88.2	Confident	92	Very high	74 Å²	74	24 Å²	24	32%	0.322	11%	0.112	S	C	.	.	T	Hydrogen-bonded Turn	trans	-49.8	129.4	171.3	-167.1	174.9	179.1	173.5	0	110	D202 T299 D300 E536	K200-D202 VanDerWaalsContact C-N 3.32Å; K200-D202 PolarHBondContact O-N 2.91Å; K200-T299 VanDerWaalsContact CA-O 3.24Å; K200-T299 WeakPolarHBondContact CA-O 3.46Å; K200-T299 VanDerWaalsContact CB-O 3.26Å; K200-T299 WeakPolarHBondContact CB-O 3.38Å; K200-T299 PolarHBondContact N-O 3.14Å; K200-D300 PolarHBondContact N-O 3.33Å; K200-E536 IonicContact NZ-OE1 3.29Å; K200-E536 PolarHBondContact NZ-OE1 3.46Å
201	N	85.8	Confident	92	Very high	69 Å²	69	24 Å²	24	37%	0.369	11%	0.112	S	C	.	.	T	Hydrogen-bonded Turn	trans	72.4	7.2	-178.7	-52.1	-52.2	0	0	0	116.7	K199 K295 I296 R297	K199-N201 PolarHBondContact O-N 3.3Å; N201-K295 WeakPolarHBondContact O-CE 3.37Å; N201-I296 WeakPolarHBondContact CA-O 3.48Å; N201-I296 PolarHBondContact N-O 3.25Å; N201-R297 VanDerWaalsContact OD1-CD 3.24Å; N201-R297 WeakPolarHBondContact OD1-CD 3.47Å; N201-R297 PolarHBondContact OD1-NH1 2.74Å
202	D	88.8	Confident	92	Very high	65 Å²	65	20.8 Å²	20.8	35%	0.348	10%	0.096	S	C	.	.	P	Polyproline II helix	trans	-75.6	147.6	171.8	-76.4	-20.7	0	0	0	111.7	M198 K199 K200 K295 I296	M198-D202 HydrophobicContact CB-CB 4.45Å; K199-D202 WeakPolarHBondContact CB-OD2 3.4Å; K199-D202 PolarHBondContact N-OD2 3.42Å; K199-D202 WeakPolarHBondContact O-CB 3.42Å; K199-D202 PolarHBondContact O-N 3.39Å; K200-D202 VanDerWaalsContact C-N 3.32Å; K200-D202 PolarHBondContact O-N 2.91Å; D202-K295 WeakPolarHBondContact O-CA 3.49Å; D202-I296 PolarHBondContact O-N 2.92Å
203	F	87.9	Confident	91.9	Very high	61 Å²	61	20.5 Å²	20.5	27%	0.268	10%	0.095	S	C	.	.	B	Isolated β-bridge	trans	-81	142.2	168	-74.8	-83.2	0	0	0	110.7	W187 E226 K295	W187-F203 HydrophobicContact CH2-CB 3.67Å; W187-F203 HydrophobicContact CZ2-CB 3.71Å; W187-F203 WeakPolarHBondContact CZ2-O 3.37Å; F203-E226 VanDerWaalsContact CE1-CD 3.49Å; F203-E226 HydrophobicContact CE1-CG 4.23Å; F203-E226 VanDerWaalsContact CE1-OE1 3.23Å; F203-E226 WeakPolarHBondContact CE1-OE1 3.41Å; F203-K295 HydrophobicContact CD1-CB 4.15Å; F203-K295 HydrophobicContact CE1-CB 4.15Å; F203-K295 HydrophobicContact CE1-CD 4.35Å; F203-K295 HydrophobicContact CE2-CD 4.46Å; F203-K295 HydrophobicContact CZ-CD 4.18Å
204	I	92.4	Very high	91.8	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	11%	0.107	C	C	.	.	P	Polyproline II helix	trans	-77.2	122.8	179.1	-70.8	156.4	0	0	0	109.7	M198 A206 I208 V222 L290 L291 G293 C294 I296	M198-I204 HydrophobicContact SD-CG1 3.93Å; I204-A206 WeakPolarHBondContact CG2-O 3.42Å; I204-I208 HydrophobicContact CG1-CD1 4.44Å; I204-I208 HydrophobicContact CG2-CD1 3.92Å; I204-I208 HydrophobicContact CG2-CG1 3.85Å; I204-V222 HydrophobicContact CD1-CG1 3.95Å; I204-L290 HydrophobicContact CD1-CB 3.51Å; I204-L290 HydrophobicContact CD1-CD1 4.14Å; I204-L290 HydrophobicContact CD1-CG 4.41Å; I204-L290 HydrophobicContact CG1-CB 4.41Å; I204-L291 WeakPolarHBondContact CB-O 3.45Å; I204-L291 WeakPolarHBondContact CG2-O 3.22Å; I204-G293 PolarHBondContact O-N 3.34Å; I204-C294 HydrophobicContact CD1-CB 3.36Å; I204-C294 HydrophobicContact CG1-CB 4.4Å; I204-C294 PolarHBondContact N-O 3.03Å; I204-I296 HydrophobicContact CD1-CD1 4.46Å; I204-I296 HydrophobicContact CD1-CG1 4.03Å; I204-I296 HydrophobicContact CG1-CD1 4.09Å; I204-I296 HydrophobicContact CG1-CG1 4.13Å
205	P	91.1	Very high	91.3	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	12%	0.122	C	C	.	.			trans	-77.1	-23	-168.9	28.8	-36	0	0	0	114.7	N91 W187 R292	N91-P205 PolarHBondContact ND2-O 2.8Å; N91-P205 VanDerWaalsContact ND2-O 3.12Å; N91-P205 PolarHBondContact OD1-O 3.31Å; W187-P205 HydrophobicContact CD2-CB 3.94Å; W187-P205 HydrophobicContact CG-CB 4.06Å; W187-P205 HydrophobicContact CZ2-CB 4.22Å; P205-R292 PolarHBondContact O-NE 3.25Å
206	A	93.3	Very high	90.1	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	15%	0.15	C	C	.	.	S	Bend	trans	-160.7	168.2	-170.3	0	0	0	0	0	109	I204 I208 V306 F308	I204-A206 WeakPolarHBondContact CG2-O 3.42Å; A206-I208 PolarHBondContact O-N 3.31Å; A206-V306 HydrophobicContact CB-CG1 3.78Å; A206-V306 HydrophobicContact CB-CG2 4.44Å; A206-F308 WeakPolarHBondContact CB-O 3.42Å
207	D	94.1	Very high	88.8	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	117.2	175.9	-60.7	-19.8	0	0	0	108.6	M289 L291 R292 I307 F308 T313 K314	D207-M289 HydrophobicContact CB-CE 3.93Å; D207-L291 HydrophobicContact CB-CD2 4.36Å; D207-L291 WeakPolarHBondContact OD1-CA 3.28Å; D207-R292 PolarHBondContact OD1-N 2.83Å; D207-I307 PolarHBondContact O-N 2.74Å; D207-F308 HydrophobicContact CB-CB 4.02Å; D207-F308 HydrophobicContact CB-CD2 3.97Å; D207-F308 HydrophobicContact CB-CG 4.46Å; D207-F308 PolarHBondContact N-O 3.47Å; D207-F308 PolarHBondContact O-N 2.86Å; D207-T313 VanDerWaalsContact OD2-CA 3.24Å; D207-T313 WeakPolarHBondContact OD2-CA 3.4Å; D207-K314 PolarHBondContact OD2-N 3.2Å
208	I	94.6	Very high	88.2	Confident	0 Å²	0	29.6 Å²	29.6	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	148.2	-169.6	54.8	166.6	0	0	0	111.4	V196 M198 I204 A206 M289 L290 L305 V306	V196-I208 HydrophobicContact CG2-CD1 4.41Å; V196-I208 HydrophobicContact CG2-CG2 3.99Å; M198-I208 HydrophobicContact CE-CD1 3.21Å; M198-I208 HydrophobicContact SD-CD1 3.22Å; M198-I208 WeakPolarHBondContact SD-CD1 3.26Å; I204-I208 HydrophobicContact CG1-CD1 4.44Å; I204-I208 HydrophobicContact CG2-CD1 3.92Å; I204-I208 HydrophobicContact CG2-CG1 3.85Å; A206-I208 PolarHBondContact O-N 3.31Å; I208-M289 CarbonylContact O-C 3.44Å; I208-M289 VanDerWaalsContact O-CA 3.31Å; I208-M289 WeakPolarHBondContact O-CA 3.42Å; I208-L290 HydrophobicContact CD1-CB 3.95Å; I208-L290 HydrophobicContact CD1-CD1 3.78Å; I208-L290 HydrophobicContact CD1-CG 4.18Å; I208-L290 HydrophobicContact CG1-CB 3.69Å; I208-L290 HydrophobicContact CG1-CD1 4.37Å; I208-L290 HydrophobicContact CG1-CG 4.22Å; I208-L290 VanDerWaalsContact CG1-O 3.3Å; I208-L290 WeakPolarHBondContact CG1-O 3.41Å; I208-L290 PolarHBondContact N-O 2.99Å; I208-L290 PolarHBondContact O-N 3.18Å; I208-L305 CarbonylContact C-O 3.55Å; I208-L305 WeakPolarHBondContact CA-O 3.26Å; I208-V306 HydrophobicContact CG2-CB 4.35Å; I208-V306 HydrophobicContact CG2-CG2 3.81Å
209	L	94.7	Very high	87.7	Confident	3 Å²	3	30.9 Å²	30.9	2%	0.016	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	124.2	170	177.7	70.1	0	0	0	109.4	L211 I259 L284 N288 G304 L305 I307	L209-L211 HydrophobicContact CD2-CD2 4.47Å; L209-L211 PolarHBondContact O-N 3.33Å; L209-I259 HydrophobicContact CD2-CG1 4.28Å; L209-L284 HydrophobicContact CD1-CD1 4.06Å; L209-L284 HydrophobicContact CD1-CD2 3.85Å; L209-L284 HydrophobicContact CD1-CG 4.46Å; L209-L284 HydrophobicContact CD2-CD1 3.88Å; L209-L284 HydrophobicContact CD2-CD2 4.27Å; L209-N288 HydrophobicContact CD1-CB 3.72Å; L209-N288 WeakPolarHBondContact CD1-O 3.19Å; L209-G304 CarbonylContact O-C 3.54Å; L209-G304 WeakPolarHBondContact O-CA 3.48Å; L209-L305 HydrophobicContact CB-CB 4.37Å; L209-L305 PolarHBondContact N-O 2.86Å; L209-L305 PolarHBondContact O-N 3.39Å; L209-I307 HydrophobicContact CB-CD1 4.15Å; L209-I307 HydrophobicContact CB-CG1 3.95Å
210	L	94.2	Very high	87.4	Confident	3 Å²	3	26.4 Å²	26.4	2%	0.016	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	117.5	178.9	179.9	59.5	0	0	0	110.6	S218 C220 K236 N288 L290 C302	L210-S218 WeakPolarHBondContact CD2-O 3.11Å; L210-C220 HydrophobicContact CD1-CB 4.19Å; L210-C220 HydrophobicContact CD2-CB 3.65Å; L210-K236 HydrophobicContact CD2-CB 4.31Å; L210-N288 WeakPolarHBondContact CB-O 3.43Å; L210-N288 PolarHBondContact N-O 3.49Å; L210-L290 HydrophobicContact CB-CG 4.37Å; L210-L290 HydrophobicContact CD1-CD1 4.29Å; L210-L290 HydrophobicContact CD2-CD2 4.43Å; L210-C302 HydrophobicContact CD1-CB 3.92Å
211	L	92	Very high	87.2	Confident	1 Å²	1	24.7 Å²	24.7	1%	0.005	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	-54.1	179.8	-62	179.2	0	0	0	111.4	V195 L209 T242 L246 L252 F255 H303 L305	V195-L211 HydrophobicContact CG1-CD1 4.34Å; V195-L211 HydrophobicContact CG2-CD1 4.26Å; L209-L211 HydrophobicContact CD2-CD2 4.47Å; L209-L211 PolarHBondContact O-N 3.33Å; L211-T242 HydrophobicContact CD2-CG2 4.49Å; L211-T242 CarbonylContact O-C 3.49Å; L211-T242 WeakPolarHBondContact O-CB 3.4Å; L211-T242 PolarHBondContact O-OG1 3.46Å; L211-L246 HydrophobicContact CB-CD1 4.32Å; L211-L246 HydrophobicContact CD1-CD1 4.49Å; L211-L246 HydrophobicContact CD2-CD1 4.43Å; L211-L252 HydrophobicContact CD1-CD2 4.15Å; L211-F255 HydrophobicContact CD1-CD1 4.19Å; L211-F255 HydrophobicContact CD1-CE1 3.98Å; L211-F255 HydrophobicContact CD2-CE1 3.83Å; L211-F255 HydrophobicContact CD2-CZ 3.89Å; L211-H303 PolarHBondContact N-O 2.98Å; L211-L305 HydrophobicContact CD1-CB 4.18Å; L211-L305 HydrophobicContact CD2-CB 4.41Å; L211-L305 HydrophobicContact CG-CB 4.35Å
212	S	91.6	Very high	87.2	Confident	0 Å²	0	21.4 Å²	21.4	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	155.8	179.6	59.3	0	0	0	0	112.3	S218 L246 C302 H303	S212-S218 VanDerWaalsContact CA-OG 3.28Å; S212-S218 WeakPolarHBondContact CA-OG 3.43Å; S212-L246 WeakPolarHBondContact CB-O 3.23Å; S212-L246 PolarHBondContact OG-O 2.73Å; S212-C302 CarbonylContact O-C 3.23Å; S212-C302 WeakPolarHBondContact O-CA 3.38Å; S212-H303 PolarHBondContact N-O 3.34Å; S212-H303 PolarHBondContact O-N 3.46Å; S212-H303 PolarHBondContact OG-ND1 2.88Å
213	S	90.4	Very high	86.8	Confident	0 Å²	0	20.1 Å²	20.1	0%	0	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	161.9	178.2	-167	0	0	0	0	110.9	E215 S218 L219 Q247 T299	S213-E215 VanDerWaalsContact C-N 3.27Å; S213-S218 PolarHBondContact N-OG 2.9Å; S213-L219 VanDerWaalsContact CB-O 3.23Å; S213-L219 WeakPolarHBondContact CB-O 3.47Å; S213-L219 PolarHBondContact OG-O 3.12Å; S213-Q247 PolarHBondContact O-NE2 3.08Å; S213-Q247 VanDerWaalsContact O-NE2 3.1Å; S213-T299 WeakPolarHBondContact OG-CG2 3.48Å
214	S	87.1	Confident	86.1	Confident	36 Å²	36	17.8 Å²	17.8	25%	0.252	10%	0.097	S	C	.	.	S	Bend	trans	-67.2	-28.2	171.2	62.5	0	0	0	0	113	D300 F301	S214-D300 PolarHBondContact OG-N 2.94Å; S214-D300 VanDerWaalsContact OG-N 3.13Å; S214-F301 PolarHBondContact N-O 2.81Å
215	E	81.8	Confident	84.7	Confident	72 Å²	72	18.3 Å²	18.3	34%	0.336	10%	0.102	S	C	.	.	S	Bend	trans	-80.9	147.8	178.6	-63.4	-58.7	141.3	0	0	111.7	S213 S218 L219	S213-E215 VanDerWaalsContact C-N 3.27Å; E215-S218 PolarHBondContact O-N 2.98Å; E215-L219 HydrophobicContact CB-CB 4.17Å; E215-L219 WeakPolarHBondContact CB-O 3Å
216	P	68.9	Low	83.4	Confident	92 Å²	92	20.9 Å²	20.9	60%	0.597	11%	0.114	S	C	*	.	G	3₁₀ helix	trans	-59.2	142.2	178.6	24.4	-33.2	0	0	0	111.7	S218	P216-S218 VanDerWaalsContact C-N 3.32Å
217	N	68.6	Low	82	Confident	49 Å²	49	21.6 Å²	21.6	26%	0.262	12%	0.117	S	C	.	.	G	3₁₀ helix	trans	66	25.5	-175.1	-54.2	-62.7	0	0	0	114.9	L219 D243 Q571	N217-L219 VanDerWaalsContact C-N 3.25Å; N217-L219 PolarHBondContact O-N 3.48Å; N217-D243 VanDerWaalsContact CA-OD2 3.27Å; N217-D243 WeakPolarHBondContact CA-OD2 3.11Å; N217-D243 PolarHBondContact N-OD2 3.47Å; N217-Q571 PolarHBondContact ND2-NE2 3.39Å; N217-Q571 PolarHBondContact ND2-OE1 3.23Å
218	S	81	Confident	80.3	Confident	0 Å²	0	22.7 Å²	22.7	0%	0	12%	0.123	C	C	.	.	G	3₁₀ helix	trans	54.9	38.7	179.1	-84.7	0	0	0	0	114.2	L210 S212 S213 E215 P216 G238 D243	L210-S218 WeakPolarHBondContact CD2-O 3.11Å; S212-S218 VanDerWaalsContact CA-OG 3.28Å; S212-S218 WeakPolarHBondContact CA-OG 3.43Å; S213-S218 PolarHBondContact N-OG 2.9Å; E215-S218 PolarHBondContact O-N 2.98Å; P216-S218 VanDerWaalsContact C-N 3.32Å; S218-G238 PolarHBondContact O-N 2.78Å; S218-D243 WeakPolarHBondContact CB-OD1 3.49Å; S218-D243 PolarHBondContact N-OD1 2.81Å; S218-D243 PolarHBondContact N-OD2 3.47Å; S218-D243 WeakPolarHBondContact OG-CA 3.16Å; S218-D243 WeakPolarHBondContact OG-CB 3.48Å; S218-D243 PolarHBondContact OG-OD1 2.85Å
219	L	82.6	Confident	78.1	Confident	30 Å²	30	22.7 Å²	22.7	16%	0.157	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	130.5	173.1	-79.2	158.5	0	0	0	109.7	S213 E215 N217 F235	S213-L219 VanDerWaalsContact CB-O 3.23Å; S213-L219 WeakPolarHBondContact CB-O 3.47Å; S213-L219 PolarHBondContact OG-O 3.12Å; E215-L219 HydrophobicContact CB-CB 4.17Å; E215-L219 WeakPolarHBondContact CB-O 3Å; N217-L219 VanDerWaalsContact C-N 3.25Å; N217-L219 PolarHBondContact O-N 3.48Å; L219-F235 HydrophobicContact CD2-CB 4.42Å; L219-F235 HydrophobicContact CD2-CD2 4.07Å
220	C	85.8	Confident	76.4	Confident	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	131.4	174	-177	0	0	0	0	108.7	L210 F235 K236	L210-C220 HydrophobicContact CD1-CB 4.19Å; L210-C220 HydrophobicContact CD2-CB 3.65Å; C220-F235 CarbonylContact O-C 3.56Å; C220-F235 WeakPolarHBondContact O-CA 3.35Å; C220-K236 PolarHBondContact N-O 3.49Å; C220-K236 PolarHBondContact O-N 2.83Å
221	Y	84.7	Confident	74.5	Confident	37 Å²	37	27.9 Å²	27.9	15%	0.145	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	134.5	174.1	-54.6	-92.5	0	0	0	110.4	K234 F235 R297 N298 T299	Y221-K234 WeakPolarHBondContact CA-O 3.03Å; Y221-F235 HydrophobicContact CD1-CB 3.81Å; Y221-F235 HydrophobicContact CE1-CB 3.77Å; Y221-R297 WeakPolarHBondContact CB-O 3.4Å; Y221-R297 PolarHBondContact O-N 3.07Å; Y221-R297 VanDerWaalsContact O-O 3.11Å; Y221-N298 HydrophobicContact CD2-CB 3.74Å; Y221-N298 HydrophobicContact CE2-CB 4.4Å; Y221-N298 HydrophobicContact CG-CB 4.19Å; Y221-T299 PolarHBondContact N-OG1 3.05Å
222	V	85.8	Confident	73.1	Confident	1 Å²	1	29.8 Å²	29.8	1%	0.006	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	133.5	179.1	-68	0	0	0	0	110.5	I204 T224 K234 K236 L290 C294 K295 I296	I204-V222 HydrophobicContact CD1-CG1 3.95Å; V222-T224 HydrophobicContact CG2-CG2 4.35Å; V222-K234 HydrophobicContact CG2-CB 4.23Å; V222-K234 WeakPolarHBondContact CG2-O 3.37Å; V222-K234 PolarHBondContact N-O 2.88Å; V222-K234 PolarHBondContact O-N 2.97Å; V222-K236 HydrophobicContact CG2-CG 3.96Å; V222-L290 HydrophobicContact CG1-CD2 3.89Å; V222-C294 HydrophobicContact CB-CB 4.12Å; V222-C294 HydrophobicContact CG1-CB 4.36Å; V222-K295 CarbonylContact C-O 3.53Å; V222-K295 WeakPolarHBondContact CA-O 3.49Å; V222-I296 HydrophobicContact CG1-CG1 4.48Å
223	E	80.7	Confident	72	Confident	38 Å²	38	31.2 Å²	31.2	18%	0.178	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	120.4	167.5	-179	-177.6	179.5	0	0	107.8	A225 L233 C294 K295 R297	E223-A225 HydrophobicContact CG-CB 4.05Å; E223-L233 HydrophobicContact CB-CD2 3.89Å; E223-C294 VanDerWaalsContact O-CA 3.32Å; E223-C294 WeakPolarHBondContact O-CA 3.23Å; E223-K295 HydrophobicContact CB-CB 4.32Å; E223-K295 PolarHBondContact N-O 3.47Å; E223-K295 PolarHBondContact O-N 2.94Å; E223-R297 HydrophobicContact CB-CG 3.99Å; E223-R297 IonicContact OE1-NH2 3.55Å; E223-R297 IonicContact OE2-CZ 2.8Å; E223-R297 IonicContact OE2-NE 3.62Å; E223-R297 PolarHBondContact OE2-NE 3.48Å; E223-R297 IonicContact OE2-NH2 2.83Å; E223-R297 PolarHBondContact OE2-NH2 2.76Å
224	T	73.3	Confident	71.4	Confident	11 Å²	11	34.5 Å²	34.5	7%	0.067	18%	0.183	C	C	.	.			trans	-97.9	16	-176	54.2	0	0	0	0	113.3	V222 E226 L227 D228 E230 K234	V222-T224 HydrophobicContact CG2-CG2 4.35Å; T224-E226 PolarHBondContact O-N 2.89Å; T224-L227 PolarHBondContact O-N 3.36Å; T224-D228 WeakPolarHBondContact CB-OD1 3.45Å; T224-D228 WeakPolarHBondContact CB-OD2 3.43Å; T224-D228 PolarHBondContact O-N 3.31Å; T224-D228 VanDerWaalsContact O-N 3.12Å; T224-D228 VanDerWaalsContact OG1-CG 3.27Å; T224-D228 PolarHBondContact OG1-OD1 2.81Å; T224-D228 PolarHBondContact OG1-OD2 2.95Å; T224-D228 VanDerWaalsContact OG1-OD2 3.05Å; T224-E230 CarbonylContact C-O 3.44Å; T224-K234 HydrophobicContact CG2-CD 3.94Å; T224-K234 HydrophobicContact CG2-CG 4.39Å
225	A	63.6	Low	71.1	Confident	12 Å²	12	38.7 Å²	38.7	10%	0.099	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.8	-29	-175.6	0	0	0	0	0	114.6	E223 G229 E230 T231 G909	E223-A225 HydrophobicContact CG-CB 4.05Å; A225-G229 VanDerWaalsContact O-CA 3.29Å; A225-G229 WeakPolarHBondContact O-CA 3.47Å; A225-G229 PolarHBondContact O-N 2.99Å; A225-E230 WeakPolarHBondContact CA-O 3.4Å; A225-E230 PolarHBondContact N-O 2.8Å; A225-T231 HydrophobicContact CB-CG2 4.42Å; A225-G909 WeakPolarHBondContact O-CA 3.41Å
226	E	63.3	Low	71.3	Confident	53 Å²	53	36.4 Å²	36.4	25%	0.248	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.7	-8.2	174.1	-61.6	-166.5	164.5	0	0	114.4	F203 T224 G293 Q911	F203-E226 VanDerWaalsContact CE1-CD 3.49Å; F203-E226 HydrophobicContact CE1-CG 4.23Å; F203-E226 VanDerWaalsContact CE1-OE1 3.23Å; F203-E226 WeakPolarHBondContact CE1-OE1 3.41Å; T224-E226 PolarHBondContact O-N 2.89Å; E226-G293 WeakPolarHBondContact CB-O 3.23Å; E226-G293 WeakPolarHBondContact OE2-CA 3.48Å; E226-Q911 WeakPolarHBondContact O-CG 3.31Å; E226-Q911 PolarHBondContact O-NE2 3.45Å
227	L	64.1	Low	72	Confident	15 Å²	15	35.7 Å²	35.7	8%	0.079	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.9	-57.7	-177	-80	147.9	0	0	0	112.4	T224 L268 L291 R292 C294 I315 A889	T224-L227 PolarHBondContact O-N 3.36Å; L227-L268 HydrophobicContact CD2-CD2 3.97Å; L227-L291 HydrophobicContact CD1-CB 3.67Å; L227-L291 HydrophobicContact CD1-CD1 4.43Å; L227-L291 HydrophobicContact CD2-CB 4.19Å; L227-L291 HydrophobicContact CD2-CD1 4.36Å; L227-R292 WeakPolarHBondContact CD2-O 3.27Å; L227-C294 HydrophobicContact CD1-CB 4.23Å; L227-C294 WeakPolarHBondContact CD1-SG 3.24Å; L227-I315 HydrophobicContact CD2-CB 3.88Å; L227-I315 HydrophobicContact CD2-CD1 4.06Å; L227-I315 HydrophobicContact CD2-CG1 4.12Å; L227-I315 HydrophobicContact CG-CD1 4.37Å; L227-A889 WeakPolarHBondContact O-CB 3.48Å
228	D	56.8	Low	72.9	Confident	24 Å²	24	33.5 Å²	33.5	13%	0.128	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.8	-17	-179.7	49.8	26	0	0	0	112.4	T224 E230 K234 A889	T224-D228 WeakPolarHBondContact CB-OD1 3.45Å; T224-D228 WeakPolarHBondContact CB-OD2 3.43Å; T224-D228 PolarHBondContact O-N 3.31Å; T224-D228 VanDerWaalsContact O-N 3.12Å; T224-D228 VanDerWaalsContact OG1-CG 3.27Å; T224-D228 PolarHBondContact OG1-OD1 2.81Å; T224-D228 PolarHBondContact OG1-OD2 2.95Å; T224-D228 VanDerWaalsContact OG1-OD2 3.05Å; D228-E230 WeakPolarHBondContact OD1-CB 3.22Å; D228-E230 PolarHBondContact OD1-N 2.9Å; D228-K234 IonicContact OD2-NZ 2.75Å; D228-K234 PolarHBondContact OD2-NZ 3.29Å; D228-A889 VanDerWaalsContact C-CB 3.43Å; D228-A889 VanDerWaalsContact CA-CB 3.49Å; D228-A889 VanDerWaalsContact O-CB 3.26Å; D228-A889 WeakPolarHBondContact O-CB 3.47Å; D228-A889 PolarHBondContact O-N 2.67Å
229	G	50.2	Low	73.1	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	17%	0.171	C	C	.	.			trans	97	-19.1	-173.1	0	0	0	0	0	112.6	A225 T231 E908 G909	A225-G229 VanDerWaalsContact O-CA 3.29Å; A225-G229 WeakPolarHBondContact O-CA 3.47Å; A225-G229 PolarHBondContact O-N 2.99Å; G229-T231 PolarHBondContact O-N 2.76Å; G229-E908 VanDerWaalsContact C-C 3.45Å; G229-E908 CarbonylContact C-O 3.53Å; G229-E908 VanDerWaalsContact C-O 3.31Å; G229-E908 VanDerWaalsContact CA-C 3.47Å; G229-E908 WeakPolarHBondContact CA-O 3.28Å; G229-E908 CarbonylContact O-C 3.54Å; G229-E908 WeakPolarHBondContact O-CA 3.37Å; G229-E908 WeakPolarHBondContact O-CB 3.04Å; G229-G909 PolarHBondContact O-N 3.19Å
230	E	58	Low	73.1	Confident	68 Å²	68	41.5 Å²	41.5	32%	0.318	19%	0.194	S	C	.	.			trans	-66.5	125.5	-173.2	-61.8	172.8	-168.2	0	0	111.7	T224 A225 D228 N232 K234	T224-E230 CarbonylContact C-O 3.44Å; A225-E230 WeakPolarHBondContact CA-O 3.4Å; A225-E230 PolarHBondContact N-O 2.8Å; D228-E230 WeakPolarHBondContact OD1-CB 3.22Å; D228-E230 PolarHBondContact OD1-N 2.9Å; E230-N232 VanDerWaalsContact C-N 3.28Å; E230-K234 IonicContact OE1-NZ 2.93Å; E230-K234 WeakPolarHBondContact OE2-CE 3.32Å; E230-K234 IonicContact OE2-NZ 3.97Å; E230-K234 PolarHBondContact OE2-NZ 3.24Å
231	T	54.1	Low	73.1	Confident	46 Å²	46	43 Å²	43	28%	0.282	20%	0.203	S	C	.	.			trans	-80.9	-11.1	173.6	44.2	0	0	0	0	113.4	A225 G229 Q907	A225-T231 HydrophobicContact CB-CG2 4.42Å; G229-T231 PolarHBondContact O-N 2.76Å; T231-Q907 HydrophobicContact CG2-CB 4.39Å; T231-Q907 WeakPolarHBondContact CG2-O 3.5Å
232	N	62.6	Low	73.1	Confident	41 Å²	41	41.4 Å²	41.4	22%	0.219	20%	0.197	C	C	.	.	S	Bend	trans	-69.2	140.8	178.6	-63.8	-17.6	0	0	0	108.9	E230 K234 A548	E230-N232 VanDerWaalsContact C-N 3.28Å; N232-K234 PolarHBondContact O-N 3.1Å; N232-A548 PolarHBondContact ND2-O 2.76Å
233	L	70	Confident	73	Confident	31 Å²	31	42.2 Å²	42.2	16%	0.162	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74	125.9	176.7	-61.6	-177.6	0	0	0	109.4	E223 R297 N298	E223-L233 HydrophobicContact CB-CD2 3.89Å; L233-R297 HydrophobicContact CD1-CB 4.05Å; L233-R297 HydrophobicContact CD2-CB 3.55Å; L233-R297 HydrophobicContact CD2-CG 3.61Å; L233-R297 HydrophobicContact CG-CB 4.48Å; L233-N298 VanDerWaalsContact CD1-ND2 3.35Å; L233-N298 WeakPolarHBondContact CD1-ND2 3.32Å
234	K	76.7	Confident	73.2	Confident	69 Å²	69	47.9 Å²	47.9	30%	0.3	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	135.2	166.3	-60.4	-172.4	-175.6	179.2	0	107.8	Y221 V222 T224 D228 E230 N232	Y221-K234 WeakPolarHBondContact CA-O 3.03Å; V222-K234 HydrophobicContact CG2-CB 4.23Å; V222-K234 WeakPolarHBondContact CG2-O 3.37Å; V222-K234 PolarHBondContact N-O 2.88Å; V222-K234 PolarHBondContact O-N 2.97Å; T224-K234 HydrophobicContact CG2-CD 3.94Å; T224-K234 HydrophobicContact CG2-CG 4.39Å; D228-K234 IonicContact OD2-NZ 2.75Å; D228-K234 PolarHBondContact OD2-NZ 3.29Å; E230-K234 IonicContact OE1-NZ 2.93Å; E230-K234 WeakPolarHBondContact OE2-CE 3.32Å; E230-K234 IonicContact OE2-NZ 3.97Å; E230-K234 PolarHBondContact OE2-NZ 3.24Å; N232-K234 PolarHBondContact O-N 3.1Å
235	F	80.5	Confident	73.7	Confident	124 Å²	124	53 Å²	53	54%	0.544	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	147	170.3	67.2	-88.4	0	0	0	109.4	L219 C220 Y221	L219-F235 HydrophobicContact CD2-CB 4.42Å; L219-F235 HydrophobicContact CD2-CD2 4.07Å; C220-F235 CarbonylContact O-C 3.56Å; C220-F235 WeakPolarHBondContact O-CA 3.35Å; Y221-F235 HydrophobicContact CD1-CB 3.81Å; Y221-F235 HydrophobicContact CE1-CB 3.77Å
236	K	86	Confident	74.6	Confident	24 Å²	24	52.5 Å²	52.5	10%	0.104	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	146	174.8	-68.3	-68.6	177.4	-176.4	0	108	L210 C220 V222 L286 D287 M289 L290	L210-K236 HydrophobicContact CD2-CB 4.31Å; C220-K236 PolarHBondContact N-O 3.49Å; C220-K236 PolarHBondContact O-N 2.83Å; V222-K236 HydrophobicContact CG2-CG 3.96Å; K236-L286 PolarHBondContact NZ-O 3.48Å; K236-D287 WeakPolarHBondContact CD-O 3.16Å; K236-D287 IonicContact NZ-OD1 2.75Å; K236-D287 PolarHBondContact NZ-OD1 3.37Å; K236-M289 WeakPolarHBondContact CD-O 3.12Å; K236-L290 HydrophobicContact CB-CD2 3.47Å; K236-L290 VanDerWaalsContact CB-CD2 3.47Å; K236-L290 HydrophobicContact CG-CD2 3.65Å
237	M	84.3	Confident	75.5	Confident	77 Å²	77	53.7 Å²	53.7	38%	0.379	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	125.1	-171.4	-168.7	175	60.8	0	0	110.2	D287 N288	M237-D287 PolarHBondContact N-O 2.85Å; M237-N288 PolarHBondContact O-ND2 3.47Å
238	G	86.3	Confident	76.5	Confident	2 Å²	2	58.4 Å²	58.4	2%	0.021	27%	0.269	C	S	.	.			trans	-71.1	166.4	171.8	0	0	0	0	0	111.9	S218	S218-G238 PolarHBondContact O-N 2.78Å
239	L	85.8	Confident	77.9	Confident	29 Å²	29	61.3 Å²	61.3	15%	0.152	28%	0.281	C	S	.	.			trans	-68.1	139.3	172.2	-67.7	172.6	0	0	0	109.7	V241 T242 D243 M275 Y282 L284	L239-V241 PolarHBondContact O-N 3.44Å; L239-V241 VanDerWaalsContact O-N 3.14Å; L239-T242 HydrophobicContact CB-CG2 4.2Å; L239-T242 HydrophobicContact CD1-CG2 4.5Å; L239-T242 PolarHBondContact N-OG1 3.47Å; L239-T242 PolarHBondContact O-N 3.12Å; L239-T242 VanDerWaalsContact O-N 3.08Å; L239-T242 PolarHBondContact O-OG1 3.38Å; L239-D243 PolarHBondContact O-N 2.89Å; L239-M275 HydrophobicContact CD1-CE 3.44Å; L239-M275 VanDerWaalsContact CD1-CE 3.44Å; L239-M275 HydrophobicContact CD1-SD 4.29Å; L239-Y282 HydrophobicContact CD1-CG 4.3Å; L239-L284 HydrophobicContact CD1-CD2 3.76Å; L239-L284 HydrophobicContact CG-CD2 4.33Å
240	R	83	Confident	79.6	Confident	170 Å²	170	70.6 Å²	70.6	64%	0.642	32%	0.316	S	S	*	.	H	α-helix	trans	-56.5	-34.5	178	-70.4	-175.4	173.8	-173.9	-3.4	113	Q244	R240-Q244 WeakPolarHBondContact O-CG 3.46Å; R240-Q244 PolarHBondContact O-N 2.75Å
241	V	85.3	Confident	80.9	Confident	32 Å²	32	71.3 Å²	71.3	19%	0.194	32%	0.32	C	S	.	.	H	α-helix	trans	-71.3	-36.3	-179.4	-174.7	0	0	0	0	111.5	L239 R245 W277 Y282	L239-V241 PolarHBondContact O-N 3.44Å; L239-V241 VanDerWaalsContact O-N 3.14Å; V241-R245 WeakPolarHBondContact O-CB 3.45Å; V241-R245 WeakPolarHBondContact O-CG 3.41Å; V241-R245 PolarHBondContact O-N 2.65Å; V241-W277 HydrophobicContact CG1-CE3 4.34Å; V241-W277 HydrophobicContact CG1-CZ3 3.97Å; V241-Y282 HydrophobicContact CB-CE1 4.36Å; V241-Y282 HydrophobicContact CG2-CD1 4.48Å; V241-Y282 HydrophobicContact CG2-CE1 3.68Å
242	T	85.7	Confident	82.5	Confident	2 Å²	2	69.1 Å²	69.1	1%	0.012	31%	0.306	C	S	.	.	H	α-helix	trans	-73.6	-40.3	176.3	56.7	0	0	0	0	110.5	L211 L239 Q244 R245 L246 M275 W277	L211-T242 HydrophobicContact CD2-CG2 4.49Å; L211-T242 CarbonylContact O-C 3.49Å; L211-T242 WeakPolarHBondContact O-CB 3.4Å; L211-T242 PolarHBondContact O-OG1 3.46Å; L239-T242 HydrophobicContact CB-CG2 4.2Å; L239-T242 HydrophobicContact CD1-CG2 4.5Å; L239-T242 PolarHBondContact N-OG1 3.47Å; L239-T242 PolarHBondContact O-N 3.12Å; L239-T242 VanDerWaalsContact O-N 3.08Å; L239-T242 PolarHBondContact O-OG1 3.38Å; T242-Q244 PolarHBondContact O-N 2.75Å; T242-R245 PolarHBondContact O-N 3.28Å; T242-L246 HydrophobicContact CG2-CD1 4.03Å; T242-L246 WeakPolarHBondContact O-CA 3.35Å; T242-L246 WeakPolarHBondContact O-CB 3.26Å; T242-L246 PolarHBondContact O-N 3.21Å; T242-M275 HydrophobicContact CG2-CE 3.86Å; T242-M275 HydrophobicContact CG2-SD 4.29Å; T242-W277 HydrophobicContact CG2-CZ3 4.37Å
243	D	83.7	Confident	83.6	Confident	19 Å²	19	69 Å²	69	10%	0.102	31%	0.311	C	S	.	.	H	α-helix	trans	-56.6	-47.1	176.8	-171.2	44.4	0	0	0	112.7	N217 S218 L239 R245 Q247	N217-D243 VanDerWaalsContact CA-OD2 3.27Å; N217-D243 WeakPolarHBondContact CA-OD2 3.11Å; N217-D243 PolarHBondContact N-OD2 3.47Å; S218-D243 WeakPolarHBondContact CB-OD1 3.49Å; S218-D243 PolarHBondContact N-OD1 2.81Å; S218-D243 PolarHBondContact N-OD2 3.47Å; S218-D243 WeakPolarHBondContact OG-CA 3.16Å; S218-D243 WeakPolarHBondContact OG-CB 3.48Å; S218-D243 PolarHBondContact OG-OD1 2.85Å; L239-D243 PolarHBondContact O-N 2.89Å; D243-R245 PolarHBondContact O-N 3.19Å; D243-Q247 WeakPolarHBondContact O-CG 3.5Å; D243-Q247 PolarHBondContact O-NE2 2.82Å; D243-Q247 PolarHBondContact OD1-NE2 2.81Å
244	Q	83.3	Confident	84.4	Confident	156 Å²	156	74.5 Å²	74.5	73%	0.729	34%	0.336	S	S	*	.	H	α-helix	trans	-72.6	-29	-176.2	-70.7	176.3	-2.2	0	0	113.3	R240 T242	R240-Q244 WeakPolarHBondContact O-CG 3.46Å; R240-Q244 PolarHBondContact O-N 2.75Å; T242-Q244 PolarHBondContact O-N 2.75Å
245	R	84	Confident	84.9	Confident	119 Å²	119	71.4 Å²	71.4	45%	0.449	32%	0.322	S	S	.	.	H	α-helix	trans	-102.9	-27.7	-171.1	-64.6	-175.2	-176.5	-176.1	3.6	113.5	V241 T242 D243 H251 W277 D278	V241-R245 WeakPolarHBondContact O-CB 3.45Å; V241-R245 WeakPolarHBondContact O-CG 3.41Å; V241-R245 PolarHBondContact O-N 2.65Å; T242-R245 PolarHBondContact O-N 3.28Å; D243-R245 PolarHBondContact O-N 3.19Å; R245-H251 VanDerWaalsContact O-CB 3.31Å; R245-H251 WeakPolarHBondContact O-CB 3.43Å; R245-H251 PolarHBondContact O-ND1 2.87Å; R245-W277 HydrophobicContact CB-CH2 3.85Å; R245-W277 HydrophobicContact CB-CZ3 4.46Å; R245-W277 HydrophobicContact CG-CH2 4.41Å; R245-D278 IonicContact NH1-OD2 3.6Å
246	L	83.8	Confident	85.2	Confident	2 Å²	2	70 Å²	70	1%	0.01	32%	0.32	C	S	.	.			trans	-110.5	38.6	-168.9	-57.9	176.1	0	0	0	113.6	L211 S212 T242 H251 L252 F255 W277	L211-L246 HydrophobicContact CB-CD1 4.32Å; L211-L246 HydrophobicContact CD1-CD1 4.49Å; L211-L246 HydrophobicContact CD2-CD1 4.43Å; S212-L246 WeakPolarHBondContact CB-O 3.23Å; S212-L246 PolarHBondContact OG-O 2.73Å; T242-L246 HydrophobicContact CG2-CD1 4.03Å; T242-L246 WeakPolarHBondContact O-CA 3.35Å; T242-L246 WeakPolarHBondContact O-CB 3.26Å; T242-L246 PolarHBondContact O-N 3.21Å; L246-H251 HydrophobicContact CD2-CB 4.2Å; L246-L252 HydrophobicContact CB-CD2 3.84Å; L246-L252 HydrophobicContact CB-CG 4.36Å; L246-L252 HydrophobicContact CD2-CD2 4.47Å; L246-F255 HydrophobicContact CD1-CD1 4.5Å; L246-F255 HydrophobicContact CD1-CD2 3.61Å; L246-F255 HydrophobicContact CD1-CE2 3.65Å; L246-F255 HydrophobicContact CD1-CG 4.05Å; L246-F255 HydrophobicContact CD1-CZ 4.12Å; L246-F255 HydrophobicContact CD2-CB 4.07Å; L246-F255 HydrophobicContact CD2-CD2 3.9Å; L246-F255 HydrophobicContact CD2-CG 4.18Å; L246-F255 HydrophobicContact CG-CD2 4.39Å; L246-W277 HydrophobicContact CD1-CH2 4.34Å; L246-W277 HydrophobicContact CD2-CH2 4.15Å; L246-W277 HydrophobicContact CD2-CZ2 4.34Å; L246-W277 HydrophobicContact CG-CH2 4.14Å
247	Q	81.7	Confident	85.4	Confident	78 Å²	78	68.9 Å²	68.9	36%	0.364	32%	0.316	S	S	.	.	S	Bend	trans	-84.9	-31.6	173.6	-70.4	-70.2	-14.9	0	0	112.5	S213 D243	S213-Q247 PolarHBondContact O-NE2 3.08Å; S213-Q247 VanDerWaalsContact O-NE2 3.1Å; D243-Q247 WeakPolarHBondContact O-CG 3.5Å; D243-Q247 PolarHBondContact O-NE2 2.82Å; D243-Q247 PolarHBondContact OD1-NE2 2.81Å
248	E	84.7	Confident	85.7	Confident	113 Å²	113	67.5 Å²	67.5	53%	0.528	31%	0.31	S	S	.	.	S	Bend	trans	-93.1	142.6	-178.3	-65	-172.1	-171.2	0	0	112.7	R250 H251 L252	E248-R250 PolarHBondContact O-N 3.24Å; E248-R250 VanDerWaalsContact O-N 3.14Å; E248-H251 PolarHBondContact O-N 2.98Å; E248-H251 VanDerWaalsContact O-N 3.09Å; E248-L252 PolarHBondContact O-N 3.49Å; E248-L252 VanDerWaalsContact O-N 3.1Å
249	E	86.3	Confident	86	Confident	85 Å²	85	67.4 Å²	67.4	40%	0.397	31%	0.309	S	S	.	.	H	α-helix	trans	-56.2	-33.2	178.5	-57.5	-168.5	161.4	0	0	112.8	F182 R197 L252 A253	F182-E249 HydrophobicContact CD2-CG 4.06Å; F182-E249 WeakPolarHBondContact CD2-OE1 3.12Å; F182-E249 HydrophobicContact CE2-CG 3.94Å; R197-E249 IonicContact NH1-OE1 2.75Å; R197-E249 PolarHBondContact NH1-OE1 3.14Å; E249-L252 PolarHBondContact O-N 2.77Å; E249-A253 PolarHBondContact O-N 2.89Å
250	R	85.7	Confident	86.1	Confident	195 Å²	195	69.4 Å²	69.4	74%	0.736	32%	0.317	S	S	*	.	H	α-helix	trans	-66.2	-41.8	179	-66.6	-178.9	179.9	-178.2	1.7	112.3	E248 A253 Q254	E248-R250 PolarHBondContact O-N 3.24Å; E248-R250 VanDerWaalsContact O-N 3.14Å; R250-A253 PolarHBondContact O-N 3.18Å; R250-Q254 PolarHBondContact O-N 3.07Å
251	H	86.1	Confident	86.4	Confident	84 Å²	84	61.8 Å²	61.8	39%	0.389	29%	0.29	S	S	.	.	H	α-helix	trans	-72.1	-37.3	178.4	-61.4	164.8	0	0	0	110.9	R245 L246 E248 A253 Q254 F255	R245-H251 VanDerWaalsContact O-CB 3.31Å; R245-H251 WeakPolarHBondContact O-CB 3.43Å; R245-H251 PolarHBondContact O-ND1 2.87Å; L246-H251 HydrophobicContact CD2-CB 4.2Å; E248-H251 PolarHBondContact O-N 2.98Å; E248-H251 VanDerWaalsContact O-N 3.09Å; H251-A253 VanDerWaalsContact C-N 3.26Å; H251-A253 PolarHBondContact O-N 3.36Å; H251-Q254 PolarHBondContact O-N 2.81Å; H251-F255 PolarHBondContact O-N 2.5Å
252	L	86.3	Confident	86.4	Confident	0 Å²	0	61.8 Å²	61.8	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-60.7	-34.6	172.8	-72.7	164.6	0	0	0	112.3	N65 L177 F182 V195 L211 L246 E248 E249 F255 H303	N65-L252 PolarHBondContact ND2-O 2.75Å; L177-L252 HydrophobicContact CD2-CB 3.95Å; L177-L252 WeakPolarHBondContact CD2-O 2.98Å; F182-L252 HydrophobicContact CE2-CD1 4.32Å; F182-L252 HydrophobicContact CZ-CD1 4.14Å; V195-L252 HydrophobicContact CG1-CD2 4.26Å; L211-L252 HydrophobicContact CD1-CD2 4.15Å; L246-L252 HydrophobicContact CB-CD2 3.84Å; L246-L252 HydrophobicContact CB-CG 4.36Å; L246-L252 HydrophobicContact CD2-CD2 4.47Å; E248-L252 PolarHBondContact O-N 3.49Å; E248-L252 VanDerWaalsContact O-N 3.1Å; E249-L252 PolarHBondContact O-N 2.77Å; L252-F255 WeakPolarHBondContact O-CB 3.38Å; L252-F255 PolarHBondContact O-N 2.67Å; L252-H303 HydrophobicContact CD1-CB 4.35Å; L252-H303 HydrophobicContact CD2-CB 4.29Å
253	A	86.7	Confident	86.5	Confident	38 Å²	38	66.9 Å²	66.9	31%	0.314	31%	0.312	S	S	.	.	H	α-helix	trans	-72.8	-28.3	176.6	0	0	0	0	0	113.7	L177 E249 R250 H251	L177-A253 HydrophobicContact CD2-CB 4.35Å; E249-A253 PolarHBondContact O-N 2.89Å; R250-A253 PolarHBondContact O-N 3.18Å; H251-A253 VanDerWaalsContact C-N 3.26Å; H251-A253 PolarHBondContact O-N 3.36Å
254	Q	86.4	Confident	86.6	Confident	146 Å²	146	66.9 Å²	66.9	68%	0.682	31%	0.312	S	S	*	.	H	α-helix	trans	-88.7	-8.3	177.2	-66.7	175.8	8.4	0	0	112.8	R250 H251 N256	R250-Q254 PolarHBondContact O-N 3.07Å; H251-Q254 PolarHBondContact O-N 2.81Å; Q254-N256 PolarHBondContact O-N 2.88Å
255	F	87.1	Confident	86.6	Confident	4 Å²	4	60.6 Å²	60.6	2%	0.018	28%	0.284	C	S	.	.			trans	-64.4	120.1	-179	-176.6	-116.9	0	0	0	111.1	A64 N65 L211 L246 H251 L252 A257 M275 W277 L305	A64-F255 HydrophobicContact CB-CD1 3.45Å; A64-F255 VanDerWaalsContact CB-CD1 3.45Å; A64-F255 HydrophobicContact CB-CE1 3.58Å; A64-F255 HydrophobicContact CB-CG 4.41Å; N65-F255 PolarHBondContact ND2-O 3.09Å; L211-F255 HydrophobicContact CD1-CD1 4.19Å; L211-F255 HydrophobicContact CD1-CE1 3.98Å; L211-F255 HydrophobicContact CD2-CE1 3.83Å; L211-F255 HydrophobicContact CD2-CZ 3.89Å; L246-F255 HydrophobicContact CD1-CD1 4.5Å; L246-F255 HydrophobicContact CD1-CD2 3.61Å; L246-F255 HydrophobicContact CD1-CE2 3.65Å; L246-F255 HydrophobicContact CD1-CG 4.05Å; L246-F255 HydrophobicContact CD1-CZ 4.12Å; L246-F255 HydrophobicContact CD2-CB 4.07Å; L246-F255 HydrophobicContact CD2-CD2 3.9Å; L246-F255 HydrophobicContact CD2-CG 4.18Å; L246-F255 HydrophobicContact CG-CD2 4.39Å; H251-F255 PolarHBondContact O-N 2.5Å; L252-F255 WeakPolarHBondContact O-CB 3.38Å; L252-F255 PolarHBondContact O-N 2.67Å; F255-A257 HydrophobicContact CD2-CB 4.42Å; F255-A257 HydrophobicContact CE1-CB 3.97Å; F255-A257 HydrophobicContact CE2-CB 3.59Å; F255-A257 HydrophobicContact CZ-CB 3.33Å; F255-M275 HydrophobicContact CZ-SD 4.14Å; F255-W277 HydrophobicContact CD2-CD2 4.24Å; F255-W277 AromaticContact CD2-CE2 3.7Å; F255-W277 HydrophobicContact CD2-CH2 4.35Å; F255-W277 AromaticContact CD2-CZ2 3.8Å; F255-W277 HydrophobicContact CD2-CZ2 3.8Å; F255-W277 AromaticContact CD2-NE1 3.9Å; F255-W277 AromaticContact CE2-CD2 3.8Å; F255-W277 HydrophobicContact CE2-CD2 3.8Å; F255-W277 AromaticContact CE2-CE2 3.77Å; F255-W277 HydrophobicContact CE2-CE3 4.15Å; F255-W277 HydrophobicContact CE2-CG 4.16Å; F255-W277 HydrophobicContact CE2-CH2 4.41Å; F255-W277 HydrophobicContact CE2-CZ2 4.11Å; F255-W277 HydrophobicContact CE2-CZ3 4.43Å; F255-L305 HydrophobicContact CE1-CD2 4.45Å
256	N	88.3	Confident	86	Confident	95 Å²	95	59.6 Å²	59.6	51%	0.508	29%	0.287	S	S	.	.			trans	-133.1	33.2	-170.8	66.8	-15.2	0	0	0	112.7	Q254	Q254-N256 PolarHBondContact O-N 2.88Å
257	A	89.4	Confident	85.5	Confident	1 Å²	1	63.5 Å²	63.5	1%	0.008	30%	0.302	C	S	.	.			trans	-66.4	147.8	179.4	0	0	0	0	0	112.7	A64 F255 I259 M275 L276 W277	A64-A257 PolarHBondContact N-O 2.92Å; F255-A257 HydrophobicContact CD2-CB 4.42Å; F255-A257 HydrophobicContact CE1-CB 3.97Å; F255-A257 HydrophobicContact CE2-CB 3.59Å; F255-A257 HydrophobicContact CZ-CB 3.33Å; A257-I259 HydrophobicContact CB-CD1 4.38Å; A257-M275 HydrophobicContact CB-CG 3.93Å; A257-M275 HydrophobicContact CB-SD 4.2Å; A257-L276 WeakPolarHBondContact CA-O 3.42Å; A257-W277 HydrophobicContact CB-CB 3.99Å; A257-W277 HydrophobicContact CB-CG 4.07Å
258	L	91.3	Very high	85.1	Confident	47 Å²	47	62.5 Å²	62.5	25%	0.246	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	121.7	170.9	178.2	70	0	0	0	108.9	K61 K63 L276	K61-L258 HydrophobicContact CB-CD1 4.48Å; K63-L258 HydrophobicContact CB-CD1 4.38Å; L258-L276 HydrophobicContact CB-CB 4.41Å; L258-L276 HydrophobicContact CD2-CD1 4.42Å; L258-L276 PolarHBondContact N-O 2.7Å; L258-L276 PolarHBondContact O-N 3.33Å
259	I	91.1	Very high	84.5	Confident	0 Å²	0	63.3 Å²	63.3	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	126.3	178.3	-59.9	83.3	0	0	0	107.8	K61 V62 L209 A257 M275 L284 L305 I307	K61-I259 CarbonylContact C-O 3.46Å; K61-I259 WeakPolarHBondContact CA-O 3.21Å; V62-I259 HydrophobicContact CB-CB 4.38Å; V62-I259 PolarHBondContact N-O 3.43Å; V62-I259 PolarHBondContact O-N 2.79Å; L209-I259 HydrophobicContact CD2-CG1 4.28Å; A257-I259 HydrophobicContact CB-CD1 4.38Å; I259-M275 HydrophobicContact CG1-CG 4.36Å; I259-L284 HydrophobicContact CG2-CD1 3.79Å; I259-L305 HydrophobicContact CD1-CD2 3.25Å; I259-L305 HydrophobicContact CG1-CD2 4.22Å; I259-I307 HydrophobicContact CB-CD1 4.48Å; I259-I307 HydrophobicContact CG1-CD1 4.42Å; I259-I307 HydrophobicContact CG2-CD1 4.28Å
260	E	89.2	Confident	84	Confident	72 Å²	72	63.1 Å²	63.1	34%	0.336	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	121.1	170.5	-60.1	-168.8	149.9	0	0	108.5	W60 K61 G273 T274 L276	W60-E260 WeakPolarHBondContact O-CA 3.48Å; K61-E260 HydrophobicContact CD-CG 4.36Å; K61-E260 VanDerWaalsContact CE-OE1 3.25Å; K61-E260 WeakPolarHBondContact CE-OE1 3.2Å; K61-E260 HydrophobicContact CG-CG 4.29Å; K61-E260 IonicContact NZ-OE1 2.66Å; K61-E260 PolarHBondContact NZ-OE1 3.44Å; E260-G273 CarbonylContact O-C 3.55Å; E260-G273 WeakPolarHBondContact O-CA 3.37Å; E260-T274 PolarHBondContact N-O 2.88Å; E260-T274 PolarHBondContact O-N 2.7Å; E260-L276 HydrophobicContact CG-CD1 4.02Å
261	C	87.7	Confident	84	Confident	9 Å²	9	54.2 Å²	54.2	6%	0.061	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	174.2	-177.5	67.6	0	0	0	0	112.8	W60 F271	W60-C261 WeakPolarHBondContact CB-O 3.42Å; W60-C261 VanDerWaalsContact CD1-SG 3.59Å; W60-C261 PolarHBondContact N-O 2.83Å; W60-C261 PolarHBondContact O-N 3.03Å; C261-F271 HydrophobicContact CB-CE2 3.8Å; C261-F271 HydrophobicContact CB-CZ 3.72Å
262	E	85.9	Confident	83.9	Confident	32 Å²	32	53.7 Å²	53.7	15%	0.15	27%	0.274	C	S	.	.			trans	-61.6	158.3	171.9	59.1	171.1	-168.9	0	0	112.6	W60 N265 R267 F271 T272 K314	W60-E262 WeakPolarHBondContact CB-O 3.37Å; E262-N265 PolarHBondContact OE1-ND2 3.4Å; E262-N265 PolarHBondContact OE2-ND2 2.74Å; E262-N265 VanDerWaalsContact OE2-ND2 3.12Å; E262-R267 IonicContact OE2-CZ 2.8Å; E262-R267 IonicContact OE2-NH2 2.65Å; E262-R267 PolarHBondContact OE2-NH2 2.75Å; E262-F271 HydrophobicContact CG-CD2 4.48Å; E262-F271 WeakPolarHBondContact OE1-CA 3.47Å; E262-T272 PolarHBondContact N-O 2.91Å; E262-K314 IonicContact OE1-NZ 2.77Å
263	E	87.3	Confident	83.9	Confident	110 Å²	110	54.1 Å²	54.1	51%	0.514	28%	0.279	S	S	.	.			trans	-66.7	153.4	175	-69.7	-152.6	141	0	0	112.4	R87 N265	R87-E263 IonicContact CZ-OE1 3.11Å; R87-E263 IonicContact NH2-OE1 2.73Å; R87-E263 PolarHBondContact NH2-OE1 3.46Å; E263-N265 PolarHBondContact O-N 2.8Å; E263-N265 PolarHBondContact O-ND2 3.34Å
264	P	86.1	Confident	83.9	Confident	18 Å²	18	54.9 Å²	54.9	12%	0.117	28%	0.279	C	S	.	.			trans	-49.6	115.5	174	-27.7	33.5	0	0	0	112.3	W60 F308 D312	W60-P264 HydrophobicContact CD2-CG 4.2Å; W60-P264 VanDerWaalsContact CE3-CD 3.45Å; W60-P264 HydrophobicContact CE3-CG 3.96Å; W60-P264 HydrophobicContact CH2-CG 3.72Å; W60-P264 HydrophobicContact CZ2-CG 3.95Å; W60-P264 HydrophobicContact CZ3-CG 3.72Å; P264-F308 HydrophobicContact CB-CD1 4.4Å; P264-F308 HydrophobicContact CB-CE1 4.4Å; P264-F308 HydrophobicContact CG-CD1 3.76Å; P264-F308 HydrophobicContact CG-CE1 3.72Å; P264-D312 HydrophobicContact CB-CB 4.07Å; P264-D312 WeakPolarHBondContact CB-O 3.13Å; P264-D312 HydrophobicContact CG-CB 3.91Å
265	N	83.2	Confident	84	Confident	25 Å²	25	47.9 Å²	47.9	13%	0.134	25%	0.247	C	C	.	.			trans	-127.6	174.8	-178.5	63.3	56.9	0	0	0	111.4	E262 E263 R267 K314	E262-N265 PolarHBondContact OE1-ND2 3.4Å; E262-N265 PolarHBondContact OE2-ND2 2.74Å; E262-N265 VanDerWaalsContact OE2-ND2 3.12Å; E263-N265 PolarHBondContact O-N 2.8Å; E263-N265 PolarHBondContact O-ND2 3.34Å; N265-R267 WeakPolarHBondContact OD1-CB 3.37Å; N265-R267 PolarHBondContact OD1-N 3.06Å; N265-R267 PolarHBondContact OD1-O 2.88Å; N265-K314 PolarHBondContact OD1-NZ 2.88Å
266	N	72.8	Confident	84.1	Confident	98 Å²	98	49.8 Å²	49.8	52%	0.524	26%	0.257	S	S	.	.	S	Bend	trans	-96.1	8.2	-179.4	64.2	-9.8	0	0	0	113.5	L268 R317 N318	N266-L268 PolarHBondContact O-N 3.23Å; N266-R317 HydrophobicContact CB-CB 4.23Å; N266-N318 WeakPolarHBondContact CB-OD1 3.24Å; N266-N318 PolarHBondContact O-ND2 3.04Å; N266-N318 PolarHBondContact O-OD1 2.86Å; N266-N318 VanDerWaalsContact O-OD1 3.09Å
267	R	71.9	Confident	84.1	Confident	84 Å²	84	46.3 Å²	46.3	32%	0.317	24%	0.237	S	C	.	.			trans	-85.4	111.5	178.8	-61.5	-176.3	-66.2	-159	-1.2	109.9	E262 N265 D269 K270 K314	E262-R267 IonicContact OE2-CZ 2.8Å; E262-R267 IonicContact OE2-NH2 2.65Å; E262-R267 PolarHBondContact OE2-NH2 2.75Å; N265-R267 WeakPolarHBondContact OD1-CB 3.37Å; N265-R267 PolarHBondContact OD1-N 3.06Å; N265-R267 PolarHBondContact OD1-O 2.88Å; R267-D269 VanDerWaalsContact C-N 3.33Å; R267-K270 HydrophobicContact CB-CB 4.27Å; R267-K314 WeakPolarHBondContact O-CD 3.47Å; R267-K314 PolarHBondContact O-NZ 2.93Å
268	L	73.5	Confident	83.9	Confident	56 Å²	56	51.5 Å²	51.5	29%	0.293	27%	0.265	S	S	.	.	S	Bend	trans	-76.2	-24	-179.3	-66.5	172.8	0	0	0	113	L227 N266 L286 L291 K314 N318	L227-L268 HydrophobicContact CD2-CD2 3.97Å; N266-L268 PolarHBondContact O-N 3.23Å; L268-L286 VanDerWaalsContact O-CD2 3.29Å; L268-L286 WeakPolarHBondContact O-CD2 3.29Å; L268-L291 HydrophobicContact CD2-CD1 4.27Å; L268-K314 HydrophobicContact CD2-CB 3.92Å; L268-N318 WeakPolarHBondContact CG-ND2 3.38Å
269	D	71.5	Confident	83.3	Confident	131 Å²	131	52.9 Å²	52.9	70%	0.701	29%	0.29	S	S	*	.	S	Bend	trans	-96.2	-11.9	-170.9	59.9	-36.9	0	0	0	113.9	R267 L286	R267-D269 VanDerWaalsContact C-N 3.33Å; D269-L286 WeakPolarHBondContact O-CD2 3.33Å
270	K	76.9	Confident	82.8	Confident	81 Å²	81	58.5 Å²	58.5	35%	0.352	32%	0.316	S	S	.	.			trans	-123.4	132.4	-178.9	-169.7	167.3	178.8	171.9	0	111.5	R267 K314	R267-K270 HydrophobicContact CB-CB 4.27Å; K270-K314 PolarHBondContact O-NZ 3.04Å
271	F	85.2	Confident	82.4	Confident	7 Å²	7	64 Å²	64	3%	0.031	33%	0.334	C	S	.	.			trans	-148.9	131.6	165.1	176.1	-102.2	0	0	0	108.8	C261 E262 L284 L286 M289 F308	C261-F271 HydrophobicContact CB-CE2 3.8Å; C261-F271 HydrophobicContact CB-CZ 3.72Å; E262-F271 HydrophobicContact CG-CD2 4.48Å; E262-F271 WeakPolarHBondContact OE1-CA 3.47Å; F271-L284 HydrophobicContact CE1-CB 4.02Å; F271-L286 HydrophobicContact CB-CB 4.16Å; F271-L286 HydrophobicContact CB-CD1 3.95Å; F271-M289 HydrophobicContact CB-SD 4.02Å; F271-M289 HydrophobicContact CD1-CG 3.74Å; F271-M289 HydrophobicContact CD1-SD 3.43Å; F271-M289 WeakPolarHBondContact CD1-SD 3.49Å; F271-M289 HydrophobicContact CD2-SD 3.32Å; F271-M289 WeakPolarHBondContact CD2-SD 3.44Å; F271-M289 HydrophobicContact CE1-CG 3.86Å; F271-M289 HydrophobicContact CE1-SD 3.56Å; F271-M289 VanDerWaalsContact CE1-SD 3.56Å; F271-M289 HydrophobicContact CE2-CE 4.36Å; F271-M289 HydrophobicContact CE2-SD 3.45Å; F271-M289 WeakPolarHBondContact CE2-SD 3.48Å; F271-M289 HydrophobicContact CG-CG 4.14Å; F271-M289 HydrophobicContact CG-SD 3.28Å; F271-M289 WeakPolarHBondContact CG-SD 3.27Å; F271-M289 HydrophobicContact CZ-CE 4.49Å; F271-M289 HydrophobicContact CZ-CG 4.37Å; F271-M289 HydrophobicContact CZ-SD 3.57Å; F271-M289 VanDerWaalsContact CZ-SD 3.57Å; F271-F308 HydrophobicContact CD2-CE2 4.43Å; F271-F308 HydrophobicContact CE2-CE2 4.16Å; F271-F308 HydrophobicContact CE2-CZ 4.26Å
272	T	83.9	Confident	82.3	Confident	73 Å²	73	65.9 Å²	65.9	45%	0.448	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	130.6	174.8	51.8	0	0	0	0	109.9	E262	E262-T272 PolarHBondContact N-O 2.91Å
273	G	86.8	Confident	82.2	Confident	10 Å²	10	68.7 Å²	68.7	10%	0.103	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.6	174.4	176.2	0	0	0	0	0	112.5	E260 L284	E260-G273 CarbonylContact O-C 3.55Å; E260-G273 WeakPolarHBondContact O-CA 3.37Å; G273-L284 PolarHBondContact N-O 3.35Å; G273-L284 PolarHBondContact O-N 2.75Å
274	T	85.9	Confident	82.1	Confident	53 Å²	53	63.6 Å²	63.6	33%	0.325	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	128	174.3	-58.3	0	0	0	0	108.5	E260 R281 Y282	E260-T274 PolarHBondContact N-O 2.88Å; E260-T274 PolarHBondContact O-N 2.7Å; T274-R281 HydrophobicContact CG2-CB 4.08Å; T274-R281 HydrophobicContact CG2-CG 4.43Å; T274-Y282 WeakPolarHBondContact CA-O 3.48Å
275	M	89.7	Confident	82.1	Confident	0 Å²	0	67.3 Å²	67.3	0%	0	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	122.2	171.6	-175.3	179.2	73.3	0	0	109.2	L239 T242 F255 A257 I259 W277 Y282 L284	L239-M275 HydrophobicContact CD1-CE 3.44Å; L239-M275 VanDerWaalsContact CD1-CE 3.44Å; L239-M275 HydrophobicContact CD1-SD 4.29Å; T242-M275 HydrophobicContact CG2-CE 3.86Å; T242-M275 HydrophobicContact CG2-SD 4.29Å; F255-M275 HydrophobicContact CZ-SD 4.14Å; A257-M275 HydrophobicContact CB-CG 3.93Å; A257-M275 HydrophobicContact CB-SD 4.2Å; I259-M275 HydrophobicContact CG1-CG 4.36Å; M275-W277 HydrophobicContact CE-CB 4.35Å; M275-W277 HydrophobicContact CE-CE3 4.35Å; M275-Y282 HydrophobicContact CE-CD2 3.56Å; M275-Y282 HydrophobicContact CE-CE2 4.32Å; M275-Y282 HydrophobicContact CE-CG 4.07Å; M275-Y282 PolarHBondContact N-O 2.78Å; M275-Y282 PolarHBondContact O-N 2.6Å; M275-L284 HydrophobicContact CB-CD1 4.05Å; M275-L284 HydrophobicContact CB-CD2 4.22Å; M275-L284 HydrophobicContact CB-CG 4.15Å
276	L	89.3	Confident	82.2	Confident	44 Å²	44	67.6 Å²	67.6	23%	0.23	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	115.2	169.6	-65.8	116.7	0	0	0	109	A257 L258 E260 E280 R281	A257-L276 WeakPolarHBondContact CA-O 3.42Å; L258-L276 HydrophobicContact CB-CB 4.41Å; L258-L276 HydrophobicContact CD2-CD1 4.42Å; L258-L276 PolarHBondContact N-O 2.7Å; L258-L276 PolarHBondContact O-N 3.33Å; E260-L276 HydrophobicContact CG-CD1 4.02Å; L276-E280 WeakPolarHBondContact CA-O 3.35Å; L276-R281 HydrophobicContact CD2-CG 3.88Å; L276-R281 HydrophobicContact CG-CG 4.29Å
277	W	88.2	Confident	82.8	Confident	21 Å²	21	66.9 Å²	66.9	8%	0.08	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	129.9	178.8	-169.9	33.9	0	0	0	110.4	V241 T242 R245 L246 F255 A257 M275 G279 E280	V241-W277 HydrophobicContact CG1-CE3 4.34Å; V241-W277 HydrophobicContact CG1-CZ3 3.97Å; T242-W277 HydrophobicContact CG2-CZ3 4.37Å; R245-W277 HydrophobicContact CB-CH2 3.85Å; R245-W277 HydrophobicContact CB-CZ3 4.46Å; R245-W277 HydrophobicContact CG-CH2 4.41Å; L246-W277 HydrophobicContact CD1-CH2 4.34Å; L246-W277 HydrophobicContact CD2-CH2 4.15Å; L246-W277 HydrophobicContact CD2-CZ2 4.34Å; L246-W277 HydrophobicContact CG-CH2 4.14Å; F255-W277 HydrophobicContact CD2-CD2 4.24Å; F255-W277 AromaticContact CD2-CE2 3.7Å; F255-W277 HydrophobicContact CD2-CH2 4.35Å; F255-W277 AromaticContact CD2-CZ2 3.8Å; F255-W277 HydrophobicContact CD2-CZ2 3.8Å; F255-W277 AromaticContact CD2-NE1 3.9Å; F255-W277 AromaticContact CE2-CD2 3.8Å; F255-W277 HydrophobicContact CE2-CD2 3.8Å; F255-W277 AromaticContact CE2-CE2 3.77Å; F255-W277 HydrophobicContact CE2-CE3 4.15Å; F255-W277 HydrophobicContact CE2-CG 4.16Å; F255-W277 HydrophobicContact CE2-CH2 4.41Å; F255-W277 HydrophobicContact CE2-CZ2 4.11Å; F255-W277 HydrophobicContact CE2-CZ3 4.43Å; A257-W277 HydrophobicContact CB-CB 3.99Å; A257-W277 HydrophobicContact CB-CG 4.07Å; M275-W277 HydrophobicContact CE-CB 4.35Å; M275-W277 HydrophobicContact CE-CE3 4.35Å; W277-G279 PolarHBondContact O-N 2.74Å; W277-G279 VanDerWaalsContact O-N 3.11Å; W277-E280 PolarHBondContact N-O 2.84Å; W277-E280 VanDerWaalsContact N-O 3.08Å; W277-E280 PolarHBondContact O-N 3Å
278	D	84.6	Confident	83.6	Confident	111 Å²	111	63.7 Å²	63.7	59%	0.594	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.4	30	-176.7	-63.1	-22	0	0	0	115.4	R245 E280	R245-D278 IonicContact NH1-OD2 3.6Å; D278-E280 VanDerWaalsContact C-N 3.29Å; D278-E280 PolarHBondContact O-N 2.95Å
279	G	78.1	Confident	84.5	Confident	75 Å²	75	61 Å²	61	77%	0.773	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.7	-7.2	-179.4	0	0	0	0	0	114.9	W277	W277-G279 PolarHBondContact O-N 2.74Å; W277-G279 VanDerWaalsContact O-N 3.11Å
280	E	82	Confident	85.5	Confident	119 Å²	119	54.9 Å²	54.9	56%	0.556	29%	0.293	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.2	154.3	175.3	-68.9	-64.8	150.7	0	0	111.4	L276 W277 D278 Y282	L276-E280 WeakPolarHBondContact CA-O 3.35Å; W277-E280 PolarHBondContact N-O 2.84Å; W277-E280 VanDerWaalsContact N-O 3.08Å; W277-E280 PolarHBondContact O-N 3Å; D278-E280 VanDerWaalsContact C-N 3.29Å; D278-E280 PolarHBondContact O-N 2.95Å; E280-Y282 HydrophobicContact CB-CE2 3.85Å
281	R	80.6	Confident	86.2	Confident	187 Å²	187	51.9 Å²	51.9	71%	0.706	28%	0.28	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.5	125.7	179.4	-65.1	-176.5	-178.9	-163.9	-1.2	110.4	T274 L276	T274-R281 HydrophobicContact CG2-CB 4.08Å; T274-R281 HydrophobicContact CG2-CG 4.43Å; L276-R281 HydrophobicContact CD2-CG 3.88Å; L276-R281 HydrophobicContact CG-CG 4.29Å
282	Y	84.5	Confident	86.4	Confident	49 Å²	49	52 Å²	52	19%	0.192	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	127.6	175.9	-58.2	-79.7	0	0	0	110.1	L239 V241 T274 M275 E280	L239-Y282 HydrophobicContact CD1-CG 4.3Å; V241-Y282 HydrophobicContact CB-CE1 4.36Å; V241-Y282 HydrophobicContact CG2-CD1 4.48Å; V241-Y282 HydrophobicContact CG2-CE1 3.68Å; T274-Y282 WeakPolarHBondContact CA-O 3.48Å; M275-Y282 HydrophobicContact CE-CD2 3.56Å; M275-Y282 HydrophobicContact CE-CE2 4.32Å; M275-Y282 HydrophobicContact CE-CG 4.07Å; M275-Y282 PolarHBondContact N-O 2.78Å; M275-Y282 PolarHBondContact O-N 2.6Å; E280-Y282 HydrophobicContact CB-CE2 3.85Å
283	P	84.1	Confident	86.1	Confident	90 Å²	90	48.7 Å²	48.7	58%	0.584	26%	0.261	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.4	141.8	174.2	29.7	-33.6	0	0	0	110
284	L	85.8	Confident	86.1	Confident	4 Å²	4	48.4 Å²	48.4	2%	0.021	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	132	174.4	-60.2	178.4	0	0	0	109.9	L209 L239 I259 F271 G273 M275	L209-L284 HydrophobicContact CD1-CD1 4.06Å; L209-L284 HydrophobicContact CD1-CD2 3.85Å; L209-L284 HydrophobicContact CD1-CG 4.46Å; L209-L284 HydrophobicContact CD2-CD1 3.88Å; L209-L284 HydrophobicContact CD2-CD2 4.27Å; L239-L284 HydrophobicContact CD1-CD2 3.76Å; L239-L284 HydrophobicContact CG-CD2 4.33Å; I259-L284 HydrophobicContact CG2-CD1 3.79Å; F271-L284 HydrophobicContact CE1-CB 4.02Å; G273-L284 PolarHBondContact N-O 3.35Å; G273-L284 PolarHBondContact O-N 2.75Å; M275-L284 HydrophobicContact CB-CD1 4.05Å; M275-L284 HydrophobicContact CB-CD2 4.22Å; M275-L284 HydrophobicContact CB-CG 4.15Å
285	E	85.7	Confident	86.1	Confident	95 Å²	95	48 Å²	48	44%	0.444	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	173.8	177.6	-64.6	177	-174.8	0	0	110	D287 N288	E285-D287 PolarHBondContact O-N 3.15Å; E285-N288 PolarHBondContact N-OD1 2.76Å; E285-N288 PolarHBondContact O-N 2.94Å; E285-N288 VanDerWaalsContact O-N 3.08Å; E285-N288 PolarHBondContact O-OD1 3.44Å
286	L	84.6	Confident	86.1	Confident	31 Å²	31	48 Å²	48	16%	0.162	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-60.3	-26.7	179.4	-174.8	70.7	0	0	0	112.8	K236 L268 D269 F271 N288 M289	K236-L286 PolarHBondContact NZ-O 3.48Å; L268-L286 VanDerWaalsContact O-CD2 3.29Å; L268-L286 WeakPolarHBondContact O-CD2 3.29Å; D269-L286 WeakPolarHBondContact O-CD2 3.33Å; F271-L286 HydrophobicContact CB-CB 4.16Å; F271-L286 HydrophobicContact CB-CD1 3.95Å; L286-N288 PolarHBondContact O-N 2.83Å; L286-M289 PolarHBondContact O-N 3.18Å
287	D	85.3	Confident	85.8	Confident	84 Å²	84	49 Å²	49	45%	0.449	25%	0.252	S	S	.	.	G	3₁₀ helix	trans	-69.1	-13.8	178.4	-72.9	-18.2	0	0	0	114.2	K236 M237 E285	K236-D287 WeakPolarHBondContact CD-O 3.16Å; K236-D287 IonicContact NZ-OD1 2.75Å; K236-D287 PolarHBondContact NZ-OD1 3.37Å; M237-D287 PolarHBondContact N-O 2.85Å; E285-D287 PolarHBondContact O-N 3.15Å
288	N	90.3	Very high	85.2	Confident	16 Å²	16	49.6 Å²	49.6	9%	0.086	26%	0.257	C	S	.	.	G	3₁₀ helix	trans	-90	-7.6	171.6	-47	119.4	0	0	0	112.7	L209 L210 M237 E285 L286	L209-N288 HydrophobicContact CD1-CB 3.72Å; L209-N288 WeakPolarHBondContact CD1-O 3.19Å; L210-N288 WeakPolarHBondContact CB-O 3.43Å; L210-N288 PolarHBondContact N-O 3.49Å; M237-N288 PolarHBondContact O-ND2 3.47Å; E285-N288 PolarHBondContact N-OD1 2.76Å; E285-N288 PolarHBondContact O-N 2.94Å; E285-N288 VanDerWaalsContact O-N 3.08Å; E285-N288 PolarHBondContact O-OD1 3.44Å; L286-N288 PolarHBondContact O-N 2.83Å
289	M	91.5	Very high	85.2	Confident	1 Å²	1	44.3 Å²	44.3	1%	0.005	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	144.9	-176.8	-69.3	-158.3	78.2	0	0	113.5	D207 I208 K236 F271 L286 I307	D207-M289 HydrophobicContact CB-CE 3.93Å; I208-M289 CarbonylContact O-C 3.44Å; I208-M289 VanDerWaalsContact O-CA 3.31Å; I208-M289 WeakPolarHBondContact O-CA 3.42Å; K236-M289 WeakPolarHBondContact CD-O 3.12Å; F271-M289 HydrophobicContact CB-SD 4.02Å; F271-M289 HydrophobicContact CD1-CG 3.74Å; F271-M289 HydrophobicContact CD1-SD 3.43Å; F271-M289 WeakPolarHBondContact CD1-SD 3.49Å; F271-M289 HydrophobicContact CD2-SD 3.32Å; F271-M289 WeakPolarHBondContact CD2-SD 3.44Å; F271-M289 HydrophobicContact CE1-CG 3.86Å; F271-M289 HydrophobicContact CE1-SD 3.56Å; F271-M289 VanDerWaalsContact CE1-SD 3.56Å; F271-M289 HydrophobicContact CE2-CE 4.36Å; F271-M289 HydrophobicContact CE2-SD 3.45Å; F271-M289 WeakPolarHBondContact CE2-SD 3.48Å; F271-M289 HydrophobicContact CG-CG 4.14Å; F271-M289 HydrophobicContact CG-SD 3.28Å; F271-M289 WeakPolarHBondContact CG-SD 3.27Å; F271-M289 HydrophobicContact CZ-CE 4.49Å; F271-M289 HydrophobicContact CZ-CG 4.37Å; F271-M289 HydrophobicContact CZ-SD 3.57Å; F271-M289 VanDerWaalsContact CZ-SD 3.57Å; L286-M289 PolarHBondContact O-N 3.18Å; M289-I307 HydrophobicContact CE-CB 4.1Å; M289-I307 HydrophobicContact CE-CG1 4.18Å; M289-I307 HydrophobicContact CE-CG2 4.49Å
290	L	93.2	Very high	85.6	Confident	1 Å²	1	45.6 Å²	45.6	1%	0.005	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	125.7	164.9	-36.8	177.3	0	0	0	108.9	M198 I204 I208 L210 V222 K236	M198-L290 HydrophobicContact CE-CD1 4.3Å; I204-L290 HydrophobicContact CD1-CB 3.51Å; I204-L290 HydrophobicContact CD1-CD1 4.14Å; I204-L290 HydrophobicContact CD1-CG 4.41Å; I204-L290 HydrophobicContact CG1-CB 4.41Å; I208-L290 HydrophobicContact CD1-CB 3.95Å; I208-L290 HydrophobicContact CD1-CD1 3.78Å; I208-L290 HydrophobicContact CD1-CG 4.18Å; I208-L290 HydrophobicContact CG1-CB 3.69Å; I208-L290 HydrophobicContact CG1-CD1 4.37Å; I208-L290 HydrophobicContact CG1-CG 4.22Å; I208-L290 VanDerWaalsContact CG1-O 3.3Å; I208-L290 WeakPolarHBondContact CG1-O 3.41Å; I208-L290 PolarHBondContact N-O 2.99Å; I208-L290 PolarHBondContact O-N 3.18Å; L210-L290 HydrophobicContact CB-CG 4.37Å; L210-L290 HydrophobicContact CD1-CD1 4.29Å; L210-L290 HydrophobicContact CD2-CD2 4.43Å; V222-L290 HydrophobicContact CG1-CD2 3.89Å; K236-L290 HydrophobicContact CB-CD2 3.47Å; K236-L290 VanDerWaalsContact CB-CD2 3.47Å; K236-L290 HydrophobicContact CG-CD2 3.65Å
291	L	91.2	Very high	86.1	Confident	18 Å²	18	43.6 Å²	43.6	9%	0.094	21%	0.207	C	C	.	.			trans	-90.8	152.4	-173.3	-59.1	-178.6	0	0	0	111.9	I204 D207 L227 L268 G293 C294 K314	I204-L291 WeakPolarHBondContact CB-O 3.45Å; I204-L291 WeakPolarHBondContact CG2-O 3.22Å; D207-L291 HydrophobicContact CB-CD2 4.36Å; D207-L291 WeakPolarHBondContact OD1-CA 3.28Å; L227-L291 HydrophobicContact CD1-CB 3.67Å; L227-L291 HydrophobicContact CD1-CD1 4.43Å; L227-L291 HydrophobicContact CD2-CB 4.19Å; L227-L291 HydrophobicContact CD2-CD1 4.36Å; L268-L291 HydrophobicContact CD2-CD1 4.27Å; L291-G293 PolarHBondContact O-N 3Å; L291-C294 VanDerWaalsContact O-CB 3.23Å; L291-C294 WeakPolarHBondContact O-CB 3.33Å; L291-C294 PolarHBondContact O-N 3.32Å; L291-C294 PolarHBondContact O-SG 2.82Å; L291-K314 HydrophobicContact CD2-CD 3.94Å
292	R	88.3	Confident	86.7	Confident	9 Å²	9	34.7 Å²	34.7	3%	0.034	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.7	134.5	174.2	-177.8	178.7	-173.1	145.2	16.2	111.1	N91 I93 P205 D207 L227 C294 T313 I315	N91-R292 PolarHBondContact OD1-NH1 2.87Å; I93-R292 VanDerWaalsContact CD1-CZ 3.43Å; P205-R292 PolarHBondContact O-NE 3.25Å; D207-R292 PolarHBondContact OD1-N 2.83Å; L227-R292 WeakPolarHBondContact CD2-O 3.27Å; R292-C294 VanDerWaalsContact C-N 3.32Å; R292-T313 HydrophobicContact CB-CG2 4.17Å; R292-I315 HydrophobicContact CB-CG2 3.96Å; R292-I315 HydrophobicContact CG-CG2 4.09Å
293	G	79	Confident	87.1	Confident	4 Å²	4	32.6 Å²	32.6	4%	0.041	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	93.6	-19	-177.4	0	0	0	0	0	113.3	I204 E226 L291	I204-G293 PolarHBondContact O-N 3.34Å; E226-G293 WeakPolarHBondContact CB-O 3.23Å; E226-G293 WeakPolarHBondContact OE2-CA 3.48Å; L291-G293 PolarHBondContact O-N 3Å
294	C	86.8	Confident	87.6	Confident	4 Å²	4	28.3 Å²	28.3	3%	0.027	14%	0.138	C	C	.	.			trans	-60.3	147.8	165.4	-72.4	0	0	0	0	110.5	I204 V222 E223 L227 L291 R292	I204-C294 HydrophobicContact CD1-CB 3.36Å; I204-C294 HydrophobicContact CG1-CB 4.4Å; I204-C294 PolarHBondContact N-O 3.03Å; V222-C294 HydrophobicContact CB-CB 4.12Å; V222-C294 HydrophobicContact CG1-CB 4.36Å; E223-C294 VanDerWaalsContact O-CA 3.32Å; E223-C294 WeakPolarHBondContact O-CA 3.23Å; L227-C294 HydrophobicContact CD1-CB 4.23Å; L227-C294 WeakPolarHBondContact CD1-SG 3.24Å; L291-C294 VanDerWaalsContact O-CB 3.23Å; L291-C294 WeakPolarHBondContact O-CB 3.33Å; L291-C294 PolarHBondContact O-N 3.32Å; L291-C294 PolarHBondContact O-SG 2.82Å; R292-C294 VanDerWaalsContact C-N 3.32Å
295	K	85.5	Confident	88	Confident	44 Å²	44	28.1 Å²	28.1	19%	0.191	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	132.2	172.2	-173	177.1	-178.9	-175.7	0	110.2	N201 D202 F203 V222 E223 R297	N201-K295 WeakPolarHBondContact O-CE 3.37Å; D202-K295 WeakPolarHBondContact O-CA 3.49Å; F203-K295 HydrophobicContact CD1-CB 4.15Å; F203-K295 HydrophobicContact CE1-CB 4.15Å; F203-K295 HydrophobicContact CE1-CD 4.35Å; F203-K295 HydrophobicContact CE2-CD 4.46Å; F203-K295 HydrophobicContact CZ-CD 4.18Å; V222-K295 CarbonylContact C-O 3.53Å; V222-K295 WeakPolarHBondContact CA-O 3.49Å; E223-K295 HydrophobicContact CB-CB 4.32Å; E223-K295 PolarHBondContact N-O 3.47Å; E223-K295 PolarHBondContact O-N 2.94Å; K295-R297 VanDerWaalsContact NZ-NH2 3.19Å
296	I	88.8	Confident	88.4	Confident	0 Å²	0	23.6 Å²	23.6	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	131.9	179.5	-66.9	156.3	0	0	0	109.4	M198 N201 D202 I204 V222 C302	M198-I296 HydrophobicContact CB-CD1 3.23Å; M198-I296 HydrophobicContact CE-CD1 4.11Å; M198-I296 HydrophobicContact CG-CD1 4Å; M198-I296 HydrophobicContact SD-CD1 3.67Å; N201-I296 WeakPolarHBondContact CA-O 3.48Å; N201-I296 PolarHBondContact N-O 3.25Å; D202-I296 PolarHBondContact O-N 2.92Å; I204-I296 HydrophobicContact CD1-CD1 4.46Å; I204-I296 HydrophobicContact CD1-CG1 4.03Å; I204-I296 HydrophobicContact CG1-CD1 4.09Å; I204-I296 HydrophobicContact CG1-CG1 4.13Å; V222-I296 HydrophobicContact CG1-CG1 4.48Å; I296-C302 WeakPolarHBondContact CD1-SG 3.19Å
297	R	83.2	Confident	88.8	Confident	66 Å²	66	22.1 Å²	22.1	25%	0.249	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	158.1	177.5	-61.9	-63.9	-167.6	155.3	15.3	108.8	N201 Y221 E223 L233 K295 T299	N201-R297 VanDerWaalsContact OD1-CD 3.24Å; N201-R297 WeakPolarHBondContact OD1-CD 3.47Å; N201-R297 PolarHBondContact OD1-NH1 2.74Å; Y221-R297 WeakPolarHBondContact CB-O 3.4Å; Y221-R297 PolarHBondContact O-N 3.07Å; Y221-R297 VanDerWaalsContact O-O 3.11Å; E223-R297 HydrophobicContact CB-CG 3.99Å; E223-R297 IonicContact OE1-NH2 3.55Å; E223-R297 IonicContact OE2-CZ 2.8Å; E223-R297 IonicContact OE2-NE 3.62Å; E223-R297 PolarHBondContact OE2-NE 3.48Å; E223-R297 IonicContact OE2-NH2 2.83Å; E223-R297 PolarHBondContact OE2-NH2 2.76Å; L233-R297 HydrophobicContact CD1-CB 4.05Å; L233-R297 HydrophobicContact CD2-CB 3.55Å; L233-R297 HydrophobicContact CD2-CG 3.61Å; L233-R297 HydrophobicContact CG-CB 4.48Å; K295-R297 VanDerWaalsContact NZ-NH2 3.19Å; R297-T299 PolarHBondContact O-N 2.71Å; R297-T299 PolarHBondContact O-OG1 2.95Å
298	N	76.5	Confident	89.2	Confident	33 Å²	33	18.1 Å²	18.1	18%	0.176	9%	0.087	C	C	.	.	S	Bend	trans	47.3	30.3	174	-54.2	0.3	0	0	0	115.7	Y221 L233 E536 Q546	Y221-N298 HydrophobicContact CD2-CB 3.74Å; Y221-N298 HydrophobicContact CE2-CB 4.4Å; Y221-N298 HydrophobicContact CG-CB 4.19Å; L233-N298 VanDerWaalsContact CD1-ND2 3.35Å; L233-N298 WeakPolarHBondContact CD1-ND2 3.32Å; N298-E536 PolarHBondContact OD1-OE2 2.93Å; N298-Q546 PolarHBondContact ND2-OE1 2.75Å
299	T	84.8	Confident	89.3	Confident	0 Å²	0	17.4 Å²	17.4	0%	0	8%	0.083	C	C	.	.			trans	-148.1	117.4	-179.1	-59	0	0	0	0	105.7	K200 S213 Y221 R297 F301 C302	K200-T299 VanDerWaalsContact CA-O 3.24Å; K200-T299 WeakPolarHBondContact CA-O 3.46Å; K200-T299 VanDerWaalsContact CB-O 3.26Å; K200-T299 WeakPolarHBondContact CB-O 3.38Å; K200-T299 PolarHBondContact N-O 3.14Å; S213-T299 WeakPolarHBondContact OG-CG2 3.48Å; Y221-T299 PolarHBondContact N-OG1 3.05Å; R297-T299 PolarHBondContact O-N 2.71Å; R297-T299 PolarHBondContact O-OG1 2.95Å; T299-F301 WeakPolarHBondContact CG2-O 3.32Å; T299-C302 HydrophobicContact CG2-CB 4.29Å
300	D	87	Confident	89.1	Confident	103 Å²	103	17.3 Å²	17.3	55%	0.551	8%	0.082	S	C	*	.	S	Bend	trans	-64.9	-44.9	-172.9	-75.6	-22.5	0	0	0	111.3	K199 K200 S214	K199-D300 CarbonylContact C-O 3.59Å; K199-D300 WeakPolarHBondContact CA-O 3.1Å; K200-D300 PolarHBondContact N-O 3.33Å; S214-D300 PolarHBondContact OG-N 2.94Å; S214-D300 VanDerWaalsContact OG-N 3.13Å
301	F	91	Very high	88.7	Confident	76 Å²	76	19.9 Å²	19.9	33%	0.333	10%	0.104	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	150.6	171.1	62.4	-89.7	0	0	0	111.5	M198 S214 T299 H303	M198-F301 CarbonylContact O-C 3.45Å; M198-F301 WeakPolarHBondContact O-CA 3.43Å; S214-F301 PolarHBondContact N-O 2.81Å; T299-F301 WeakPolarHBondContact CG2-O 3.32Å; F301-H303 AromaticContact CD2-CE1 3.69Å; F301-H303 AromaticContact CE2-CE1 3.71Å
302	C	93	Very high	88.6	Confident	0 Å²	0	19.4 Å²	19.4	0%	0	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	153.4	166.8	63.1	0	0	0	0	111.2	M198 L210 S212 I296 T299	M198-C302 WeakPolarHBondContact CE-SG 3.47Å; M198-C302 PolarHBondContact N-O 3.19Å; M198-C302 PolarHBondContact O-N 2.88Å; L210-C302 HydrophobicContact CD1-CB 3.92Å; S212-C302 CarbonylContact O-C 3.23Å; S212-C302 WeakPolarHBondContact O-CA 3.38Å; I296-C302 WeakPolarHBondContact CD1-SG 3.19Å; T299-C302 HydrophobicContact CG2-CB 4.29Å
303	H	93.8	Very high	88.6	Confident	6 Å²	6	19 Å²	19	3%	0.028	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	131.6	177.6	-53.8	108.1	0	0	0	109.1	F182 V196 L211 S212 L252 F301	F182-H303 AromaticContact CZ-CD2 3.63Å; V196-H303 WeakPolarHBondContact O-CA 3.36Å; L211-H303 PolarHBondContact N-O 2.98Å; S212-H303 PolarHBondContact N-O 3.34Å; S212-H303 PolarHBondContact O-N 3.46Å; S212-H303 PolarHBondContact OG-ND1 2.88Å; L252-H303 HydrophobicContact CD1-CB 4.35Å; L252-H303 HydrophobicContact CD2-CB 4.29Å; F301-H303 AromaticContact CD2-CE1 3.69Å; F301-H303 AromaticContact CE2-CE1 3.71Å
304	G	93.6	Very high	88.8	Confident	0 Å²	0	18.8 Å²	18.8	0%	0	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	154	179.4	0	0	0	0	0	113.1	V195 V196 L209	V195-G304 CarbonylContact C-O 3.58Å; V195-G304 WeakPolarHBondContact CA-O 3.43Å; V196-G304 WeakPolarHBondContact CG2-O 3.16Å; V196-G304 PolarHBondContact N-O 2.92Å; V196-G304 PolarHBondContact O-N 3.15Å; L209-G304 CarbonylContact O-C 3.54Å; L209-G304 WeakPolarHBondContact O-CA 3.48Å
305	L	94.6	Very high	88.4	Confident	0 Å²	0	20.2 Å²	20.2	0%	0	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	128.3	175.9	178.1	70.6	0	0	0	110.6	A64 G193 V195 I208 L209 L211 F255 I259 I307	A64-L305 HydrophobicContact CB-CD1 3.9Å; A64-L305 HydrophobicContact CB-CD2 4.06Å; G193-L305 WeakPolarHBondContact O-CD1 3.36Å; V195-L305 HydrophobicContact CG2-CD1 3.92Å; I208-L305 CarbonylContact C-O 3.55Å; I208-L305 WeakPolarHBondContact CA-O 3.26Å; L209-L305 HydrophobicContact CB-CB 4.37Å; L209-L305 PolarHBondContact N-O 2.86Å; L209-L305 PolarHBondContact O-N 3.39Å; L211-L305 HydrophobicContact CD1-CB 4.18Å; L211-L305 HydrophobicContact CD2-CB 4.41Å; L211-L305 HydrophobicContact CG-CB 4.35Å; F255-L305 HydrophobicContact CE1-CD2 4.45Å; I259-L305 HydrophobicContact CD1-CD2 3.25Å; I259-L305 HydrophobicContact CG1-CD2 4.22Å; L305-I307 HydrophobicContact CD2-CD1 4.16Å; L305-I307 HydrophobicContact CG-CD1 4.35Å; L305-I307 PolarHBondContact O-N 3.05Å
306	V	95	Very high	88.1	Confident	0 Å²	0	21.4 Å²	21.4	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	118.8	-179.9	-178.4	0	0	0	0	111.6	V190 Q191 G193 D194 V196 A206 I208 A309	V190-V306 HydrophobicContact CG1-CG1 4.42Å; V190-V306 HydrophobicContact CG1-CG2 3.72Å; Q191-V306 WeakPolarHBondContact O-CB 3.45Å; Q191-V306 WeakPolarHBondContact O-CG1 3.32Å; G193-V306 PolarHBondContact N-O 3.07Å; D194-V306 HydrophobicContact CB-CG2 4.33Å; D194-V306 WeakPolarHBondContact O-CG2 3.25Å; D194-V306 PolarHBondContact O-N 2.85Å; V196-V306 HydrophobicContact CG1-CG2 3.9Å; V196-V306 HydrophobicContact CG2-CG2 4.49Å; A206-V306 HydrophobicContact CB-CG1 3.78Å; A206-V306 HydrophobicContact CB-CG2 4.44Å; I208-V306 HydrophobicContact CG2-CB 4.35Å; I208-V306 HydrophobicContact CG2-CG2 3.81Å; V306-A309 HydrophobicContact CG1-CB 4.34Å
307	I	93.6	Very high	87.5	Confident	0 Å²	0	26.6 Å²	26.6	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	-48.7	178.6	-56.5	-57.4	0	0	0	111.3	W60 V62 V192 D207 L209 I259 M289 L305	W60-I307 PolarHBondContact NE1-O 3.47Å; V62-I307 HydrophobicContact CB-CD1 4.35Å; V62-I307 HydrophobicContact CG1-CD1 4.22Å; V62-I307 HydrophobicContact CG2-CG2 4.39Å; V192-I307 WeakPolarHBondContact CG1-O 3.43Å; D207-I307 PolarHBondContact O-N 2.74Å; L209-I307 HydrophobicContact CB-CD1 4.15Å; L209-I307 HydrophobicContact CB-CG1 3.95Å; I259-I307 HydrophobicContact CB-CD1 4.48Å; I259-I307 HydrophobicContact CG1-CD1 4.42Å; I259-I307 HydrophobicContact CG2-CD1 4.28Å; M289-I307 HydrophobicContact CE-CB 4.1Å; M289-I307 HydrophobicContact CE-CG1 4.18Å; M289-I307 HydrophobicContact CE-CG2 4.49Å; L305-I307 HydrophobicContact CD2-CD1 4.16Å; L305-I307 HydrophobicContact CG-CD1 4.35Å; L305-I307 PolarHBondContact O-N 3.05Å
308	F	93.2	Very high	86.8	Confident	0 Å²	0	26 Å²	26	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	135.7	176.8	-51.1	-55.8	0	0	0	111	W60 A206 D207 P264 F271 D312 T313	W60-F308 AromaticContact CD1-CE1 3.61Å; W60-F308 HydrophobicContact CD2-CE1 4.18Å; W60-F308 AromaticContact CE2-CD1 3.85Å; W60-F308 AromaticContact CE2-CE1 3.82Å; W60-F308 HydrophobicContact CG-CE1 4.04Å; W60-F308 HydrophobicContact CZ2-CD1 4.09Å; W60-F308 HydrophobicContact CZ2-CE1 4.45Å; W60-F308 AromaticContact NE1-CD1 3.58Å; W60-F308 AromaticContact NE1-CE1 3.46Å; A206-F308 WeakPolarHBondContact CB-O 3.42Å; D207-F308 HydrophobicContact CB-CB 4.02Å; D207-F308 HydrophobicContact CB-CD2 3.97Å; D207-F308 HydrophobicContact CB-CG 4.46Å; D207-F308 PolarHBondContact N-O 3.47Å; D207-F308 PolarHBondContact O-N 2.86Å; P264-F308 HydrophobicContact CB-CD1 4.4Å; P264-F308 HydrophobicContact CB-CE1 4.4Å; P264-F308 HydrophobicContact CG-CD1 3.76Å; P264-F308 HydrophobicContact CG-CE1 3.72Å; F271-F308 HydrophobicContact CD2-CE2 4.43Å; F271-F308 HydrophobicContact CE2-CE2 4.16Å; F271-F308 HydrophobicContact CE2-CZ 4.26Å; F308-D312 HydrophobicContact CB-CB 4.37Å; F308-D312 WeakPolarHBondContact CB-O 3.35Å; F308-T313 HydrophobicContact CB-CG2 4.37Å; F308-T313 VanDerWaalsContact O-CG2 3.31Å; F308-T313 WeakPolarHBondContact O-CG2 2.88Å
309	A	92	Very high	85.9	Confident	0 Å²	0	26.1 Å²	26.1	0%	0	14%	0.142	C	C	.	.			trans	-125.4	146.8	-177.4	0	0	0	0	0	112	N91 V192 V306 A311 D312	N91-A309 HydrophobicContact CB-CB 4.14Å; V192-A309 HydrophobicContact CG2-CB 3.83Å; V306-A309 HydrophobicContact CG1-CB 4.34Å; A309-A311 PolarHBondContact O-N 3.1Å; A309-D312 PolarHBondContact O-N 3.35Å; A309-D312 VanDerWaalsContact O-N 3.08Å
310	G	87.9	Confident	84.6	Confident	0 Å²	0	28.7 Å²	28.7	0%	0	17%	0.169	C	C	.	.	G	3₁₀ helix	trans	57.9	-124.2	173.3	0	0	0	0	0	113.2	G90 N91 D312 T313 M316	G90-G310 WeakPolarHBondContact O-CA 3.46Å; N91-G310 PolarHBondContact OD1-N 2.97Å; G310-D312 PolarHBondContact O-N 2.73Å; G310-T313 PolarHBondContact O-N 3.43Å; G310-T313 PolarHBondContact O-OG1 3.09Å; G310-M316 WeakPolarHBondContact O-CG 3.32Å
311	A	83.6	Confident	83	Confident	55 Å²	55	33.7 Å²	33.7	46%	0.455	19%	0.186	S	C	.	.	G	3₁₀ helix	trans	-64.1	-17.6	-179.7	0	0	0	0	0	114.1	A309 R317	A309-A311 PolarHBondContact O-N 3.1Å; A311-R317 PolarHBondContact O-NE 3.26Å
312	D	89.1	Confident	81.3	Confident	8 Å²	8	36 Å²	36	4%	0.043	21%	0.206	C	C	.	.	G	3₁₀ helix	trans	-85.8	-8.2	178.5	-64.2	-39.6	0	0	0	113.1	S89 P264 F308 A309 G310 R317	S89-D312 WeakPolarHBondContact CB-OD2 3.4Å; S89-D312 PolarHBondContact N-OD2 3.28Å; S89-D312 PolarHBondContact OG-OD2 3.35Å; P264-D312 HydrophobicContact CB-CB 4.07Å; P264-D312 WeakPolarHBondContact CB-O 3.13Å; P264-D312 HydrophobicContact CG-CB 3.91Å; F308-D312 HydrophobicContact CB-CB 4.37Å; F308-D312 WeakPolarHBondContact CB-O 3.35Å; A309-D312 PolarHBondContact O-N 3.35Å; A309-D312 VanDerWaalsContact O-N 3.08Å; G310-D312 PolarHBondContact O-N 2.73Å; D312-R317 IonicContact OD1-CZ 2.63Å; D312-R317 IonicContact OD1-NH2 3.11Å; D312-R317 PolarHBondContact OD1-NH2 3.4Å
313	T	87.8	Confident	79.5	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	25%	0.248	C	C	.	.	S	Bend	trans	-66.9	145.6	174.7	57	0	0	0	0	111.9	D207 R292 F308 G310 I315 M316 R317	D207-T313 VanDerWaalsContact OD2-CA 3.24Å; D207-T313 WeakPolarHBondContact OD2-CA 3.4Å; R292-T313 HydrophobicContact CB-CG2 4.17Å; F308-T313 HydrophobicContact CB-CG2 4.37Å; F308-T313 VanDerWaalsContact O-CG2 3.31Å; F308-T313 WeakPolarHBondContact O-CG2 2.88Å; G310-T313 PolarHBondContact O-N 3.43Å; G310-T313 PolarHBondContact O-OG1 3.09Å; T313-I315 PolarHBondContact O-N 3.43Å; T313-M316 PolarHBondContact O-N 2.99Å; T313-M316 VanDerWaalsContact OG1-CG 3.26Å; T313-M316 WeakPolarHBondContact OG1-CG 3.43Å; T313-R317 PolarHBondContact O-N 3.49Å
314	K	84.3	Confident	78.1	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-58.2	-34.9	-177.4	-68.2	177.8	174.4	-85.4	0	112.2	D207 E262 N265 R267 L268 K270 L291 R317 N318	D207-K314 PolarHBondContact OD2-N 3.2Å; E262-K314 IonicContact OE1-NZ 2.77Å; N265-K314 PolarHBondContact OD1-NZ 2.88Å; R267-K314 WeakPolarHBondContact O-CD 3.47Å; R267-K314 PolarHBondContact O-NZ 2.93Å; L268-K314 HydrophobicContact CD2-CB 3.92Å; K270-K314 PolarHBondContact O-NZ 3.04Å; L291-K314 HydrophobicContact CD2-CD 3.94Å; K314-R317 PolarHBondContact O-N 3.28Å; K314-N318 PolarHBondContact O-N 3.08Å; K314-N318 VanDerWaalsContact O-N 3.08Å; K314-N318 PolarHBondContact O-ND2 3.39Å
315	I	78.7	Confident	77	Confident	34 Å²	34	55.8 Å²	55.8	17%	0.174	29%	0.286	C	S	.	.	H	α-helix	trans	-64	-42.9	175.4	-167	171.4	0	0	0	112.5	L227 R292 T313 N318 G319	L227-I315 HydrophobicContact CD2-CB 3.88Å; L227-I315 HydrophobicContact CD2-CD1 4.06Å; L227-I315 HydrophobicContact CD2-CG1 4.12Å; L227-I315 HydrophobicContact CG-CD1 4.37Å; R292-I315 HydrophobicContact CB-CG2 3.96Å; R292-I315 HydrophobicContact CG-CG2 4.09Å; T313-I315 PolarHBondContact O-N 3.43Å; I315-N318 PolarHBondContact O-N 3.49Å; I315-G319 PolarHBondContact O-N 3.4Å
316	M	78.2	Confident	76.2	Confident	69 Å²	69	63.6 Å²	63.6	34%	0.34	32%	0.315	S	S	.	.	H	α-helix	trans	-72.6	-33.8	-179.6	-67.8	-59.3	-65.2	0	0	111.8	I93 G310 T313 N318 G319	I93-M316 HydrophobicContact CD1-SD 4.08Å; I93-M316 HydrophobicContact CG1-CE 4.4Å; I93-M316 HydrophobicContact CG1-SD 4.38Å; I93-M316 HydrophobicContact CG2-CE 4.17Å; G310-M316 WeakPolarHBondContact O-CG 3.32Å; T313-M316 PolarHBondContact O-N 2.99Å; T313-M316 VanDerWaalsContact OG1-CG 3.26Å; T313-M316 WeakPolarHBondContact OG1-CG 3.43Å; M316-N318 VanDerWaalsContact C-N 3.3Å; M316-N318 PolarHBondContact O-N 3.4Å; M316-G319 PolarHBondContact O-N 3.24Å
317	R	77.2	Confident	75.7	Confident	108 Å²	108	63.6 Å²	63.6	41%	0.408	32%	0.316	S	S	.	.	H	α-helix	trans	-64.9	-33.1	171.9	-68.6	-70.9	179.2	157.1	2.9	112.3	N266 A311 D312 T313 K314	N266-R317 HydrophobicContact CB-CB 4.23Å; A311-R317 PolarHBondContact O-NE 3.26Å; D312-R317 IonicContact OD1-CZ 2.63Å; D312-R317 IonicContact OD1-NH2 3.11Å; D312-R317 PolarHBondContact OD1-NH2 3.4Å; T313-R317 PolarHBondContact O-N 3.49Å; K314-R317 PolarHBondContact O-N 3.28Å
318	N	67.4	Low	75.3	Confident	54 Å²	54	67.3 Å²	67.3	29%	0.289	33%	0.332	S	S	.	.	H	α-helix	trans	-78.6	-20.8	173.2	-85.9	-46.7	0	0	0	114.6	N266 L268 K314 I315 M316 G320	N266-N318 WeakPolarHBondContact CB-OD1 3.24Å; N266-N318 PolarHBondContact O-ND2 3.04Å; N266-N318 PolarHBondContact O-OD1 2.86Å; N266-N318 VanDerWaalsContact O-OD1 3.09Å; L268-N318 WeakPolarHBondContact CG-ND2 3.38Å; K314-N318 PolarHBondContact O-N 3.08Å; K314-N318 VanDerWaalsContact O-N 3.08Å; K314-N318 PolarHBondContact O-ND2 3.39Å; I315-N318 PolarHBondContact O-N 3.49Å; M316-N318 VanDerWaalsContact C-N 3.3Å; M316-N318 PolarHBondContact O-N 3.4Å; N318-G320 PolarHBondContact O-N 3.04Å; N318-G320 VanDerWaalsContact O-N 3.14Å
319	G	58.1	Low	75	Confident	35 Å²	35	67.7 Å²	67.7	36%	0.361	33%	0.334	S	S	.	.	H	α-helix	trans	-55.7	-32.6	-178.9	0	0	0	0	0	114	I315 M316 K896	I315-G319 PolarHBondContact O-N 3.4Å; M316-G319 PolarHBondContact O-N 3.24Å; G319-K896 PolarHBondContact O-NZ 3.04Å
320	G	56.9	Low	74.7	Confident	55 Å²	55	68.6 Å²	68.6	57%	0.567	34%	0.338	S	S	*	.			trans	60.7	165.6	178.9	0	0	0	0	0	114.3	N318	N318-G320 PolarHBondContact O-N 3.04Å; N318-G320 VanDerWaalsContact O-N 3.14Å
321	K	55	Low	74.5	Confident	208 Å²	208	73.9 Å²	73.9	90%	0.904	36%	0.363	S	S	*	.	P	Polyproline II helix	trans	-77.9	125.1	170.6	-69.5	-179.6	-177.6	173.5	0	109.4	R323	K321-R323 PolarHBondContact O-N 3.21Å
322	T	53.8	Low	74.6	Confident	125 Å²	125	72.8 Å²	72.8	77%	0.767	35%	0.35	S	S	*	.	P	Polyproline II helix	trans	-65.6	118.5	174.7	47.8	0	0	0	0	110
323	R	55.6	Low	74.4	Confident	232 Å²	232	72.7 Å²	72.7	88%	0.875	35%	0.349	S	S	*	.	P	Polyproline II helix	trans	-83.2	132.9	176.3	-77.3	-175.9	167.8	-177.9	-2.2	110.1	K321 K325	K321-R323 PolarHBondContact O-N 3.21Å; R323-K325 PolarHBondContact O-N 3.25Å
324	F	63.9	Low	74.3	Confident	144 Å²	144	75.1 Å²	75.1	63%	0.632	36%	0.362	S	S	*	.	P	Polyproline II helix	trans	-70.7	118.3	173.1	-170.7	-93	0	0	0	109.9	R326 T436	F324-R326 HydrophobicContact CD1-CG 3.93Å; F324-R326 HydrophobicContact CE1-CG 3.97Å; F324-T436 HydrophobicContact CZ-CG2 4.32Å
325	K	72.2	Confident	74.4	Confident	44 Å²	44	81.8 Å²	81.8	19%	0.191	39%	0.388	C	S	.	.	P	Polyproline II helix	trans	-85.8	131.6	177.9	-60.1	-174.6	179.5	-174.2	0	109.6	R323 L437 I895 A898 D899 D917	R323-K325 PolarHBondContact O-N 3.25Å; K325-L437 HydrophobicContact CB-CD1 4.28Å; K325-L437 HydrophobicContact CB-CD2 3.96Å; K325-L437 HydrophobicContact CD-CD1 4Å; K325-I895 PolarHBondContact NZ-O 2.67Å; K325-A898 WeakPolarHBondContact CE-O 3.34Å; K325-A898 PolarHBondContact NZ-O 2.71Å; K325-D899 VanDerWaalsContact CD-O 3.3Å; K325-D899 WeakPolarHBondContact CD-O 3.28Å; K325-D917 IonicContact NZ-OD2 3.67Å; K325-D917 PolarHBondContact NZ-OD2 2.85Å
326	R	76.2	Confident	74.8	Confident	164 Å²	164	80.2 Å²	80.2	62%	0.619	38%	0.38	S	S	*	.			trans	-111.1	143.1	176.9	-69.6	-175.1	177.6	178.8	-0.6	109.9	F324	F324-R326 HydrophobicContact CD1-CG 3.93Å; F324-R326 HydrophobicContact CE1-CG 3.97Å
327	T	85.9	Confident	75.1	Confident	1 Å²	1	77.6 Å²	77.6	1%	0.006	37%	0.368	C	S	.	.			trans	-87.5	158.6	-179	75.4	0	0	0	0	112.1	I329 D330 E331 R408 T436 L437 E439 Q440	T327-I329 PolarHBondContact O-N 2.72Å; T327-D330 PolarHBondContact N-OD2 3.48Å; T327-D330 WeakPolarHBondContact O-CB 3.15Å; T327-D330 PolarHBondContact O-N 2.89Å; T327-D330 VanDerWaalsContact O-N 3.11Å; T327-D330 PolarHBondContact OG1-N 2.76Å; T327-E331 PolarHBondContact O-N 2.86Å; T327-R408 PolarHBondContact OG1-NH2 2.84Å; T327-T436 WeakPolarHBondContact CG2-O 3.09Å; T327-L437 HydrophobicContact CG2-CD2 3.77Å; T327-E439 WeakPolarHBondContact CB-OE1 3.38Å; T327-E439 VanDerWaalsContact CG2-OE1 3.23Å; T327-E439 WeakPolarHBondContact CG2-OE1 3.28Å; T327-E439 PolarHBondContact OG1-OE1 3.13Å; T327-Q440 HydrophobicContact CG2-CB 4.19Å
328	K	84.8	Confident	75.6	Confident	78 Å²	78	78 Å²	78	34%	0.339	37%	0.37	S	S	.	.	H	α-helix	trans	-58.7	-32.7	173.1	-73	-174.8	172.4	-175.1	0	112.1	E331 L332 K879 V881	K328-E331 PolarHBondContact O-N 2.94Å; K328-L332 WeakPolarHBondContact O-CB 3.39Å; K328-L332 PolarHBondContact O-N 3.31Å; K328-K879 PolarHBondContact NZ-O 2.69Å; K328-V881 HydrophobicContact CD-CG2 3.7Å; K328-V881 VanDerWaalsContact CE-CG2 3.46Å; K328-V881 HydrophobicContact CG-CG2 4.48Å
329	I	86.3	Confident	76.6	Confident	7 Å²	7	77.7 Å²	77.7	4%	0.036	37%	0.37	C	S	.	.	H	α-helix	trans	-69.1	-38.7	176.6	-74.4	170.6	0	0	0	110.8	T327 E331 L332 M333 E439 Y938 M941 L945	T327-I329 PolarHBondContact O-N 2.72Å; I329-E331 PolarHBondContact O-N 2.89Å; I329-L332 PolarHBondContact O-N 2.97Å; I329-M333 VanDerWaalsContact O-CB 3.26Å; I329-M333 WeakPolarHBondContact O-CB 3.48Å; I329-M333 PolarHBondContact O-N 3.23Å; I329-E439 HydrophobicContact CB-CG 4.41Å; I329-E439 HydrophobicContact CD1-CB 4.19Å; I329-E439 HydrophobicContact CD1-CG 3.57Å; I329-E439 HydrophobicContact CG1-CG 4.46Å; I329-Y938 HydrophobicContact CD1-CD2 3.94Å; I329-Y938 HydrophobicContact CD1-CE2 3.95Å; I329-M941 HydrophobicContact CD1-CG 4.21Å; I329-M941 HydrophobicContact CG2-CG 4.24Å; I329-L945 HydrophobicContact CG2-CD1 3.62Å
330	D	84.9	Confident	78.1	Confident	19 Å²	19	76.1 Å²	76.1	10%	0.102	35%	0.353	C	S	.	.	H	α-helix	trans	-61.4	-43.8	174	-72	-28.6	0	0	0	112	T327 M333 N334 R408	T327-D330 PolarHBondContact N-OD2 3.48Å; T327-D330 WeakPolarHBondContact O-CB 3.15Å; T327-D330 PolarHBondContact O-N 2.89Å; T327-D330 VanDerWaalsContact O-N 3.11Å; T327-D330 PolarHBondContact OG1-N 2.76Å; D330-M333 PolarHBondContact O-N 2.8Å; D330-N334 VanDerWaalsContact O-CG 3.32Å; D330-N334 PolarHBondContact O-N 3.49Å; D330-N334 PolarHBondContact O-ND2 2.75Å; D330-R408 VanDerWaalsContact CG-NH2 3.33Å; D330-R408 IonicContact OD1-CZ 3.89Å; D330-R408 IonicContact OD1-NH1 3.16Å; D330-R408 PolarHBondContact OD1-NH1 3.29Å; D330-R408 VanDerWaalsContact OD1-NH1 3.11Å; D330-R408 IonicContact OD1-NH2 2.7Å; D330-R408 PolarHBondContact OD1-NH2 3.2Å; D330-R408 IonicContact OD2-CZ 3.25Å; D330-R408 IonicContact OD2-NH1 3.44Å; D330-R408 IonicContact OD2-NH2 3.76Å; D330-R408 PolarHBondContact OD2-NH2 3.09Å
331	E	85.2	Confident	79.7	Confident	111 Å²	111	77.5 Å²	77.5	52%	0.519	34%	0.344	S	S	.	.	H	α-helix	trans	-60.8	-48.6	176.2	-68.3	-174.7	170	0	0	111.1	T327 K328 I329 M333 N334 Y335	T327-E331 PolarHBondContact O-N 2.86Å; K328-E331 PolarHBondContact O-N 2.94Å; I329-E331 PolarHBondContact O-N 2.89Å; E331-M333 VanDerWaalsContact C-N 3.35Å; E331-M333 PolarHBondContact O-N 3.24Å; E331-N334 PolarHBondContact O-N 2.95Å; E331-Y335 WeakPolarHBondContact O-CD2 3.43Å; E331-Y335 PolarHBondContact O-N 3.43Å; E331-Y335 VanDerWaalsContact O-N 3.12Å
332	L	86	Confident	81.4	Confident	33 Å²	33	70 Å²	70	17%	0.173	32%	0.321	C	S	.	.	H	α-helix	trans	-62.5	-40.4	178.8	-177.7	61.6	0	0	0	112.2	K328 I329 Y335 M336 F1022 Y1024	K328-L332 WeakPolarHBondContact O-CB 3.39Å; K328-L332 PolarHBondContact O-N 3.31Å; I329-L332 PolarHBondContact O-N 2.97Å; L332-Y335 WeakPolarHBondContact O-CB 3.44Å; L332-Y335 PolarHBondContact O-N 3.39Å; L332-M336 HydrophobicContact CD1-CE 3.83Å; L332-M336 HydrophobicContact CD2-CE 3.87Å; L332-M336 HydrophobicContact CG-CE 3.66Å; L332-M336 HydrophobicContact CG-SD 4.34Å; L332-M336 WeakPolarHBondContact O-CG 3.28Å; L332-M336 PolarHBondContact O-N 3.35Å; L332-F1022 HydrophobicContact CD2-CD1 3.49Å; L332-F1022 VanDerWaalsContact CD2-CD1 3.49Å; L332-F1022 HydrophobicContact CD2-CE1 3.69Å; L332-F1022 HydrophobicContact CG-CD1 4.43Å; L332-F1022 HydrophobicContact CG-CE1 4.16Å; L332-Y1024 HydrophobicContact CD1-CD2 3.78Å; L332-Y1024 HydrophobicContact CD1-CE2 3.69Å
333	M	84.7	Confident	83.2	Confident	5 Å²	5	66.8 Å²	66.8	3%	0.025	30%	0.299	C	S	.	.	H	α-helix	trans	-61.6	-45.2	176.3	179	176.8	55.7	0	0	111.5	I329 D330 E331 Y335 M336 V337 L400 Y401	I329-M333 VanDerWaalsContact O-CB 3.26Å; I329-M333 WeakPolarHBondContact O-CB 3.48Å; I329-M333 PolarHBondContact O-N 3.23Å; D330-M333 PolarHBondContact O-N 2.8Å; E331-M333 VanDerWaalsContact C-N 3.35Å; E331-M333 PolarHBondContact O-N 3.24Å; M333-Y335 VanDerWaalsContact C-N 3.32Å; M333-Y335 PolarHBondContact O-N 2.81Å; M333-M336 PolarHBondContact O-N 3.11Å; M333-V337 WeakPolarHBondContact O-CG2 3.48Å; M333-V337 PolarHBondContact O-N 3.18Å; M333-L400 HydrophobicContact CG-CD2 3.97Å; M333-L400 HydrophobicContact SD-CD1 4.4Å; M333-L400 HydrophobicContact SD-CD2 3.65Å; M333-L400 HydrophobicContact SD-CG 3.84Å; M333-Y401 HydrophobicContact CE-CD1 3.66Å; M333-Y401 HydrophobicContact CE-CE1 3.36Å; M333-Y401 HydrophobicContact SD-CD1 4.25Å; M333-Y401 HydrophobicContact SD-CE1 3.97Å
334	N	84.7	Confident	84.9	Confident	51 Å²	51	55.8 Å²	55.8	27%	0.273	26%	0.257	S	S	.	.	H	α-helix	trans	-60	-44.6	176.9	-70.6	-31.5	0	0	0	111.6	D330 E331 M336 V337 Y338 Y401	D330-N334 VanDerWaalsContact O-CG 3.32Å; D330-N334 PolarHBondContact O-N 3.49Å; D330-N334 PolarHBondContact O-ND2 2.75Å; E331-N334 PolarHBondContact O-N 2.95Å; N334-M336 PolarHBondContact O-N 3.34Å; N334-V337 PolarHBondContact O-N 2.91Å; N334-Y338 HydrophobicContact CB-CE2 4.48Å; N334-Y338 WeakPolarHBondContact O-CD2 3.33Å; N334-Y338 PolarHBondContact O-N 2.8Å; N334-Y401 PolarHBondContact OD1-OH 2.8Å
335	Y	86.2	Confident	86.3	Confident	141 Å²	141	51.9 Å²	51.9	55%	0.553	24%	0.242	S	C	*	.	H	α-helix	trans	-60	-42.5	174.8	-89.9	-59.6	0	0	0	112.9	E331 L332 M333 Y338 T339 Y1024	E331-Y335 WeakPolarHBondContact O-CD2 3.43Å; E331-Y335 PolarHBondContact O-N 3.43Å; E331-Y335 VanDerWaalsContact O-N 3.12Å; L332-Y335 WeakPolarHBondContact O-CB 3.44Å; L332-Y335 PolarHBondContact O-N 3.39Å; M333-Y335 VanDerWaalsContact C-N 3.32Å; M333-Y335 PolarHBondContact O-N 2.81Å; Y335-Y338 PolarHBondContact O-N 3.43Å; Y335-T339 PolarHBondContact O-N 3.08Å; Y335-T339 VanDerWaalsContact O-N 3.1Å; Y335-T339 PolarHBondContact O-OG1 3.21Å; Y335-Y1024 VanDerWaalsContact CB-OH 3.31Å; Y335-Y1024 WeakPolarHBondContact CB-OH 3.41Å
336	M	86.7	Confident	87.4	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-64.3	-41.2	174.7	-71.7	175.5	178.4	0	0	112.3	L332 M333 N334 Y338 T339 I340 F949 F1022 F1027	L332-M336 HydrophobicContact CD1-CE 3.83Å; L332-M336 HydrophobicContact CD2-CE 3.87Å; L332-M336 HydrophobicContact CG-CE 3.66Å; L332-M336 HydrophobicContact CG-SD 4.34Å; L332-M336 WeakPolarHBondContact O-CG 3.28Å; L332-M336 PolarHBondContact O-N 3.35Å; M333-M336 PolarHBondContact O-N 3.11Å; N334-M336 PolarHBondContact O-N 3.34Å; M336-Y338 VanDerWaalsContact C-N 3.31Å; M336-Y338 PolarHBondContact O-N 2.68Å; M336-T339 WeakPolarHBondContact O-CB 3.46Å; M336-T339 PolarHBondContact O-N 2.79Å; M336-T339 VanDerWaalsContact O-N 3.14Å; M336-I340 WeakPolarHBondContact O-CG1 3.37Å; M336-I340 PolarHBondContact O-N 3.48Å; M336-F949 HydrophobicContact CB-CZ 4.49Å; M336-F949 HydrophobicContact SD-CE2 4.11Å; M336-F1022 HydrophobicContact CE-CD1 4.35Å; M336-F1022 HydrophobicContact CE-CE1 3.58Å; M336-F1022 HydrophobicContact CE-CE2 4.33Å; M336-F1022 HydrophobicContact CE-CZ 3.57Å; M336-F1022 HydrophobicContact SD-CE1 3.68Å; M336-F1022 HydrophobicContact SD-CE2 4.42Å; M336-F1022 HydrophobicContact SD-CZ 3.39Å; M336-F1022 WeakPolarHBondContact SD-CZ 3.39Å; M336-F1027 HydrophobicContact CB-CD2 4.36Å; M336-F1027 HydrophobicContact CB-CE2 4.27Å; M336-F1027 HydrophobicContact CE-CB 3.56Å; M336-F1027 HydrophobicContact CE-CD2 4.42Å; M336-F1027 HydrophobicContact CE-CG 4.15Å; M336-F1027 HydrophobicContact CG-CD2 4.08Å; M336-F1027 HydrophobicContact CG-CE2 4.46Å; M336-F1027 HydrophobicContact CG-CG 4.2Å; M336-F1027 HydrophobicContact SD-CB 4.04Å; M336-F1027 HydrophobicContact SD-CD2 3.75Å; M336-F1027 HydrophobicContact SD-CG 4.05Å
337	V	84.9	Confident	88.2	Confident	15 Å²	15	49.7 Å²	49.7	9%	0.091	25%	0.245	C	C	.	.	H	α-helix	trans	-60.7	-40.9	175.7	171	0	0	0	0	111.1	M333 N334 T339 I340 F341 V396	M333-V337 WeakPolarHBondContact O-CG2 3.48Å; M333-V337 PolarHBondContact O-N 3.18Å; N334-V337 PolarHBondContact O-N 2.91Å; V337-T339 VanDerWaalsContact C-N 3.35Å; V337-T339 PolarHBondContact O-N 2.92Å; V337-I340 PolarHBondContact O-N 3.05Å; V337-F341 WeakPolarHBondContact O-CB 3.38Å; V337-F341 PolarHBondContact O-N 2.8Å; V337-V396 HydrophobicContact CG1-CG1 4.02Å
338	Y	87.6	Confident	88.6	Confident	117 Å²	117	49.6 Å²	49.6	46%	0.459	25%	0.245	S	C	.	.	H	α-helix	trans	-61.9	-41.4	173.4	-64.1	-45.2	0	0	0	112.6	V115 N334 Y335 M336 I340 F341 A342	V115-Y338 HydrophobicContact CG1-CE1 4.13Å; N334-Y338 HydrophobicContact CB-CE2 4.48Å; N334-Y338 WeakPolarHBondContact O-CD2 3.33Å; N334-Y338 PolarHBondContact O-N 2.8Å; Y335-Y338 PolarHBondContact O-N 3.43Å; M336-Y338 VanDerWaalsContact C-N 3.31Å; M336-Y338 PolarHBondContact O-N 2.68Å; Y338-I340 VanDerWaalsContact C-N 3.35Å; Y338-I340 PolarHBondContact O-N 3.33Å; Y338-F341 PolarHBondContact O-N 3.03Å; Y338-A342 PolarHBondContact O-N 3.18Å
339	T	89.3	Confident	89.1	Confident	47 Å²	47	47.6 Å²	47.6	29%	0.288	24%	0.243	S	C	.	.	H	α-helix	trans	-62.7	-41	174.9	-58.3	0	0	0	0	111.9	Y335 M336 V337 A342 L343 F1027	Y335-T339 PolarHBondContact O-N 3.08Å; Y335-T339 VanDerWaalsContact O-N 3.1Å; Y335-T339 PolarHBondContact O-OG1 3.21Å; M336-T339 WeakPolarHBondContact O-CB 3.46Å; M336-T339 PolarHBondContact O-N 2.79Å; M336-T339 VanDerWaalsContact O-N 3.14Å; V337-T339 VanDerWaalsContact C-N 3.35Å; V337-T339 PolarHBondContact O-N 2.92Å; T339-A342 PolarHBondContact O-N 2.97Å; T339-L343 WeakPolarHBondContact O-CB 3.23Å; T339-L343 PolarHBondContact O-N 3.09Å; T339-F1027 HydrophobicContact CG2-CE1 4.45Å
340	I	89.9	Confident	89.5	Confident	1 Å²	1	49.3 Å²	49.3	1%	0.005	26%	0.263	C	S	.	.	H	α-helix	trans	-63.7	-44.4	175.6	-66.9	170.4	0	0	0	110.6	M336 V337 Y338 A342 L343 L344 M395 V396 F949 F953 F1027	M336-I340 WeakPolarHBondContact O-CG1 3.37Å; M336-I340 PolarHBondContact O-N 3.48Å; V337-I340 PolarHBondContact O-N 3.05Å; Y338-I340 VanDerWaalsContact C-N 3.35Å; Y338-I340 PolarHBondContact O-N 3.33Å; I340-A342 VanDerWaalsContact C-N 3.34Å; I340-A342 PolarHBondContact O-N 2.73Å; I340-L343 PolarHBondContact O-N 3.42Å; I340-L344 WeakPolarHBondContact O-CB 3.38Å; I340-L344 PolarHBondContact O-N 3.11Å; I340-M395 HydrophobicContact CG2-CB 4.08Å; I340-M395 HydrophobicContact CG2-CG 3.64Å; I340-M395 WeakPolarHBondContact CG2-O 3.09Å; I340-M395 HydrophobicContact CG2-SD 3.98Å; I340-V396 HydrophobicContact CB-CG2 4.45Å; I340-V396 HydrophobicContact CG2-CG2 3.68Å; I340-F949 HydrophobicContact CD1-CD1 3.88Å; I340-F949 HydrophobicContact CD1-CE1 3.56Å; I340-F953 HydrophobicContact CD1-CE1 4.32Å; I340-F953 HydrophobicContact CD1-CZ 4.08Å; I340-F953 HydrophobicContact CG1-CE1 4.32Å; I340-F953 HydrophobicContact CG1-CZ 4.18Å; I340-F1027 HydrophobicContact CD1-CE2 4Å; I340-F1027 HydrophobicContact CD1-CZ 4.09Å; I340-F1027 HydrophobicContact CG1-CE2 4.15Å; I340-F1027 HydrophobicContact CG1-CZ 3.71Å
341	F	89.3	Confident	89.9	Confident	85 Å²	85	48.6 Å²	48.6	37%	0.373	26%	0.259	S	S	.	.	H	α-helix	trans	-61.4	-42.1	178.3	-176.9	-103	0	0	0	111.9	Y119 V337 Y338 L344 I345	Y119-F341 HydrophobicContact CD2-CD2 4Å; Y119-F341 AromaticContact CD2-CE2 3.65Å; Y119-F341 HydrophobicContact CD2-CE2 3.65Å; Y119-F341 AromaticContact CE2-CD2 3.78Å; Y119-F341 HydrophobicContact CE2-CD2 3.78Å; Y119-F341 AromaticContact CE2-CE2 3.53Å; Y119-F341 HydrophobicContact CE2-CE2 3.53Å; V337-F341 WeakPolarHBondContact O-CB 3.38Å; V337-F341 PolarHBondContact O-N 2.8Å; Y338-F341 PolarHBondContact O-N 3.03Å; F341-L344 WeakPolarHBondContact O-CB 3.28Å; F341-L344 PolarHBondContact O-N 2.6Å; F341-I345 HydrophobicContact CD1-CD1 3.91Å; F341-I345 HydrophobicContact CE1-CD1 3.41Å; F341-I345 VanDerWaalsContact CE1-CD1 3.41Å; F341-I345 HydrophobicContact CE1-CG1 4.46Å; F341-I345 HydrophobicContact CE2-CD1 4.44Å; F341-I345 HydrophobicContact CZ-CD1 3.71Å; F341-I345 HydrophobicContact CZ-CG1 4.48Å; F341-I345 WeakPolarHBondContact O-CG1 3.46Å; F341-I345 PolarHBondContact O-N 3.02Å; F341-I345 VanDerWaalsContact O-N 3.11Å
342	A	91.7	Very high	90.4	Very high	50 Å²	50	43.6 Å²	43.6	41%	0.413	24%	0.236	S	C	.	.	H	α-helix	trans	-62.5	-43.8	173.8	0	0	0	0	0	111.9	Y338 T339 I340 I345 L346	Y338-A342 PolarHBondContact O-N 3.18Å; T339-A342 PolarHBondContact O-N 2.97Å; I340-A342 VanDerWaalsContact C-N 3.34Å; I340-A342 PolarHBondContact O-N 2.73Å; A342-I345 PolarHBondContact O-N 3.37Å; A342-L346 WeakPolarHBondContact O-CG 3.23Å; A342-L346 PolarHBondContact O-N 2.86Å; A342-L346 VanDerWaalsContact O-N 3.11Å
343	L	91	Very high	90.8	Very high	58 Å²	58	46.6 Å²	46.6	30%	0.304	25%	0.251	S	S	.	.	H	α-helix	trans	-63.4	-40.9	176.5	-178.3	60.7	0	0	0	112.1	T339 I340 I345 L346 V347 M395 L1031	T339-L343 WeakPolarHBondContact O-CB 3.23Å; T339-L343 PolarHBondContact O-N 3.09Å; I340-L343 PolarHBondContact O-N 3.42Å; L343-I345 PolarHBondContact O-N 3.38Å; L343-L346 PolarHBondContact O-N 3.16Å; L343-V347 HydrophobicContact CD1-CG2 4.01Å; L343-V347 HydrophobicContact CG-CG2 4.34Å; L343-V347 WeakPolarHBondContact O-CB 3.44Å; L343-V347 VanDerWaalsContact O-CG2 3.3Å; L343-V347 WeakPolarHBondContact O-CG2 3.28Å; L343-V347 PolarHBondContact O-N 2.93Å; L343-M395 HydrophobicContact CD2-CE 3.36Å; L343-M395 HydrophobicContact CG-CE 3.89Å; L343-L1031 HydrophobicContact CD2-CD1 4.4Å; L343-L1031 HydrophobicContact CD2-CD2 4.05Å
344	L	92.2	Very high	91.1	Very high	0 Å²	0	47 Å²	47	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-58.1	-47.2	176.1	172.3	64.9	0	0	0	111.7	Y119 I340 F341 S348 I389 L392 M395	Y119-L344 WeakPolarHBondContact OH-CD2 3.29Å; I340-L344 WeakPolarHBondContact O-CB 3.38Å; I340-L344 PolarHBondContact O-N 3.11Å; F341-L344 WeakPolarHBondContact O-CB 3.28Å; F341-L344 PolarHBondContact O-N 2.6Å; L344-S348 VanDerWaalsContact O-CB 3.3Å; L344-S348 WeakPolarHBondContact O-CB 3.18Å; L344-S348 PolarHBondContact O-N 2.99Å; L344-S348 PolarHBondContact O-OG 3.16Å; L344-I389 HydrophobicContact CG-CD1 4.04Å; L344-L392 HydrophobicContact CD1-CB 3.35Å; L344-L392 HydrophobicContact CD1-CD1 4.4Å; L344-L392 WeakPolarHBondContact CD1-O 3.23Å; L344-M395 HydrophobicContact CB-SD 4.41Å
345	I	93	Very high	91.5	Very high	63 Å²	63	45.8 Å²	45.8	32%	0.323	25%	0.25	S	C	.	.	H	α-helix	trans	-62.4	-46.2	177.6	-69.5	170.3	0	0	0	110.7	F341 A342 L343 S348 A349 F385 I389	F341-I345 HydrophobicContact CD1-CD1 3.91Å; F341-I345 HydrophobicContact CE1-CD1 3.41Å; F341-I345 VanDerWaalsContact CE1-CD1 3.41Å; F341-I345 HydrophobicContact CE1-CG1 4.46Å; F341-I345 HydrophobicContact CE2-CD1 4.44Å; F341-I345 HydrophobicContact CZ-CD1 3.71Å; F341-I345 HydrophobicContact CZ-CG1 4.48Å; F341-I345 WeakPolarHBondContact O-CG1 3.46Å; F341-I345 PolarHBondContact O-N 3.02Å; F341-I345 VanDerWaalsContact O-N 3.11Å; A342-I345 PolarHBondContact O-N 3.37Å; L343-I345 PolarHBondContact O-N 3.38Å; I345-S348 PolarHBondContact O-N 3.33Å; I345-A349 VanDerWaalsContact O-CB 3.31Å; I345-A349 WeakPolarHBondContact O-CB 3.4Å; I345-A349 PolarHBondContact O-N 3.01Å; I345-F385 HydrophobicContact CG2-CE2 4.48Å; I345-F385 HydrophobicContact CG2-CZ 4.42Å; I345-I389 HydrophobicContact CG1-CD1 4.27Å
346	L	94.6	Very high	91.7	Very high	124 Å²	124	40.4 Å²	40.4	65%	0.649	23%	0.233	S	C	*	.	H	α-helix	trans	-63.7	-44.3	-178.9	-69.8	172.9	0	0	0	112.2	A342 L343 A349 G350	A342-L346 WeakPolarHBondContact O-CG 3.23Å; A342-L346 PolarHBondContact O-N 2.86Å; A342-L346 VanDerWaalsContact O-N 3.11Å; L343-L346 PolarHBondContact O-N 3.16Å; L346-A349 PolarHBondContact O-N 3.17Å; L346-G350 PolarHBondContact O-N 3.14Å
347	V	93.6	Very high	92	Very high	37 Å²	37	47 Å²	47	22%	0.224	26%	0.262	C	S	.	.	H	α-helix	trans	-65.8	-45.2	178.1	172.1	0	0	0	0	110.7	L343 A349 G350 L351 L392 F960	L343-V347 HydrophobicContact CD1-CG2 4.01Å; L343-V347 HydrophobicContact CG-CG2 4.34Å; L343-V347 WeakPolarHBondContact O-CB 3.44Å; L343-V347 VanDerWaalsContact O-CG2 3.3Å; L343-V347 WeakPolarHBondContact O-CG2 3.28Å; L343-V347 PolarHBondContact O-N 2.93Å; V347-A349 VanDerWaalsContact C-N 3.34Å; V347-A349 PolarHBondContact O-N 3.21Å; V347-G350 PolarHBondContact O-N 3.23Å; V347-L351 HydrophobicContact CG1-CD1 4.2Å; V347-L351 HydrophobicContact CG1-CG 4.47Å; V347-L351 WeakPolarHBondContact O-CG 3.48Å; V347-L351 PolarHBondContact O-N 3.4Å; V347-L392 HydrophobicContact CG1-CD1 3.85Å; V347-F960 HydrophobicContact CG1-CD2 3.55Å; V347-F960 HydrophobicContact CG1-CE2 3.85Å
348	S	94.1	Very high	92.3	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-63.6	-39.5	179	-54.6	0	0	0	0	111.9	L344 I345 L351 A352 I389	L344-S348 VanDerWaalsContact O-CB 3.3Å; L344-S348 WeakPolarHBondContact O-CB 3.18Å; L344-S348 PolarHBondContact O-N 2.99Å; L344-S348 PolarHBondContact O-OG 3.16Å; I345-S348 PolarHBondContact O-N 3.33Å; S348-L351 PolarHBondContact O-N 3.03Å; S348-A352 VanDerWaalsContact O-CB 3.28Å; S348-A352 WeakPolarHBondContact O-CB 3.37Å; S348-A352 PolarHBondContact O-N 3.49Å; S348-I389 WeakPolarHBondContact OG-CD1 3.36Å
349	A	94.8	Very high	92.3	Very high	35 Å²	35	45.5 Å²	45.5	29%	0.289	25%	0.254	S	S	.	.	H	α-helix	trans	-63.3	-43.6	173.9	0	0	0	0	0	111.9	I345 L346 V347 A352 I353 F385	I345-A349 VanDerWaalsContact O-CB 3.31Å; I345-A349 WeakPolarHBondContact O-CB 3.4Å; I345-A349 PolarHBondContact O-N 3.01Å; L346-A349 PolarHBondContact O-N 3.17Å; V347-A349 VanDerWaalsContact C-N 3.34Å; V347-A349 PolarHBondContact O-N 3.21Å; A349-A352 PolarHBondContact O-N 3.36Å; A349-I353 VanDerWaalsContact O-CG1 3.27Å; A349-I353 WeakPolarHBondContact O-CG1 3.36Å; A349-I353 PolarHBondContact O-N 3.4Å; A349-F385 HydrophobicContact CB-CD2 4.24Å; A349-F385 HydrophobicContact CB-CE2 4.13Å
350	G	94.7	Very high	92.2	Very high	44 Å²	44	49.2 Å²	49.2	45%	0.454	27%	0.268	S	S	.	.	H	α-helix	trans	-60.5	-45	176.2	0	0	0	0	0	113.1	L346 V347 I353 G354	L346-G350 PolarHBondContact O-N 3.14Å; V347-G350 PolarHBondContact O-N 3.23Å; G350-I353 PolarHBondContact O-N 3Å; G350-G354 PolarHBondContact O-N 3.01Å
351	L	94.7	Very high	92.1	Very high	4 Å²	4	54.9 Å²	54.9	2%	0.021	30%	0.298	C	S	.	.	H	α-helix	trans	-67.6	-37.7	177.4	-66.5	176.9	0	0	0	112.6	V347 S348 G354 H355 Y388 L392 F960 Y968	V347-L351 HydrophobicContact CG1-CD1 4.2Å; V347-L351 HydrophobicContact CG1-CG 4.47Å; V347-L351 WeakPolarHBondContact O-CG 3.48Å; V347-L351 PolarHBondContact O-N 3.4Å; S348-L351 PolarHBondContact O-N 3.03Å; L351-G354 CarbonylContact O-C 3.6Å; L351-G354 WeakPolarHBondContact O-CA 3.49Å; L351-G354 PolarHBondContact O-N 3.14Å; L351-G354 VanDerWaalsContact O-N 3.14Å; L351-H355 PolarHBondContact O-N 2.7Å; L351-Y388 HydrophobicContact CB-CD1 4.4Å; L351-Y388 HydrophobicContact CB-CD2 3.62Å; L351-Y388 HydrophobicContact CB-CE1 4.33Å; L351-Y388 HydrophobicContact CB-CE2 3.51Å; L351-Y388 HydrophobicContact CB-CG 4.08Å; L351-Y388 HydrophobicContact CD1-CD1 3.57Å; L351-Y388 HydrophobicContact CD1-CD2 4.29Å; L351-Y388 HydrophobicContact CD1-CE1 3.62Å; L351-Y388 HydrophobicContact CD1-CE2 4.33Å; L351-Y388 HydrophobicContact CD1-CG 3.94Å; L351-L392 HydrophobicContact CD1-CD1 4.19Å; L351-F960 HydrophobicContact CD1-CD2 3.94Å; L351-F960 HydrophobicContact CD2-CD2 3.94Å; L351-F960 HydrophobicContact CD2-CE2 3.83Å; L351-F960 HydrophobicContact CG-CD2 4.17Å; L351-F960 HydrophobicContact CG-CE2 4.24Å; L351-Y968 HydrophobicContact CD2-CD1 3.94Å; L351-Y968 HydrophobicContact CD2-CE1 4.02Å
352	A	94.3	Very high	91.9	Very high	6 Å²	6	53.9 Å²	53.9	5%	0.05	30%	0.297	C	S	.	.	H	α-helix	trans	-65.9	-36.7	176.2	0	0	0	0	0	113.1	S348 A349 G354 H355 S356 F385	S348-A352 VanDerWaalsContact O-CB 3.28Å; S348-A352 WeakPolarHBondContact O-CB 3.37Å; S348-A352 PolarHBondContact O-N 3.49Å; A349-A352 PolarHBondContact O-N 3.36Å; A352-G354 VanDerWaalsContact C-N 3.33Å; A352-H355 PolarHBondContact O-N 3.02Å; A352-S356 PolarHBondContact O-N 2.87Å; A352-S356 PolarHBondContact O-OG 3.1Å; A352-F385 HydrophobicContact CB-CB 3.69Å
353	I	93.8	Very high	91.4	Very high	95 Å²	95	51.7 Å²	51.7	49%	0.487	28%	0.278	S	S	.	.	H	α-helix	trans	-63.4	-43.9	170.4	-68.8	165.5	0	0	0	109.6	A349 G350 H355 S356 F357	A349-I353 VanDerWaalsContact O-CG1 3.27Å; A349-I353 WeakPolarHBondContact O-CG1 3.36Å; A349-I353 PolarHBondContact O-N 3.4Å; G350-I353 PolarHBondContact O-N 3Å; I353-H355 VanDerWaalsContact C-N 3.35Å; I353-H355 PolarHBondContact O-N 3.28Å; I353-S356 WeakPolarHBondContact O-CB 3.35Å; I353-S356 PolarHBondContact O-N 3.43Å; I353-S356 VanDerWaalsContact O-N 3.17Å; I353-F357 HydrophobicContact CG2-CD2 3.67Å; I353-F357 HydrophobicContact CG2-CE2 3.42Å; I353-F357 VanDerWaalsContact CG2-CE2 3.42Å; I353-F357 VanDerWaalsContact O-CD2 3.25Å; I353-F357 WeakPolarHBondContact O-CD2 3.17Å; I353-F357 PolarHBondContact O-N 2.73Å
354	G	92.8	Very high	90.9	Very high	15 Å²	15	53 Å²	53	16%	0.155	29%	0.289	C	S	.	.	H	α-helix	trans	-55.1	-46.3	173.1	0	0	0	0	0	113	G350 L351 A352 S356 F357 W358	G350-G354 PolarHBondContact O-N 3.01Å; L351-G354 CarbonylContact O-C 3.6Å; L351-G354 WeakPolarHBondContact O-CA 3.49Å; L351-G354 PolarHBondContact O-N 3.14Å; L351-G354 VanDerWaalsContact O-N 3.14Å; A352-G354 VanDerWaalsContact C-N 3.33Å; G354-S356 VanDerWaalsContact C-N 3.35Å; G354-S356 PolarHBondContact O-N 3.19Å; G354-F357 PolarHBondContact O-N 2.65Å; G354-W358 WeakPolarHBondContact O-CB 3.28Å; G354-W358 PolarHBondContact O-N 2.9Å
355	H	91.8	Very high	90.4	Very high	24 Å²	24	58.1 Å²	58.1	11%	0.111	32%	0.32	C	S	.	.	H	α-helix	trans	-59.9	-43	174.9	-178.3	-104.4	0	0	0	112.6	L351 A352 I353 F357 W358 Y359 G967 Y968	L351-H355 PolarHBondContact O-N 2.7Å; A352-H355 PolarHBondContact O-N 3.02Å; I353-H355 VanDerWaalsContact C-N 3.35Å; I353-H355 PolarHBondContact O-N 3.28Å; H355-F357 PolarHBondContact O-N 2.69Å; H355-W358 PolarHBondContact O-N 3.26Å; H355-Y359 WeakPolarHBondContact O-CB 3.47Å; H355-Y359 PolarHBondContact O-N 3.45Å; H355-G967 PolarHBondContact CD2-O 3.18Å; H355-Y968 PolarHBondContact CD2-O 3.46Å; H355-Y968 VanDerWaalsContact CD2-O 3.25Å
356	S	91.8	Very high	90	Very high	29 Å²	29	56 Å²	56	20%	0.203	31%	0.311	C	S	.	.	H	α-helix	trans	-62	-43.8	179.5	-55.2	0	0	0	0	111.7	A352 I353 G354 Q360 V377 G381	A352-S356 PolarHBondContact O-N 2.87Å; A352-S356 PolarHBondContact O-OG 3.1Å; I353-S356 WeakPolarHBondContact O-CB 3.35Å; I353-S356 PolarHBondContact O-N 3.43Å; I353-S356 VanDerWaalsContact O-N 3.17Å; G354-S356 VanDerWaalsContact C-N 3.35Å; G354-S356 PolarHBondContact O-N 3.19Å; S356-Q360 WeakPolarHBondContact O-CB 3.22Å; S356-Q360 PolarHBondContact O-N 3.2Å; S356-Q360 VanDerWaalsContact O-N 3.16Å; S356-V377 WeakPolarHBondContact O-CG1 3.22Å; S356-G381 VanDerWaalsContact OG-CA 3.31Å; S356-G381 WeakPolarHBondContact OG-CA 3.43Å
357	F	91.5	Very high	89.4	Confident	137 Å²	137	60.8 Å²	60.8	60%	0.601	32%	0.321	S	S	*	.	H	α-helix	trans	-67.6	-46.6	176.4	-77.8	-62.9	0	0	0	112.4	I353 G354 H355 Y359 Q360 D361	I353-F357 HydrophobicContact CG2-CD2 3.67Å; I353-F357 HydrophobicContact CG2-CE2 3.42Å; I353-F357 VanDerWaalsContact CG2-CE2 3.42Å; I353-F357 VanDerWaalsContact O-CD2 3.25Å; I353-F357 WeakPolarHBondContact O-CD2 3.17Å; I353-F357 PolarHBondContact O-N 2.73Å; G354-F357 PolarHBondContact O-N 2.65Å; H355-F357 PolarHBondContact O-N 2.69Å; F357-Y359 VanDerWaalsContact C-N 3.33Å; F357-Y359 PolarHBondContact O-N 2.9Å; F357-Q360 PolarHBondContact O-N 3.09Å; F357-D361 PolarHBondContact O-N 2.96Å
358	W	91.7	Very high	88.9	Confident	75 Å²	75	66.1 Å²	66.1	28%	0.284	34%	0.338	S	S	.	.	H	α-helix	trans	-62.2	-41.2	179.6	-176.2	89.8	0	0	0	111.9	G354 H355 D361 I362 G363 L369 Y968	G354-W358 WeakPolarHBondContact O-CB 3.28Å; G354-W358 PolarHBondContact O-N 2.9Å; H355-W358 PolarHBondContact O-N 3.26Å; W358-D361 PolarHBondContact O-N 3.27Å; W358-I362 HydrophobicContact CH2-CG2 4.41Å; W358-I362 HydrophobicContact CZ2-CB 4.3Å; W358-I362 HydrophobicContact CZ2-CG2 3.91Å; W358-I362 PolarHBondContact O-N 2.96Å; W358-G363 PolarHBondContact O-N 3.32Å; W358-L369 HydrophobicContact CH2-CD1 3.74Å; W358-L369 HydrophobicContact CZ3-CD1 4.24Å; W358-Y968 HydrophobicContact CB-CD2 4.05Å; W358-Y968 HydrophobicContact CB-CE2 4.5Å; W358-Y968 HydrophobicContact CG-CD2 4.41Å
359	Y	88.2	Confident	88.3	Confident	27 Å²	27	69.1 Å²	69.1	11%	0.106	35%	0.354	C	S	.	.	I	π-helix	trans	-66.3	-38.4	178.4	-168.3	-90.8	0	0	0	112.1	H355 F357 D361 G363 T364 V377 R380	H355-Y359 WeakPolarHBondContact O-CB 3.47Å; H355-Y359 PolarHBondContact O-N 3.45Å; F357-Y359 VanDerWaalsContact C-N 3.33Å; F357-Y359 PolarHBondContact O-N 2.9Å; Y359-D361 VanDerWaalsContact C-N 3.33Å; Y359-D361 PolarHBondContact O-N 3.36Å; Y359-G363 CarbonylContact O-C 3.47Å; Y359-G363 VanDerWaalsContact O-CA 3.23Å; Y359-G363 WeakPolarHBondContact O-CA 3.42Å; Y359-G363 PolarHBondContact O-N 3.04Å; Y359-T364 HydrophobicContact CD1-CG2 4.06Å; Y359-T364 HydrophobicContact CE1-CG2 3.78Å; Y359-T364 PolarHBondContact O-N 3.48Å; Y359-V377 HydrophobicContact CD1-CG2 4.36Å; Y359-R380 VanDerWaalsContact CZ-CZ 3.5Å; Y359-R380 PolarHBondContact OH-NE 3.12Å; Y359-R380 PolarHBondContact OH-NH1 3.39Å; Y359-R380 PolarHBondContact OH-NH2 3.14Å
360	Q	87.9	Confident	87.5	Confident	124 Å²	124	73.5 Å²	73.5	58%	0.579	37%	0.372	S	S	*	.	I	π-helix	trans	-65.7	-34.1	177.2	-175.9	176.8	-8.6	0	0	113	S356 F357 T364 V377	S356-Q360 WeakPolarHBondContact O-CB 3.22Å; S356-Q360 PolarHBondContact O-N 3.2Å; S356-Q360 VanDerWaalsContact O-N 3.16Å; F357-Q360 PolarHBondContact O-N 3.09Å; Q360-T364 PolarHBondContact O-OG1 2.85Å; Q360-V377 HydrophobicContact CB-CG1 4.37Å
361	D	87.3	Confident	86.5	Confident	120 Å²	120	75 Å²	75	64%	0.642	37%	0.37	S	S	*	.	I	π-helix	trans	-85.9	-51.7	-177.1	-166.2	42.4	0	0	0	111.8	F357 W358 Y359 T365	F357-D361 PolarHBondContact O-N 2.96Å; W358-D361 PolarHBondContact O-N 3.27Å; Y359-D361 VanDerWaalsContact C-N 3.33Å; Y359-D361 PolarHBondContact O-N 3.36Å; D361-T365 PolarHBondContact O-OG1 2.77Å
362	I	85.4	Confident	85.4	Confident	65 Å²	65	77.9 Å²	77.9	33%	0.333	40%	0.401	S	S	.	.	I	π-helix	trans	-108.7	-39.6	-170.2	-62	169	0	0	0	111.7	W358 T364 T365 S366	W358-I362 HydrophobicContact CH2-CG2 4.41Å; W358-I362 HydrophobicContact CZ2-CB 4.3Å; W358-I362 HydrophobicContact CZ2-CG2 3.91Å; W358-I362 PolarHBondContact O-N 2.96Å; I362-T364 PolarHBondContact O-N 3.05Å; I362-T365 PolarHBondContact O-N 3.46Å; I362-T365 PolarHBondContact O-OG1 2.63Å; I362-S366 WeakPolarHBondContact O-CB 2.82Å; I362-S366 PolarHBondContact O-N 3.02Å; I362-S366 VanDerWaalsContact O-N 3.16Å; I362-S366 PolarHBondContact O-OG 3.05Å
363	G	80.6	Confident	84.5	Confident	3 Å²	3	82.4 Å²	82.4	3%	0.031	42%	0.419	C	S	.	.	I	π-helix	trans	-62.8	-43.7	-175.3	0	0	0	0	0	113.3	W358 Y359 T365	W358-G363 PolarHBondContact O-N 3.32Å; Y359-G363 CarbonylContact O-C 3.47Å; Y359-G363 VanDerWaalsContact O-CA 3.23Å; Y359-G363 WeakPolarHBondContact O-CA 3.42Å; Y359-G363 PolarHBondContact O-N 3.04Å; G363-T365 VanDerWaalsContact C-N 3.3Å; G363-T365 PolarHBondContact O-N 2.67Å
364	T	79.9	Confident	83.5	Confident	85 Å²	85	86.3 Å²	86.3	52%	0.521	44%	0.441	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72	-21.3	-179.6	50.8	0	0	0	0	114.2	Y359 Q360 I362	Y359-T364 HydrophobicContact CD1-CG2 4.06Å; Y359-T364 HydrophobicContact CE1-CG2 3.78Å; Y359-T364 PolarHBondContact O-N 3.48Å; Q360-T364 PolarHBondContact O-OG1 2.85Å; I362-T364 PolarHBondContact O-N 3.05Å
365	T	81.5	Confident	82.9	Confident	108 Å²	108	88.2 Å²	88.2	66%	0.663	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.4	-17.5	-177.7	53.7	0	0	0	0	112.8	D361 I362 G363	D361-T365 PolarHBondContact O-OG1 2.77Å; I362-T365 PolarHBondContact O-N 3.46Å; I362-T365 PolarHBondContact O-OG1 2.63Å; G363-T365 VanDerWaalsContact C-N 3.3Å; G363-T365 PolarHBondContact O-N 2.67Å
366	S	84.2	Confident	82.7	Confident	18 Å²	18	91.6 Å²	91.6	13%	0.126	47%	0.468	C	S	.	.			trans	-89.1	110.7	-174.9	-63.8	0	0	0	0	112.6	I362 Y368 L369	I362-S366 WeakPolarHBondContact O-CB 2.82Å; I362-S366 PolarHBondContact O-N 3.02Å; I362-S366 VanDerWaalsContact O-N 3.16Å; I362-S366 PolarHBondContact O-OG 3.05Å; S366-Y368 VanDerWaalsContact C-N 3.27Å; S366-Y368 PolarHBondContact O-N 3.22Å; S366-L369 PolarHBondContact O-N 3.27Å
367	W	83.4	Confident	82.5	Confident	226 Å²	226	92.4 Å²	92.4	86%	0.856	47%	0.472	S	S	*	.	G	3₁₀ helix	trans	-59.3	-31.1	-175.1	70.9	-90.6	0	0	0	114.7	L369	W367-L369 VanDerWaalsContact C-N 3.32Å; W367-L369 PolarHBondContact O-N 3.12Å
368	Y	83.2	Confident	82.3	Confident	148 Å²	148	89.6 Å²	89.6	58%	0.58	47%	0.474	S	S	*	.	G	3₁₀ helix	trans	-81.8	-7.2	-176.4	61.3	-90.8	0	0	0	113.8	S366	S366-Y368 VanDerWaalsContact C-N 3.27Å; S366-Y368 PolarHBondContact O-N 3.22Å
369	L	80.8	Confident	82.2	Confident	64 Å²	64	90.9 Å²	90.9	34%	0.335	48%	0.479	S	S	.	.	G	3₁₀ helix	trans	-102.7	0.5	177.5	-67.9	173.8	0	0	0	113.2	W358 S366 W367 D371	W358-L369 HydrophobicContact CH2-CD1 3.74Å; W358-L369 HydrophobicContact CZ3-CD1 4.24Å; S366-L369 PolarHBondContact O-N 3.27Å; W367-L369 VanDerWaalsContact C-N 3.32Å; W367-L369 PolarHBondContact O-N 3.12Å; L369-D371 PolarHBondContact O-N 2.88Å
370	N	78.3	Confident	82.1	Confident	126 Å²	126	90.9 Å²	90.9	67%	0.674	48%	0.479	S	S	*	.			trans	-72.1	111.8	179.8	-172.6	10.6	0	0	0	110.7	G372	N370-G372 PolarHBondContact OD1-N 3.35Å
371	D	73.8	Confident	82.2	Confident	76 Å²	76	85.2 Å²	85.2	41%	0.406	45%	0.454	S	S	.	.			trans	-91.4	0.9	-178.5	60.8	5.7	0	0	0	113.6	L369 K373 R380	L369-D371 PolarHBondContact O-N 2.88Å; D371-K373 PolarHBondContact O-N 3.29Å; D371-K373 PolarHBondContact OD1-N 3.42Å; D371-K373 VanDerWaalsContact OD1-N 3.08Å; D371-R380 VanDerWaalsContact CG-NH2 3.32Å; D371-R380 IonicContact OD1-CZ 3.96Å; D371-R380 IonicContact OD1-NH1 3.95Å; D371-R380 IonicContact OD1-NH2 3.17Å; D371-R380 PolarHBondContact OD1-NH2 2.94Å; D371-R380 IonicContact OD2-CZ 3.69Å; D371-R380 IonicContact OD2-NH1 3.69Å; D371-R380 PolarHBondContact OD2-NH1 3.12Å; D371-R380 IonicContact OD2-NH2 2.76Å; D371-R380 PolarHBondContact OD2-NH2 3.2Å; D371-R380 VanDerWaalsContact OD2-NH2 3.1Å
372	G	72.1	Confident	82.4	Confident	65 Å²	65	84.7 Å²	84.7	67%	0.67	45%	0.446	S	S	*	.	S	Bend	trans	68.3	10.7	-179.2	0	0	0	0	0	114.5	N370	N370-G372 PolarHBondContact OD1-N 3.35Å
373	K	75.7	Confident	82.7	Confident	101 Å²	101	82.7 Å²	82.7	44%	0.439	44%	0.436	S	S	.	.			trans	-102.6	115.4	176.7	-63.8	-178.2	178.8	-178.9	0	109.5	D131 D371 Q375 R380	D131-K373 IonicContact OD1-NZ 3.33Å; D371-K373 PolarHBondContact O-N 3.29Å; D371-K373 PolarHBondContact OD1-N 3.42Å; D371-K373 VanDerWaalsContact OD1-N 3.08Å; K373-Q375 HydrophobicContact CB-CG 4.18Å; K373-Q375 PolarHBondContact O-N 2.93Å; K373-R380 PolarHBondContact O-NH2 3.27Å
374	D	71.1	Confident	83.1	Confident	176 Å²	176	83 Å²	83	94%	0.941	44%	0.437	S	S	*	.			trans	-74.2	55.6	177.3	-71.5	-25.6	0	0	0	112.7
375	Q	81.9	Confident	83.8	Confident	55 Å²	55	81 Å²	81	26%	0.257	42%	0.422	S	S	.	.			trans	-88.6	138.8	178.5	-69.5	-178.8	-3.9	0	0	111.3	K373 Y379 R380	K373-Q375 HydrophobicContact CB-CG 4.18Å; K373-Q375 PolarHBondContact O-N 2.93Å; Q375-Y379 HydrophobicContact CB-CD1 4.1Å; Q375-Y379 HydrophobicContact CG-CD1 3.97Å; Q375-Y379 HydrophobicContact CG-CE1 4.25Å; Q375-R380 HydrophobicContact CB-CG 4.09Å
376	T	87	Confident	84.3	Confident	96 Å²	96	79.3 Å²	79.3	59%	0.589	40%	0.403	S	S	*	.			trans	-65.6	149.1	175.6	62.1	0	0	0	0	111.4	A378 Y379 R380	T376-A378 PolarHBondContact O-N 2.94Å; T376-Y379 PolarHBondContact O-N 3.16Å; T376-Y379 VanDerWaalsContact OG1-CB 3.28Å; T376-Y379 WeakPolarHBondContact OG1-CB 3.15Å; T376-Y379 PolarHBondContact OG1-N 3.12Å; T376-R380 PolarHBondContact O-N 3.3Å
377	V	86.1	Confident	84.7	Confident	46 Å²	46	78.6 Å²	78.6	28%	0.279	40%	0.398	S	S	.	.	H	α-helix	trans	-55.4	-41.5	178.1	-179.3	0	0	0	0	111.2	S356 Y359 Q360 Y379 R380 G381	S356-V377 WeakPolarHBondContact O-CG1 3.22Å; Y359-V377 HydrophobicContact CD1-CG2 4.36Å; Q360-V377 HydrophobicContact CB-CG1 4.37Å; V377-Y379 VanDerWaalsContact C-N 3.34Å; V377-Y379 PolarHBondContact O-N 3.48Å; V377-R380 PolarHBondContact O-N 3.16Å; V377-G381 PolarHBondContact O-N 3.42Å
378	A	87.8	Confident	85.2	Confident	77 Å²	77	67.9 Å²	67.9	64%	0.636	36%	0.358	S	S	*	.	H	α-helix	trans	-63.4	-37.7	177.2	0	0	0	0	0	112.8	T376 G381 F382	T376-A378 PolarHBondContact O-N 2.94Å; A378-G381 PolarHBondContact O-N 2.84Å; A378-F382 PolarHBondContact O-N 3.09Å
379	Y	89.3	Confident	85.6	Confident	102 Å²	102	61.3 Å²	61.3	40%	0.4	33%	0.333	S	S	.	.	H	α-helix	trans	-69.9	-39.4	177.1	-175.3	-106.1	0	0	0	111.9	Q375 T376 V377 G381 F382 L383	Q375-Y379 HydrophobicContact CB-CD1 4.1Å; Q375-Y379 HydrophobicContact CG-CD1 3.97Å; Q375-Y379 HydrophobicContact CG-CE1 4.25Å; T376-Y379 PolarHBondContact O-N 3.16Å; T376-Y379 VanDerWaalsContact OG1-CB 3.28Å; T376-Y379 WeakPolarHBondContact OG1-CB 3.15Å; T376-Y379 PolarHBondContact OG1-N 3.12Å; V377-Y379 VanDerWaalsContact C-N 3.34Å; V377-Y379 PolarHBondContact O-N 3.48Å; Y379-G381 VanDerWaalsContact C-N 3.33Å; Y379-G381 PolarHBondContact O-N 3.32Å; Y379-F382 HydrophobicContact CE2-CD1 4.48Å; Y379-F382 WeakPolarHBondContact O-CB 2.99Å; Y379-F382 PolarHBondContact O-N 3.5Å; Y379-F382 VanDerWaalsContact O-N 3.15Å; Y379-L383 HydrophobicContact CD1-CD1 4.09Å; Y379-L383 HydrophobicContact CD1-CG 4.41Å; Y379-L383 HydrophobicContact CE1-CD1 3.69Å; Y379-L383 HydrophobicContact CE1-CD2 4.42Å; Y379-L383 HydrophobicContact CE1-CG 4.1Å; Y379-L383 WeakPolarHBondContact O-CG 2.83Å; Y379-L383 PolarHBondContact O-N 2.88Å
380	R	87.3	Confident	86.1	Confident	27 Å²	27	58.3 Å²	58.3	10%	0.102	32%	0.317	C	S	.	.	H	α-helix	trans	-62.2	-40	172.2	-67.2	179.7	-177.6	-108.1	-1.9	111.9	Y359 D371 K373 Q375 T376 V377 L383 S384	Y359-R380 VanDerWaalsContact CZ-CZ 3.5Å; Y359-R380 PolarHBondContact OH-NE 3.12Å; Y359-R380 PolarHBondContact OH-NH1 3.39Å; Y359-R380 PolarHBondContact OH-NH2 3.14Å; D371-R380 VanDerWaalsContact CG-NH2 3.32Å; D371-R380 IonicContact OD1-CZ 3.96Å; D371-R380 IonicContact OD1-NH1 3.95Å; D371-R380 IonicContact OD1-NH2 3.17Å; D371-R380 PolarHBondContact OD1-NH2 2.94Å; D371-R380 IonicContact OD2-CZ 3.69Å; D371-R380 IonicContact OD2-NH1 3.69Å; D371-R380 PolarHBondContact OD2-NH1 3.12Å; D371-R380 IonicContact OD2-NH2 2.76Å; D371-R380 PolarHBondContact OD2-NH2 3.2Å; D371-R380 VanDerWaalsContact OD2-NH2 3.1Å; K373-R380 PolarHBondContact O-NH2 3.27Å; Q375-R380 HydrophobicContact CB-CG 4.09Å; T376-R380 PolarHBondContact O-N 3.3Å; V377-R380 PolarHBondContact O-N 3.16Å; R380-L383 PolarHBondContact O-N 3.5Å; R380-S384 WeakPolarHBondContact O-CB 3.34Å; R380-S384 PolarHBondContact O-N 3.42Å
381	G	89.7	Confident	86.6	Confident	5 Å²	5	52.5 Å²	52.5	5%	0.052	29%	0.286	C	S	.	.	H	α-helix	trans	-60.2	-43.1	170.4	0	0	0	0	0	113	S356 V377 A378 Y379 S384 F385	S356-G381 VanDerWaalsContact OG-CA 3.31Å; S356-G381 WeakPolarHBondContact OG-CA 3.43Å; V377-G381 PolarHBondContact O-N 3.42Å; A378-G381 PolarHBondContact O-N 2.84Å; Y379-G381 VanDerWaalsContact C-N 3.33Å; Y379-G381 PolarHBondContact O-N 3.32Å; G381-S384 PolarHBondContact O-N 2.95Å; G381-F385 PolarHBondContact O-N 3.22Å
382	F	91.6	Very high	87.5	Confident	110 Å²	110	49.1 Å²	49.1	48%	0.482	27%	0.268	S	S	.	.	H	α-helix	trans	-63.1	-41.5	175.8	176.7	-98.6	0	0	0	112.8	A378 Y379 F385 W386	A378-F382 PolarHBondContact O-N 3.09Å; Y379-F382 HydrophobicContact CE2-CD1 4.48Å; Y379-F382 WeakPolarHBondContact O-CB 2.99Å; Y379-F382 PolarHBondContact O-N 3.5Å; Y379-F382 VanDerWaalsContact O-N 3.15Å; F382-F385 WeakPolarHBondContact O-CB 3.29Å; F382-F385 PolarHBondContact O-N 3.13Å; F382-W386 AromaticContact CE1-CD1 3.82Å; F382-W386 AromaticContact CE1-NE1 3.61Å; F382-W386 AromaticContact CE2-NE1 3.33Å; F382-W386 VanDerWaalsContact CE2-NE1 3.33Å; F382-W386 AromaticContact CZ-CD1 3.78Å; F382-W386 AromaticContact CZ-NE1 3.09Å; F382-W386 VanDerWaalsContact O-CD1 3.24Å; F382-W386 PolarHBondContact O-N 2.96Å
383	L	90.6	Very high	88.1	Confident	22 Å²	22	46.4 Å²	46.4	12%	0.115	24%	0.238	C	C	.	.	H	α-helix	trans	-63.9	-43.6	173.7	-66.6	178	0	0	0	111.4	D131 I132 Y379 R380 F385 W386 G387	D131-L383 HydrophobicContact CB-CD2 4.44Å; I132-L383 HydrophobicContact CD1-CD2 4.23Å; I132-L383 HydrophobicContact CG1-CD2 3.67Å; Y379-L383 HydrophobicContact CD1-CD1 4.09Å; Y379-L383 HydrophobicContact CD1-CG 4.41Å; Y379-L383 HydrophobicContact CE1-CD1 3.69Å; Y379-L383 HydrophobicContact CE1-CD2 4.42Å; Y379-L383 HydrophobicContact CE1-CG 4.1Å; Y379-L383 WeakPolarHBondContact O-CG 2.83Å; Y379-L383 PolarHBondContact O-N 2.88Å; R380-L383 PolarHBondContact O-N 3.5Å; L383-F385 VanDerWaalsContact C-N 3.32Å; L383-F385 PolarHBondContact O-N 2.91Å; L383-W386 PolarHBondContact O-N 3.06Å; L383-G387 PolarHBondContact O-N 3.14Å
384	S	90.4	Very high	88.5	Confident	9 Å²	9	42.2 Å²	42.2	6%	0.063	22%	0.221	C	C	.	.	H	α-helix	trans	-62.2	-36	176.2	174.8	0	0	0	0	112.7	R380 G381 W386 G387 Y388 S970	R380-S384 WeakPolarHBondContact O-CB 3.34Å; R380-S384 PolarHBondContact O-N 3.42Å; G381-S384 PolarHBondContact O-N 2.95Å; S384-W386 VanDerWaalsContact C-N 3.34Å; S384-W386 PolarHBondContact O-N 2.75Å; S384-G387 PolarHBondContact O-N 3.32Å; S384-Y388 VanDerWaalsContact O-CD2 3.23Å; S384-Y388 WeakPolarHBondContact O-CD2 3.4Å; S384-Y388 PolarHBondContact O-N 3.36Å; S384-Y388 WeakPolarHBondContact OG-CD2 3.4Å; S384-Y388 VanDerWaalsContact OG-CE2 3.25Å; S384-Y388 WeakPolarHBondContact OG-CE2 3.34Å; S384-S970 PolarHBondContact OG-OG 3.03Å
385	F	94	Very high	89.1	Confident	43 Å²	43	34.4 Å²	34.4	19%	0.189	18%	0.179	C	C	.	.	H	α-helix	trans	-54.9	-50.5	173	168.9	-101.8	0	0	0	111.5	I345 A349 A352 G381 F382 L383 Y388 I389	I345-F385 HydrophobicContact CG2-CE2 4.48Å; I345-F385 HydrophobicContact CG2-CZ 4.42Å; A349-F385 HydrophobicContact CB-CD2 4.24Å; A349-F385 HydrophobicContact CB-CE2 4.13Å; A352-F385 HydrophobicContact CB-CB 3.69Å; G381-F385 PolarHBondContact O-N 3.22Å; F382-F385 WeakPolarHBondContact O-CB 3.29Å; F382-F385 PolarHBondContact O-N 3.13Å; L383-F385 VanDerWaalsContact C-N 3.32Å; L383-F385 PolarHBondContact O-N 2.91Å; F385-Y388 PolarHBondContact O-N 2.83Å; F385-I389 HydrophobicContact CE1-CG1 4.19Å; F385-I389 HydrophobicContact CE2-CD1 4.32Å; F385-I389 HydrophobicContact CE2-CG1 4.29Å; F385-I389 HydrophobicContact CZ-CD1 4.14Å; F385-I389 HydrophobicContact CZ-CG1 4.03Å; F385-I389 WeakPolarHBondContact O-CG1 3.44Å; F385-I389 PolarHBondContact O-N 3.43Å
386	W	92.8	Very high	89.1	Confident	74 Å²	74	32 Å²	32	28%	0.28	17%	0.168	S	C	.	.	H	α-helix	trans	-70.1	-33.6	178.4	-67.7	108	0	0	0	112.8	L126 I132 F382 L383 S384 Y388 I389 I390	L126-W386 HydrophobicContact CD1-CE3 3.75Å; L126-W386 HydrophobicContact CD1-CZ3 3.61Å; L126-W386 HydrophobicContact CD2-CE3 4.2Å; L126-W386 HydrophobicContact CD2-CZ3 4.27Å; I132-W386 HydrophobicContact CB-CB 4.43Å; I132-W386 HydrophobicContact CD1-CB 4.16Å; I132-W386 HydrophobicContact CD1-CG 4.31Å; I132-W386 HydrophobicContact CG1-CB 4.34Å; I132-W386 HydrophobicContact CG2-CB 3.27Å; I132-W386 HydrophobicContact CG2-CG 4.37Å; F382-W386 AromaticContact CE1-CD1 3.82Å; F382-W386 AromaticContact CE1-NE1 3.61Å; F382-W386 AromaticContact CE2-NE1 3.33Å; F382-W386 VanDerWaalsContact CE2-NE1 3.33Å; F382-W386 AromaticContact CZ-CD1 3.78Å; F382-W386 AromaticContact CZ-NE1 3.09Å; F382-W386 VanDerWaalsContact O-CD1 3.24Å; F382-W386 PolarHBondContact O-N 2.96Å; L383-W386 PolarHBondContact O-N 3.06Å; S384-W386 VanDerWaalsContact C-N 3.34Å; S384-W386 PolarHBondContact O-N 2.75Å; W386-Y388 VanDerWaalsContact C-N 3.34Å; W386-Y388 PolarHBondContact O-N 2.8Å; W386-I389 PolarHBondContact O-N 2.65Å; W386-I390 WeakPolarHBondContact O-CG1 3.26Å; W386-I390 PolarHBondContact O-N 3.36Å; W386-I390 VanDerWaalsContact O-N 3.09Å
387	G	92.1	Very high	88.6	Confident	2 Å²	2	27.6 Å²	27.6	2%	0.021	14%	0.141	C	C	.	.	H	α-helix	trans	-58.4	-43.4	171.4	0	0	0	0	0	112.4	T134 L383 S384 I390 V391	T134-G387 PolarHBondContact OG1-O 3.29Å; L383-G387 PolarHBondContact O-N 3.14Å; S384-G387 PolarHBondContact O-N 3.32Å; G387-I390 WeakPolarHBondContact O-CB 3.06Å; G387-I390 PolarHBondContact O-N 2.93Å; G387-V391 WeakPolarHBondContact O-CG2 3.41Å; G387-V391 PolarHBondContact O-N 3.21Å
388	Y	93	Very high	88.3	Confident	1 Å²	1	26.5 Å²	26.5	0%	0.004	13%	0.133	C	C	.	.	H	α-helix	trans	-70	-35.2	175.1	-80.4	-59.5	0	0	0	113.8	L351 S384 F385 W386 I390 V391 L392 S963 Y968 S970	L351-Y388 HydrophobicContact CB-CD1 4.4Å; L351-Y388 HydrophobicContact CB-CD2 3.62Å; L351-Y388 HydrophobicContact CB-CE1 4.33Å; L351-Y388 HydrophobicContact CB-CE2 3.51Å; L351-Y388 HydrophobicContact CB-CG 4.08Å; L351-Y388 HydrophobicContact CD1-CD1 3.57Å; L351-Y388 HydrophobicContact CD1-CD2 4.29Å; L351-Y388 HydrophobicContact CD1-CE1 3.62Å; L351-Y388 HydrophobicContact CD1-CE2 4.33Å; L351-Y388 HydrophobicContact CD1-CG 3.94Å; S384-Y388 VanDerWaalsContact O-CD2 3.23Å; S384-Y388 WeakPolarHBondContact O-CD2 3.4Å; S384-Y388 PolarHBondContact O-N 3.36Å; S384-Y388 WeakPolarHBondContact OG-CD2 3.4Å; S384-Y388 VanDerWaalsContact OG-CE2 3.25Å; S384-Y388 WeakPolarHBondContact OG-CE2 3.34Å; F385-Y388 PolarHBondContact O-N 2.83Å; W386-Y388 VanDerWaalsContact C-N 3.34Å; W386-Y388 PolarHBondContact O-N 2.8Å; Y388-I390 PolarHBondContact O-N 3.05Å; Y388-V391 PolarHBondContact O-N 2.93Å; Y388-L392 VanDerWaalsContact O-CB 3.28Å; Y388-L392 WeakPolarHBondContact O-CB 3.37Å; Y388-L392 WeakPolarHBondContact O-CG 3.34Å; Y388-L392 PolarHBondContact O-N 3.36Å; Y388-S963 VanDerWaalsContact CE1-OG 3.24Å; Y388-S963 WeakPolarHBondContact CE1-OG 3.42Å; Y388-S963 WeakPolarHBondContact OH-CB 2.8Å; Y388-S963 PolarHBondContact OH-OG 3.37Å; Y388-Y968 WeakPolarHBondContact CE2-O 3.38Å; Y388-Y968 WeakPolarHBondContact OH-CA 3.3Å; Y388-Y968 PolarHBondContact OH-O 2.99Å; Y388-S970 VanDerWaalsContact CD2-OG 3.29Å; Y388-S970 WeakPolarHBondContact CD2-OG 3.29Å; Y388-S970 WeakPolarHBondContact CE2-OG 3.05Å; Y388-S970 PolarHBondContact OH-N 3.27Å
389	I	92.3	Very high	88.1	Confident	11 Å²	11	23.5 Å²	23.5	6%	0.056	11%	0.108	C	C	.	.	H	α-helix	trans	-57.9	-37.8	171.4	-68.8	-69.7	0	0	0	110.5	L123 L344 I345 S348 F385 W386 N393	L123-I389 HydrophobicContact CD2-CG2 3.88Å; L344-I389 HydrophobicContact CG-CD1 4.04Å; I345-I389 HydrophobicContact CG1-CD1 4.27Å; S348-I389 WeakPolarHBondContact OG-CD1 3.36Å; F385-I389 HydrophobicContact CE1-CG1 4.19Å; F385-I389 HydrophobicContact CE2-CD1 4.32Å; F385-I389 HydrophobicContact CE2-CG1 4.29Å; F385-I389 HydrophobicContact CZ-CD1 4.14Å; F385-I389 HydrophobicContact CZ-CG1 4.03Å; F385-I389 WeakPolarHBondContact O-CG1 3.44Å; F385-I389 PolarHBondContact O-N 3.43Å; W386-I389 PolarHBondContact O-N 2.65Å; I389-N393 WeakPolarHBondContact O-CB 3.44Å; I389-N393 PolarHBondContact O-N 3.02Å
390	I	90.8	Very high	87.8	Confident	1 Å²	1	18.7 Å²	18.7	1%	0.005	9%	0.089	C	C	.	.	H	α-helix	trans	-71.7	-50.5	176.1	-68.4	171.1	0	0	0	111.4	Q127 I132 T134 L135 W386 G387 Y388 L392 N393	Q127-I390 HydrophobicContact CG-CD1 3.92Å; Q127-I390 HydrophobicContact CG-CG1 4.16Å; Q127-I390 HydrophobicContact CG-CG2 4.01Å; I132-I390 HydrophobicContact CG2-CD1 3.81Å; T134-I390 WeakPolarHBondContact OG1-CG2 3.28Å; L135-I390 HydrophobicContact CB-CG2 3.87Å; L135-I390 HydrophobicContact CD1-CG2 4.02Å; L135-I390 HydrophobicContact CG-CG2 4.18Å; W386-I390 WeakPolarHBondContact O-CG1 3.26Å; W386-I390 PolarHBondContact O-N 3.36Å; W386-I390 VanDerWaalsContact O-N 3.09Å; G387-I390 WeakPolarHBondContact O-CB 3.06Å; G387-I390 PolarHBondContact O-N 2.93Å; Y388-I390 PolarHBondContact O-N 3.05Å; I390-L392 VanDerWaalsContact C-N 3.34Å; I390-L392 PolarHBondContact O-N 2.83Å; I390-N393 WeakPolarHBondContact O-CB 3.47Å; I390-N393 PolarHBondContact O-N 3.42Å; I390-N393 PolarHBondContact O-ND2 2.9Å; I390-N393 PolarHBondContact O-OD1 3.48Å
391	V	90.1	Very high	87.5	Confident	3 Å²	3	19 Å²	19	2%	0.018	9%	0.09	C	C	.	.	H	α-helix	trans	-62.1	-41.1	-178.4	173.7	0	0	0	0	112	T134 G387 Y388 N393 H959 S970 T972	T134-V391 HydrophobicContact CG2-CG2 4.34Å; T134-V391 VanDerWaalsContact OG1-CG2 3.29Å; T134-V391 WeakPolarHBondContact OG1-CG2 3.45Å; G387-V391 WeakPolarHBondContact O-CG2 3.41Å; G387-V391 PolarHBondContact O-N 3.21Å; Y388-V391 PolarHBondContact O-N 2.93Å; V391-N393 VanDerWaalsContact C-N 3.26Å; V391-N393 PolarHBondContact O-N 3.4Å; V391-H959 HydrophobicContact CG1-CB 3.75Å; V391-S970 WeakPolarHBondContact CG2-O 3.15Å; V391-T972 HydrophobicContact CG2-CG2 4.22Å
392	L	91.1	Very high	87.2	Confident	6 Å²	6	19.3 Å²	19.3	3%	0.031	9%	0.091	C	C	.	.	G	3₁₀ helix	trans	-88.1	8.5	-177.9	-58.2	175.2	0	0	0	112.4	L344 V347 L351 Y388 I390 T394 M395 T956 H959	L344-L392 HydrophobicContact CD1-CB 3.35Å; L344-L392 HydrophobicContact CD1-CD1 4.4Å; L344-L392 WeakPolarHBondContact CD1-O 3.23Å; V347-L392 HydrophobicContact CG1-CD1 3.85Å; L351-L392 HydrophobicContact CD1-CD1 4.19Å; Y388-L392 VanDerWaalsContact O-CB 3.28Å; Y388-L392 WeakPolarHBondContact O-CB 3.37Å; Y388-L392 WeakPolarHBondContact O-CG 3.34Å; Y388-L392 PolarHBondContact O-N 3.36Å; I390-L392 VanDerWaalsContact C-N 3.34Å; I390-L392 PolarHBondContact O-N 2.83Å; L392-T394 PolarHBondContact O-N 3.34Å; L392-T394 VanDerWaalsContact O-N 3.12Å; L392-M395 WeakPolarHBondContact O-CB 3.48Å; L392-M395 PolarHBondContact O-N 3.46Å; L392-T956 HydrophobicContact CB-CG2 4.1Å; L392-T956 HydrophobicContact CD2-CG2 3.71Å; L392-H959 HydrophobicContact CD2-CB 3.95Å
393	N	86.3	Confident	87	Confident	8 Å²	8	14.6 Å²	14.6	4%	0.043	7%	0.072	C	C	.	.	G	3₁₀ helix	trans	-60.1	-27.2	-176.2	75.1	8.4	0	0	0	113.2	L123 Q127 T140 I389 I390 V391 M395 V396	L123-N393 HydrophobicContact CD1-CB 3.67Å; L123-N393 HydrophobicContact CD2-CB 4.48Å; Q127-N393 PolarHBondContact NE2-ND2 2.95Å; T140-N393 PolarHBondContact OG1-ND2 3.26Å; I389-N393 WeakPolarHBondContact O-CB 3.44Å; I389-N393 PolarHBondContact O-N 3.02Å; I390-N393 WeakPolarHBondContact O-CB 3.47Å; I390-N393 PolarHBondContact O-N 3.42Å; I390-N393 PolarHBondContact O-ND2 2.9Å; I390-N393 PolarHBondContact O-OD1 3.48Å; V391-N393 VanDerWaalsContact C-N 3.26Å; V391-N393 PolarHBondContact O-N 3.4Å; N393-M395 PolarHBondContact O-N 3.04Å; N393-M395 VanDerWaalsContact O-N 3.12Å; N393-V396 PolarHBondContact O-N 3Å; N393-V396 VanDerWaalsContact O-N 3.08Å
394	T	82.4	Confident	86.9	Confident	13 Å²	13	13.7 Å²	13.7	8%	0.08	7%	0.067	C	C	.	.	G	3₁₀ helix	trans	-67.1	-11.6	179.9	56.5	0	0	0	0	112.7	L392 V396 F955 T956 I979	L392-T394 PolarHBondContact O-N 3.34Å; L392-T394 VanDerWaalsContact O-N 3.12Å; T394-V396 PolarHBondContact O-N 3.09Å; T394-F955 HydrophobicContact CG2-CE1 3.8Å; T394-F955 WeakPolarHBondContact OG1-CE1 2.94Å; T394-T956 PolarHBondContact OG1-OG1 3.1Å; T394-I979 HydrophobicContact CG2-CG2 4.25Å
395	M	84.6	Confident	86.7	Confident	12 Å²	12	14.3 Å²	14.3	6%	0.059	7%	0.069	C	C	.	.	G	3₁₀ helix	trans	-62.5	-33.9	171.1	-155	-177.3	-171	0	0	111.7	I340 L343 L344 L392 N393 P397 F953 T956 L1031	I340-M395 HydrophobicContact CG2-CB 4.08Å; I340-M395 HydrophobicContact CG2-CG 3.64Å; I340-M395 WeakPolarHBondContact CG2-O 3.09Å; I340-M395 HydrophobicContact CG2-SD 3.98Å; L343-M395 HydrophobicContact CD2-CE 3.36Å; L343-M395 HydrophobicContact CG-CE 3.89Å; L344-M395 HydrophobicContact CB-SD 4.41Å; L392-M395 WeakPolarHBondContact O-CB 3.48Å; L392-M395 PolarHBondContact O-N 3.46Å; N393-M395 PolarHBondContact O-N 3.04Å; N393-M395 VanDerWaalsContact O-N 3.12Å; M395-P397 VanDerWaalsContact O-CD 3.22Å; M395-P397 WeakPolarHBondContact O-CD 3.24Å; M395-F953 HydrophobicContact CE-CD1 3.86Å; M395-F953 HydrophobicContact CE-CE1 3.67Å; M395-F953 HydrophobicContact CG-CD1 4.1Å; M395-F953 HydrophobicContact CG-CE1 3.96Å; M395-T956 HydrophobicContact CB-CG2 4.07Å; M395-T956 PolarHBondContact N-OG1 2.93Å; M395-L1031 HydrophobicContact CE-CD1 4.44Å
396	V	82.3	Confident	86.4	Confident	4 Å²	4	14.6 Å²	14.6	2%	0.024	7%	0.074	C	C	.	.	S	Bend	trans	-96	101.7	169.6	-177.9	0	0	0	0	107.5	Y119 F120 V337 I340 N393 T394 I398	Y119-V396 HydrophobicContact CD1-CB 4.44Å; Y119-V396 HydrophobicContact CD1-CG1 4.12Å; Y119-V396 HydrophobicContact CE1-CB 3.72Å; Y119-V396 HydrophobicContact CE1-CG1 3.9Å; Y119-V396 HydrophobicContact CE1-CG2 4.12Å; F120-V396 WeakPolarHBondContact CE1-O 3.49Å; F120-V396 HydrophobicContact CZ-CB 4.47Å; F120-V396 HydrophobicContact CZ-CG1 3.94Å; F120-V396 VanDerWaalsContact CZ-O 3.25Å; F120-V396 WeakPolarHBondContact CZ-O 3.42Å; V337-V396 HydrophobicContact CG1-CG1 4.02Å; I340-V396 HydrophobicContact CB-CG2 4.45Å; I340-V396 HydrophobicContact CG2-CG2 3.68Å; N393-V396 PolarHBondContact O-N 3Å; N393-V396 VanDerWaalsContact O-N 3.08Å; T394-V396 PolarHBondContact O-N 3.09Å; V396-I398 PolarHBondContact O-N 3.35Å
397	P	76.4	Confident	86.4	Confident	3 Å²	3	11 Å²	11	2%	0.019	6%	0.061	C	C	.	.			trans	-83	116.6	-166.3	29.6	-35.4	0	0	0	113.1	M395 S399 L400 F948 N952	M395-P397 VanDerWaalsContact O-CD 3.22Å; M395-P397 WeakPolarHBondContact O-CD 3.24Å; P397-S399 VanDerWaalsContact C-N 3.29Å; P397-S399 PolarHBondContact O-N 3.44Å; P397-L400 HydrophobicContact CB-CB 4.4Å; P397-L400 HydrophobicContact CG-CB 3.93Å; P397-L400 HydrophobicContact CG-CD2 4.2Å; P397-L400 WeakPolarHBondContact O-CB 3.33Å; P397-L400 PolarHBondContact O-N 3.36Å; P397-F948 HydrophobicContact CB-CD1 4.43Å; P397-F948 HydrophobicContact CB-CE1 3.41Å; P397-F948 VanDerWaalsContact CB-CE1 3.41Å; P397-F948 HydrophobicContact CB-CZ 3.97Å; P397-F948 HydrophobicContact CG-CD1 4.15Å; P397-F948 HydrophobicContact CG-CE1 3.46Å; P397-F948 VanDerWaalsContact CG-CE1 3.46Å; P397-F948 HydrophobicContact CG-CZ 4.44Å; P397-N952 WeakPolarHBondContact CB-ND2 3.39Å
398	I	79.2	Confident	86.4	Confident	24 Å²	24	11.6 Å²	11.6	12%	0.123	6%	0.062	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.3	-44.4	177.8	-54.1	165.8	0	0	0	111.1	F120 T140 P143 V147 V396 L400	F120-I398 HydrophobicContact CD1-CD1 3.9Å; F120-I398 HydrophobicContact CD1-CG1 3.45Å; F120-I398 VanDerWaalsContact CD1-CG1 3.45Å; F120-I398 HydrophobicContact CD2-CB 4.43Å; F120-I398 HydrophobicContact CD2-CG1 3.92Å; F120-I398 HydrophobicContact CD2-CG2 4.2Å; F120-I398 HydrophobicContact CE1-CB 4.27Å; F120-I398 HydrophobicContact CE1-CD1 3.94Å; F120-I398 HydrophobicContact CE1-CG1 3.11Å; F120-I398 HydrophobicContact CE2-CB 3.97Å; F120-I398 HydrophobicContact CE2-CG1 3.62Å; F120-I398 HydrophobicContact CE2-CG2 4.14Å; F120-I398 HydrophobicContact CG-CD1 4.4Å; F120-I398 HydrophobicContact CG-CG1 3.86Å; F120-I398 HydrophobicContact CZ-CB 3.89Å; F120-I398 HydrophobicContact CZ-CD1 4.45Å; F120-I398 HydrophobicContact CZ-CG1 3.2Å; T140-I398 HydrophobicContact CG2-CD1 4.32Å; P143-I398 HydrophobicContact CB-CD1 4.03Å; P143-I398 HydrophobicContact CB-CG2 4.41Å; V147-I398 HydrophobicContact CB-CG2 4.5Å; V147-I398 HydrophobicContact CG2-CG2 4.14Å; V396-I398 PolarHBondContact O-N 3.35Å; I398-L400 PolarHBondContact O-N 3.16Å
399	S	82.9	Confident	86.2	Confident	14 Å²	14	14.5 Å²	14.5	10%	0.098	8%	0.078	C	C	.	.	H	α-helix	trans	-76.8	-3.7	-173.3	58.8	0	0	0	0	114.7	P397 S403 F948 N983	P397-S399 VanDerWaalsContact C-N 3.29Å; P397-S399 PolarHBondContact O-N 3.44Å; S399-S403 VanDerWaalsContact O-CB 3.26Å; S399-S403 WeakPolarHBondContact O-CB 3.46Å; S399-S403 PolarHBondContact O-N 2.8Å; S399-S403 PolarHBondContact O-OG 3.05Å; S399-F948 WeakPolarHBondContact OG-CZ 3.47Å; S399-N983 PolarHBondContact OG-O 2.84Å
400	L	84.9	Confident	86.2	Confident	0 Å²	0	14.9 Å²	14.9	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-59	-55.1	-179.4	177.7	57.5	0	0	0	111.7	M333 P397 I398 V402 S403 V404 F944 L945 F948 F949	M333-L400 HydrophobicContact CG-CD2 3.97Å; M333-L400 HydrophobicContact SD-CD1 4.4Å; M333-L400 HydrophobicContact SD-CD2 3.65Å; M333-L400 HydrophobicContact SD-CG 3.84Å; P397-L400 HydrophobicContact CB-CB 4.4Å; P397-L400 HydrophobicContact CG-CB 3.93Å; P397-L400 HydrophobicContact CG-CD2 4.2Å; P397-L400 WeakPolarHBondContact O-CB 3.33Å; P397-L400 PolarHBondContact O-N 3.36Å; I398-L400 PolarHBondContact O-N 3.16Å; L400-V402 VanDerWaalsContact C-N 3.35Å; L400-V402 PolarHBondContact O-N 2.82Å; L400-S403 PolarHBondContact O-N 3.01Å; L400-V404 HydrophobicContact CD1-CG2 4.23Å; L400-V404 WeakPolarHBondContact O-CG2 3.09Å; L400-V404 PolarHBondContact O-N 3.02Å; L400-F944 HydrophobicContact CD1-CE1 3.94Å; L400-F944 HydrophobicContact CD1-CZ 4.38Å; L400-L945 HydrophobicContact CD1-CD2 3.71Å; L400-F948 HydrophobicContact CB-CD1 4.27Å; L400-F948 HydrophobicContact CB-CE1 3.54Å; L400-F948 HydrophobicContact CB-CZ 3.97Å; L400-F948 HydrophobicContact CD1-CD1 3.57Å; L400-F948 HydrophobicContact CD1-CE1 3.73Å; L400-F948 HydrophobicContact CD1-CG 4.13Å; L400-F948 HydrophobicContact CD1-CZ 4.45Å; L400-F948 HydrophobicContact CG-CD1 4.41Å; L400-F948 HydrophobicContact CG-CE1 4.16Å; L400-F949 HydrophobicContact CD2-CE1 4.22Å; L400-F949 HydrophobicContact CD2-CZ 3.92Å
401	Y	80.6	Confident	86.3	Confident	34 Å²	34	14.9 Å²	14.9	13%	0.133	8%	0.084	C	C	.	.	H	α-helix	trans	-64.4	-40.6	-172.6	-68.5	-83.6	0	0	0	111.9	A116 M333 N334 V404 E405	A116-Y401 HydrophobicContact CB-CD2 4.2Å; A116-Y401 HydrophobicContact CB-CE2 3.5Å; M333-Y401 HydrophobicContact CE-CD1 3.66Å; M333-Y401 HydrophobicContact CE-CE1 3.36Å; M333-Y401 HydrophobicContact SD-CD1 4.25Å; M333-Y401 HydrophobicContact SD-CE1 3.97Å; N334-Y401 PolarHBondContact OD1-OH 2.8Å; Y401-V404 PolarHBondContact O-N 3.21Å; Y401-E405 WeakPolarHBondContact O-CG 3.42Å; Y401-E405 PolarHBondContact O-N 2.85Å
402	V	82.9	Confident	86.4	Confident	12 Å²	12	15 Å²	15	7%	0.073	9%	0.085	C	C	.	.	H	α-helix	trans	-70.7	-39.6	177.8	173.9	0	0	0	0	111.7	V147 I150 L400 V404 E405 V406	V147-V402 HydrophobicContact CB-CG2 3.67Å; V147-V402 HydrophobicContact CG1-CG2 3.29Å; V147-V402 HydrophobicContact CG2-CB 4.08Å; V147-V402 HydrophobicContact CG2-CG2 3.6Å; I150-V402 HydrophobicContact CB-CG1 4.25Å; I150-V402 HydrophobicContact CD1-CG1 3.97Å; I150-V402 HydrophobicContact CG2-CG1 3.99Å; L400-V402 VanDerWaalsContact C-N 3.35Å; L400-V402 PolarHBondContact O-N 2.82Å; V402-V404 VanDerWaalsContact C-N 3.3Å; V402-V404 PolarHBondContact O-N 3.14Å; V402-E405 PolarHBondContact O-N 3.49Å; V402-V406 HydrophobicContact CG1-CG2 4.34Å; V402-V406 WeakPolarHBondContact O-CG2 3.29Å; V402-V406 PolarHBondContact O-N 3.46Å
403	S	87.6	Confident	86.5	Confident	11 Å²	11	20.1 Å²	20.1	8%	0.077	11%	0.107	C	C	.	.	H	α-helix	trans	-61.1	-41.8	175.3	-59.4	0	0	0	0	111.2	S399 L400 V406 I407 F944	S399-S403 VanDerWaalsContact O-CB 3.26Å; S399-S403 WeakPolarHBondContact O-CB 3.46Å; S399-S403 PolarHBondContact O-N 2.8Å; S399-S403 PolarHBondContact O-OG 3.05Å; L400-S403 PolarHBondContact O-N 3.01Å; S403-V406 PolarHBondContact O-N 2.76Å; S403-I407 WeakPolarHBondContact O-CB 3.41Å; S403-I407 WeakPolarHBondContact O-CD1 3.31Å; S403-I407 VanDerWaalsContact O-CG1 3.24Å; S403-I407 WeakPolarHBondContact O-CG1 3.15Å; S403-I407 PolarHBondContact O-N 3.34Å; S403-F944 VanDerWaalsContact CB-CZ 3.42Å
404	V	88.8	Confident	86.9	Confident	3 Å²	3	23 Å²	23	2%	0.018	12%	0.119	C	C	.	.	H	α-helix	trans	-61.5	-43.6	173.9	169.7	0	0	0	0	111.4	L400 Y401 V402 I407 R408 M941 F944 L945	L400-V404 HydrophobicContact CD1-CG2 4.23Å; L400-V404 WeakPolarHBondContact O-CG2 3.09Å; L400-V404 PolarHBondContact O-N 3.02Å; Y401-V404 PolarHBondContact O-N 3.21Å; V402-V404 VanDerWaalsContact C-N 3.3Å; V402-V404 PolarHBondContact O-N 3.14Å; V404-I407 PolarHBondContact O-N 3.03Å; V404-R408 WeakPolarHBondContact O-CB 3.36Å; V404-R408 WeakPolarHBondContact O-CG 3.49Å; V404-R408 PolarHBondContact O-N 2.92Å; V404-M941 HydrophobicContact CG1-CE 3.92Å; V404-M941 HydrophobicContact CG1-SD 4.21Å; V404-M941 HydrophobicContact CG2-SD 4.08Å; V404-F944 HydrophobicContact CG2-CD1 4.26Å; V404-F944 HydrophobicContact CG2-CE1 3.6Å; V404-F944 HydrophobicContact CG2-CZ 4.45Å; V404-L945 HydrophobicContact CG2-CD2 4.3Å
405	E	85.7	Confident	87.6	Confident	22 Å²	22	22.4 Å²	22.4	10%	0.103	12%	0.116	C	C	.	.	H	α-helix	trans	-62.9	-43.6	176.7	-75.5	-179.8	-174.9	0	0	112.1	R114 T151 Y401 V402 R408 L409	R114-E405 IonicContact CZ-OE1 3.63Å; R114-E405 IonicContact NH1-OE1 3.96Å; R114-E405 PolarHBondContact NH1-OE1 3.21Å; R114-E405 IonicContact NH2-OE1 2.72Å; R114-E405 PolarHBondContact NH2-OE1 3.47Å; T151-E405 PolarHBondContact OG1-OE2 2.9Å; Y401-E405 WeakPolarHBondContact O-CG 3.42Å; Y401-E405 PolarHBondContact O-N 2.85Å; V402-E405 PolarHBondContact O-N 3.49Å; E405-R408 PolarHBondContact O-N 3.17Å; E405-L409 WeakPolarHBondContact O-CG 3.49Å; E405-L409 PolarHBondContact O-N 2.78Å
406	V	88.2	Confident	88	Confident	48 Å²	48	23.6 Å²	23.6	29%	0.291	12%	0.122	S	C	.	.	H	α-helix	trans	-63.7	-42.6	176.7	173.1	0	0	0	0	111.3	V402 S403 R408 L409 G410 L992	V402-V406 HydrophobicContact CG1-CG2 4.34Å; V402-V406 WeakPolarHBondContact O-CG2 3.29Å; V402-V406 PolarHBondContact O-N 3.46Å; S403-V406 PolarHBondContact O-N 2.76Å; V406-R408 PolarHBondContact O-N 3.13Å; V406-L409 PolarHBondContact O-N 2.79Å; V406-G410 PolarHBondContact O-N 3.34Å; V406-L992 HydrophobicContact CB-CD1 4.41Å; V406-L992 HydrophobicContact CG1-CD1 3.99Å; V406-L992 HydrophobicContact CG1-CD2 4.42Å
407	I	92.4	Very high	88.6	Confident	0 Å²	0	31.8 Å²	31.8	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-60.2	-47.9	176.2	-73	163.7	0	0	0	110.6	S403 V404 L409 G410 Q411 M941 F944 L992 G995 L996	S403-I407 WeakPolarHBondContact O-CB 3.41Å; S403-I407 WeakPolarHBondContact O-CD1 3.31Å; S403-I407 VanDerWaalsContact O-CG1 3.24Å; S403-I407 WeakPolarHBondContact O-CG1 3.15Å; S403-I407 PolarHBondContact O-N 3.34Å; V404-I407 PolarHBondContact O-N 3.03Å; I407-L409 VanDerWaalsContact C-N 3.34Å; I407-L409 PolarHBondContact O-N 3.07Å; I407-G410 PolarHBondContact O-N 3.21Å; I407-Q411 HydrophobicContact CG2-CG 4.26Å; I407-Q411 WeakPolarHBondContact O-CB 3.42Å; I407-Q411 VanDerWaalsContact O-CG 3.26Å; I407-Q411 WeakPolarHBondContact O-CG 3.45Å; I407-Q411 PolarHBondContact O-N 3.29Å; I407-M941 HydrophobicContact CB-CE 4.41Å; I407-M941 HydrophobicContact CG2-CE 3.85Å; I407-F944 HydrophobicContact CD1-CB 4.17Å; I407-F944 HydrophobicContact CD1-CD1 3.87Å; I407-F944 HydrophobicContact CD1-CD2 3.23Å; I407-F944 HydrophobicContact CD1-CE1 4.14Å; I407-F944 HydrophobicContact CD1-CE2 3.54Å; I407-F944 HydrophobicContact CD1-CG 3.45Å; I407-F944 VanDerWaalsContact CD1-CG 3.45Å; I407-F944 HydrophobicContact CD1-CZ 4.02Å; I407-L992 HydrophobicContact CG1-CG 4.48Å; I407-G995 VanDerWaalsContact CG2-O 3.32Å; I407-G995 WeakPolarHBondContact CG2-O 3.09Å; I407-L996 HydrophobicContact CB-CD2 4.47Å; I407-L996 HydrophobicContact CG1-CG 4.4Å; I407-L996 WeakPolarHBondContact O-CD2 3.31Å
408	R	91	Very high	89.5	Confident	14 Å²	14	32.7 Å²	32.7	5%	0.053	16%	0.158	C	C	.	.	H	α-helix	trans	-59.5	-42	176.8	-83.9	167.2	171.9	166.5	8	112.3	T327 D330 V404 E405 V406 S412 T435 T436 N438 E439 M941	T327-R408 PolarHBondContact OG1-NH2 2.84Å; D330-R408 VanDerWaalsContact CG-NH2 3.33Å; D330-R408 IonicContact OD1-CZ 3.89Å; D330-R408 IonicContact OD1-NH1 3.16Å; D330-R408 PolarHBondContact OD1-NH1 3.29Å; D330-R408 VanDerWaalsContact OD1-NH1 3.11Å; D330-R408 IonicContact OD1-NH2 2.7Å; D330-R408 PolarHBondContact OD1-NH2 3.2Å; D330-R408 IonicContact OD2-CZ 3.25Å; D330-R408 IonicContact OD2-NH1 3.44Å; D330-R408 IonicContact OD2-NH2 3.76Å; D330-R408 PolarHBondContact OD2-NH2 3.09Å; V404-R408 WeakPolarHBondContact O-CB 3.36Å; V404-R408 WeakPolarHBondContact O-CG 3.49Å; V404-R408 PolarHBondContact O-N 2.92Å; E405-R408 PolarHBondContact O-N 3.17Å; V406-R408 PolarHBondContact O-N 3.13Å; R408-S412 WeakPolarHBondContact O-CB 3.49Å; R408-S412 PolarHBondContact O-N 2.79Å; R408-T435 VanDerWaalsContact CB-O 3.31Å; R408-T435 WeakPolarHBondContact CB-O 3.23Å; R408-T436 PolarHBondContact NE-O 3.33Å; R408-N438 PolarHBondContact O-ND2 3.48Å; R408-E439 IonicContact CZ-OE1 2.95Å; R408-E439 IonicContact NE-OE1 3.35Å; R408-E439 PolarHBondContact NE-OE1 3.49Å; R408-E439 IonicContact NE-OE2 2.75Å; R408-E439 PolarHBondContact NE-OE2 3.09Å; R408-E439 IonicContact NH2-OE1 3.18Å; R408-E439 PolarHBondContact NH2-OE1 3.15Å; R408-E439 IonicContact NH2-OE2 3.53Å; R408-M941 HydrophobicContact CG-CE 4.16Å
409	L	89.4	Confident	90.2	Very high	62 Å²	62	38.7 Å²	38.7	33%	0.325	19%	0.189	S	C	.	.	H	α-helix	trans	-63.4	-46.1	175.6	-74	170.1	0	0	0	112.1	K154 E405 V406 I407 S412 K413 T435	K154-L409 HydrophobicContact CD-CD1 4.41Å; K154-L409 HydrophobicContact CG-CD1 4.2Å; E405-L409 WeakPolarHBondContact O-CG 3.49Å; E405-L409 PolarHBondContact O-N 2.78Å; V406-L409 PolarHBondContact O-N 2.79Å; I407-L409 VanDerWaalsContact C-N 3.34Å; I407-L409 PolarHBondContact O-N 3.07Å; L409-S412 PolarHBondContact O-N 3.08Å; L409-K413 WeakPolarHBondContact O-CG 3.44Å; L409-K413 PolarHBondContact O-N 2.83Å; L409-T435 HydrophobicContact CD2-CG2 3.72Å
410	G	92.3	Very high	90.7	Very high	19 Å²	19	43.1 Å²	43.1	20%	0.196	21%	0.208	C	C	.	.	H	α-helix	trans	-63.7	-44.7	177.8	0	0	0	0	0	112.6	V406 I407 S412 K413 F414	V406-G410 PolarHBondContact O-N 3.34Å; I407-G410 PolarHBondContact O-N 3.21Å; G410-S412 VanDerWaalsContact C-N 3.35Å; G410-S412 PolarHBondContact O-N 3.36Å; G410-K413 PolarHBondContact O-N 2.81Å; G410-F414 WeakPolarHBondContact O-CD2 3.36Å; G410-F414 WeakPolarHBondContact O-CG 3.27Å; G410-F414 PolarHBondContact O-N 3.29Å
411	Q	94.2	Very high	91.2	Very high	1 Å²	1	43.1 Å²	43.1	1%	0.005	21%	0.208	C	C	.	.	H	α-helix	trans	-60	-43	175.5	-71.9	172.9	-3.7	0	0	112	I407 K413 F414 I415 N438 G995	I407-Q411 HydrophobicContact CG2-CG 4.26Å; I407-Q411 WeakPolarHBondContact O-CB 3.42Å; I407-Q411 VanDerWaalsContact O-CG 3.26Å; I407-Q411 WeakPolarHBondContact O-CG 3.45Å; I407-Q411 PolarHBondContact O-N 3.29Å; Q411-K413 VanDerWaalsContact C-N 3.32Å; Q411-K413 PolarHBondContact O-N 2.95Å; Q411-F414 PolarHBondContact O-N 2.86Å; Q411-I415 PolarHBondContact O-N 3.11Å; Q411-I415 VanDerWaalsContact O-N 3.11Å; Q411-N438 HydrophobicContact CB-CB 4.28Å; Q411-G995 PolarHBondContact NE2-O 2.97Å; Q411-G995 VanDerWaalsContact NE2-O 3.14Å
412	S	92.3	Very high	91.8	Very high	5 Å²	5	45.5 Å²	45.5	4%	0.035	22%	0.217	C	C	.	.	H	α-helix	trans	-61.5	-39	175.5	173.1	0	0	0	0	112.1	R408 L409 G410 I415 N416 A432 N438	R408-S412 WeakPolarHBondContact O-CB 3.49Å; R408-S412 PolarHBondContact O-N 2.79Å; L409-S412 PolarHBondContact O-N 3.08Å; G410-S412 VanDerWaalsContact C-N 3.35Å; G410-S412 PolarHBondContact O-N 3.36Å; S412-I415 PolarHBondContact O-N 3.25Å; S412-N416 VanDerWaalsContact O-CG 3.24Å; S412-N416 PolarHBondContact O-N 2.77Å; S412-N416 PolarHBondContact O-ND2 3.36Å; S412-N416 PolarHBondContact O-OD1 3.01Å; S412-A432 VanDerWaalsContact OG-CB 3.24Å; S412-A432 WeakPolarHBondContact OG-CB 3.48Å; S412-N438 PolarHBondContact N-ND2 3.48Å
413	K	92.2	Very high	92.2	Very high	114 Å²	114	46.6 Å²	46.6	50%	0.496	22%	0.221	S	C	.	.	H	α-helix	trans	-66.9	-38	174.1	-70.7	-66.4	-175.6	-178.8	0	112.8	L409 G410 Q411 I415 N416 W417	L409-K413 WeakPolarHBondContact O-CG 3.44Å; L409-K413 PolarHBondContact O-N 2.83Å; G410-K413 PolarHBondContact O-N 2.81Å; Q411-K413 VanDerWaalsContact C-N 3.32Å; Q411-K413 PolarHBondContact O-N 2.95Å; K413-I415 VanDerWaalsContact C-N 3.31Å; K413-I415 PolarHBondContact O-N 3.22Å; K413-N416 PolarHBondContact O-N 3.45Å; K413-N416 VanDerWaalsContact O-N 3.13Å; K413-W417 HydrophobicContact CB-CE3 4.39Å; K413-W417 HydrophobicContact CB-CH2 4.31Å; K413-W417 HydrophobicContact CB-CZ2 4.45Å; K413-W417 HydrophobicContact CB-CZ3 4.27Å; K413-W417 HydrophobicContact CD-CZ2 4.48Å; K413-W417 PolarHBondContact O-N 3.28Å
414	F	95.4	Very high	92.2	Very high	67 Å²	67	50.4 Å²	50.4	29%	0.294	25%	0.247	S	C	.	.	H	α-helix	trans	-63.7	-35.9	175.2	-67.2	-37.6	0	0	0	113	G410 Q411 N416 W417 D418 L997	G410-F414 WeakPolarHBondContact O-CD2 3.36Å; G410-F414 WeakPolarHBondContact O-CG 3.27Å; G410-F414 PolarHBondContact O-N 3.29Å; Q411-F414 PolarHBondContact O-N 2.86Å; F414-N416 VanDerWaalsContact C-N 3.32Å; F414-W417 HydrophobicContact CD1-CE3 4.15Å; F414-W417 HydrophobicContact CD1-CZ3 4.46Å; F414-W417 HydrophobicContact CE1-CZ3 4.44Å; F414-W417 PolarHBondContact O-N 3.49Å; F414-D418 PolarHBondContact O-N 2.99Å; F414-L997 HydrophobicContact CE2-CD2 4.07Å; F414-L997 HydrophobicContact CZ-CD2 3.71Å
415	I	95.4	Very high	92	Very high	2 Å²	2	57.6 Å²	57.6	1%	0.01	28%	0.281	C	S	.	.	H	α-helix	trans	-62	-43.4	171.9	-67.3	168.2	0	0	0	110.3	Q411 S412 K413 W417 D418 M421 A432 L441 Y918 L929 H933	Q411-I415 PolarHBondContact O-N 3.11Å; Q411-I415 VanDerWaalsContact O-N 3.11Å; S412-I415 PolarHBondContact O-N 3.25Å; K413-I415 VanDerWaalsContact C-N 3.31Å; K413-I415 PolarHBondContact O-N 3.22Å; I415-W417 VanDerWaalsContact C-N 3.3Å; I415-W417 PolarHBondContact O-N 2.92Å; I415-D418 PolarHBondContact O-N 3.08Å; I415-M421 HydrophobicContact CG2-CE 4.01Å; I415-A432 HydrophobicContact CB-CB 4.44Å; I415-A432 HydrophobicContact CG2-CB 4.27Å; I415-L441 HydrophobicContact CD1-CD1 4.36Å; I415-Y918 HydrophobicContact CD1-CE1 3.9Å; I415-L929 HydrophobicContact CD1-CD1 4.19Å; I415-L929 HydrophobicContact CG1-CD1 4.49Å; I415-L929 HydrophobicContact CG2-CD1 4.06Å; I415-H933 HydrophobicContact CD1-CB 4.3Å; I415-H933 HydrophobicContact CG1-CB 3.94Å
416	N	93.7	Very high	91.8	Very high	37 Å²	37	60.2 Å²	60.2	20%	0.198	29%	0.292	C	S	.	.	H	α-helix	trans	-69.1	-26.6	-178.6	-61.4	-14.4	0	0	0	114	S412 K413 F414 A430 K431 A432	S412-N416 VanDerWaalsContact O-CG 3.24Å; S412-N416 PolarHBondContact O-N 2.77Å; S412-N416 PolarHBondContact O-ND2 3.36Å; S412-N416 PolarHBondContact O-OD1 3.01Å; K413-N416 PolarHBondContact O-N 3.45Å; K413-N416 VanDerWaalsContact O-N 3.13Å; F414-N416 VanDerWaalsContact C-N 3.32Å; N416-A430 WeakPolarHBondContact CA-O 3.1Å; N416-A430 PolarHBondContact OD1-O 3.46Å; N416-K431 VanDerWaalsContact OD1-CA 3.31Å; N416-K431 WeakPolarHBondContact OD1-CA 3.44Å; N416-A432 PolarHBondContact OD1-N 3.13Å
417	W	94.8	Very high	91.7	Very high	176 Å²	176	63.6 Å²	63.6	67%	0.667	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.5	1.5	-178.3	-66.5	-26	0	0	0	113.7	K413 F414 I415 L419	K413-W417 HydrophobicContact CB-CE3 4.39Å; K413-W417 HydrophobicContact CB-CH2 4.31Å; K413-W417 HydrophobicContact CB-CZ2 4.45Å; K413-W417 HydrophobicContact CB-CZ3 4.27Å; K413-W417 HydrophobicContact CD-CZ2 4.48Å; K413-W417 PolarHBondContact O-N 3.28Å; F414-W417 HydrophobicContact CD1-CE3 4.15Å; F414-W417 HydrophobicContact CD1-CZ3 4.46Å; F414-W417 HydrophobicContact CE1-CZ3 4.44Å; F414-W417 PolarHBondContact O-N 3.49Å; I415-W417 VanDerWaalsContact C-N 3.3Å; I415-W417 PolarHBondContact O-N 2.92Å; W417-L419 PolarHBondContact O-N 2.94Å
418	D	95.7	Very high	91.3	Very high	22 Å²	22	65 Å²	65	12%	0.118	32%	0.317	C	S	.	.			trans	-76.4	106.8	-178.5	-167	-8.7	0	0	0	111.9	F414 I415 Q420 M421 R928 H933	F414-D418 PolarHBondContact O-N 2.99Å; I415-D418 PolarHBondContact O-N 3.08Å; D418-Q420 PolarHBondContact O-N 3.11Å; D418-Q420 PolarHBondContact OD1-N 2.86Å; D418-Q420 VanDerWaalsContact OD1-N 3.09Å; D418-M421 HydrophobicContact CB-CE 3.72Å; D418-M421 PolarHBondContact O-N 3.19Å; D418-R928 IonicContact OD1-CZ 3.79Å; D418-R928 IonicContact OD1-NE 3.79Å; D418-R928 PolarHBondContact OD1-NE 3.02Å; D418-R928 IonicContact OD1-NH2 3.67Å; D418-R928 PolarHBondContact OD1-NH2 3.46Å; D418-R928 IonicContact OD2-CZ 3.44Å; D418-R928 IonicContact OD2-NE 2.86Å; D418-R928 PolarHBondContact OD2-NE 2.97Å; D418-R928 IonicContact OD2-NH2 3.07Å; D418-R928 PolarHBondContact OD2-NH2 3.08Å; D418-H933 IonicContact OD2-CD2 3.11Å; D418-H933 IonicContact OD2-CE1 2.72Å; D418-H933 IonicContact OD2-NE2 3.4Å; D418-H933 PolarHBondContact OD2-NE2 3.11Å
419	L	94.4	Very high	91.3	Very high	149 Å²	149	67.4 Å²	67.4	78%	0.78	33%	0.334	S	S	*	.	G	3₁₀ helix	trans	-63.2	-23.7	179.4	-66	174.8	0	0	0	113.3	W417 M421 Y422	W417-L419 PolarHBondContact O-N 2.94Å; L419-M421 PolarHBondContact O-N 3.17Å; L419-Y422 WeakPolarHBondContact O-CB 3.3Å; L419-Y422 PolarHBondContact O-N 3.49Å
420	Q	93.8	Very high	91.4	Very high	107 Å²	107	64.7 Å²	64.7	50%	0.5	32%	0.321	S	S	.	.	G	3₁₀ helix	trans	-76.1	-10.4	176.3	-65.6	-172	25.1	0	0	112.9	D418 Y925 R928 D1003	D418-Q420 PolarHBondContact O-N 3.11Å; D418-Q420 PolarHBondContact OD1-N 2.86Å; D418-Q420 VanDerWaalsContact OD1-N 3.09Å; Q420-Y925 WeakPolarHBondContact O-CE1 3.29Å; Q420-R928 VanDerWaalsContact CD-NH1 3.29Å; Q420-D1003 PolarHBondContact NE2-OD2 3.03Å
421	M	93.9	Very high	91.3	Very high	1 Å²	1	69 Å²	69	1%	0.005	33%	0.334	C	S	.	.	G	3₁₀ helix	trans	-111.4	25.3	171.8	-57.8	-170.4	-66.7	0	0	111.5	I415 D418 L419 A430 Y925 R928 L929 H933	I415-M421 HydrophobicContact CG2-CE 4.01Å; D418-M421 HydrophobicContact CB-CE 3.72Å; D418-M421 PolarHBondContact O-N 3.19Å; L419-M421 PolarHBondContact O-N 3.17Å; M421-A430 HydrophobicContact CB-CB 3.75Å; M421-A430 HydrophobicContact CE-CB 4.15Å; M421-A430 PolarHBondContact O-N 3.25Å; M421-A430 VanDerWaalsContact O-N 3.11Å; M421-Y925 HydrophobicContact CB-CD2 4.37Å; M421-Y925 HydrophobicContact CB-CG 4.21Å; M421-Y925 HydrophobicContact CG-CG 4.32Å; M421-R928 HydrophobicContact CG-CB 4.32Å; M421-R928 HydrophobicContact CG-CG 4.19Å; M421-R928 HydrophobicContact SD-CB 4.21Å; M421-R928 HydrophobicContact SD-CG 4.18Å; M421-L929 HydrophobicContact SD-CB 4.26Å; M421-H933 VanDerWaalsContact CE-CD2 3.46Å; M421-H933 WeakPolarHBondContact CE-CD2 3.44Å; M421-H933 WeakPolarHBondContact CE-NE2 3.43Å
422	Y	93.8	Very high	91.1	Very high	83 Å²	83	69.3 Å²	69.3	33%	0.325	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	126.1	174	170.8	-99.5	0	0	0	110.3	L419 D427 P429 Y925	L419-Y422 WeakPolarHBondContact O-CB 3.3Å; L419-Y422 PolarHBondContact O-N 3.49Å; Y422-D427 WeakPolarHBondContact CE2-OD1 3.45Å; Y422-D427 PolarHBondContact OH-OD1 3.15Å; Y422-P429 HydrophobicContact CD2-CB 4.06Å; Y422-Y925 PolarHBondContact O-OH 3.06Å
423	Y	90.9	Very high	90.8	Very high	35 Å²	35	73.4 Å²	73.4	14%	0.137	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	112.7	179	-173.6	-123.6	0	0	0	110.8	E425 K426 D427 T428 A921 Q922	Y423-E425 HydrophobicContact CD1-CB 4.36Å; Y423-E425 HydrophobicContact CE1-CB 3.74Å; Y423-E425 HydrophobicContact CE1-CG 4.45Å; Y423-E425 HydrophobicContact CE2-CB 4.32Å; Y423-E425 HydrophobicContact CE2-CG 4.19Å; Y423-E425 PolarHBondContact OH-OE2 2.74Å; Y423-K426 HydrophobicContact CD1-CB 3.85Å; Y423-K426 HydrophobicContact CD1-CD 4.25Å; Y423-K426 HydrophobicContact CD1-CG 4Å; Y423-K426 HydrophobicContact CE1-CB 4.13Å; Y423-K426 HydrophobicContact CE1-CD 4Å; Y423-K426 HydrophobicContact CE1-CG 3.75Å; Y423-D427 PolarHBondContact O-N 2.8Å; Y423-T428 PolarHBondContact N-O 3.34Å; Y423-T428 PolarHBondContact O-N 3.19Å; Y423-T428 VanDerWaalsContact O-N 3.1Å; Y423-A921 VanDerWaalsContact CB-CB 3.5Å; Y423-A921 HydrophobicContact CD1-CB 3.6Å; Y423-A921 HydrophobicContact CE1-CB 4.47Å; Y423-A921 HydrophobicContact CG-CB 3.74Å; Y423-Q922 HydrophobicContact CD2-CG 4Å; Y423-Q922 HydrophobicContact CE2-CG 4.07Å; Y423-Q922 HydrophobicContact CG-CG 4.48Å
424	S	88.8	Confident	90.3	Very high	91 Å²	91	69.8 Å²	69.8	64%	0.636	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.7	-34.9	-173	54.3	0	0	0	0	114	K426 D427	S424-K426 VanDerWaalsContact C-N 3.34Å; S424-K426 PolarHBondContact O-N 3.43Å; S424-D427 PolarHBondContact O-N 3.08Å
425	E	85	Confident	89.7	Confident	155 Å²	155	68 Å²	68	72%	0.724	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	-31.8	-174.6	-59.2	-172.7	163.9	0	0	113.4	Y423	Y423-E425 HydrophobicContact CD1-CB 4.36Å; Y423-E425 HydrophobicContact CE1-CB 3.74Å; Y423-E425 HydrophobicContact CE1-CG 4.45Å; Y423-E425 HydrophobicContact CE2-CB 4.32Å; Y423-E425 HydrophobicContact CE2-CG 4.19Å; Y423-E425 PolarHBondContact OH-OE2 2.74Å
426	K	79.9	Confident	89.2	Confident	77 Å²	77	68.7 Å²	68.7	34%	0.335	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.1	11.6	177.7	-63.4	179	179.5	-174.5	0	113.4	Y423 S424 T428 S905 G906	Y423-K426 HydrophobicContact CD1-CB 3.85Å; Y423-K426 HydrophobicContact CD1-CD 4.25Å; Y423-K426 HydrophobicContact CD1-CG 4Å; Y423-K426 HydrophobicContact CE1-CB 4.13Å; Y423-K426 HydrophobicContact CE1-CD 4Å; Y423-K426 HydrophobicContact CE1-CG 3.75Å; S424-K426 VanDerWaalsContact C-N 3.34Å; S424-K426 PolarHBondContact O-N 3.43Å; K426-T428 WeakPolarHBondContact CB-OG1 3.43Å; K426-T428 PolarHBondContact O-N 2.97Å; K426-T428 VanDerWaalsContact O-N 3.15Å; K426-T428 PolarHBondContact O-OG1 3.29Å; K426-S905 PolarHBondContact NZ-O 3.11Å; K426-S905 VanDerWaalsContact NZ-O 3.1Å; K426-G906 VanDerWaalsContact NZ-C 3.28Å; K426-G906 PolarHBondContact NZ-O 3.32Å
427	D	85.6	Confident	89	Confident	118 Å²	118	67 Å²	67	63%	0.631	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	43.8	49.1	-175.3	-174.3	21	0	0	0	112.4	Y422 Y423 S424	Y422-D427 WeakPolarHBondContact CE2-OD1 3.45Å; Y422-D427 PolarHBondContact OH-OD1 3.15Å; Y423-D427 PolarHBondContact O-N 2.8Å; S424-D427 PolarHBondContact O-N 3.08Å
428	T	84.4	Confident	88.9	Confident	30 Å²	30	58.6 Å²	58.6	18%	0.184	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	107.7	-169.1	-58.5	0	0	0	0	110.1	Y423 K426 A921	Y423-T428 PolarHBondContact N-O 3.34Å; Y423-T428 PolarHBondContact O-N 3.19Å; Y423-T428 VanDerWaalsContact O-N 3.1Å; K426-T428 WeakPolarHBondContact CB-OG1 3.43Å; K426-T428 PolarHBondContact O-N 2.97Å; K426-T428 VanDerWaalsContact O-N 3.15Å; K426-T428 PolarHBondContact O-OG1 3.29Å; T428-A921 HydrophobicContact CG2-CB 4.28Å
429	P	91.5	Very high	88.8	Confident	65 Å²	65	57.5 Å²	57.5	42%	0.422	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	159.4	173	32.3	-33.9	0	0	0	112.1	Y422	Y422-P429 HydrophobicContact CD2-CB 4.06Å
430	A	92.4	Very high	88.7	Confident	4 Å²	4	50.6 Å²	50.6	3%	0.033	26%	0.255	C	S	.	.			trans	-60.5	139.2	164.1	0	0	0	0	0	110.9	N416 M421 A919 F920	N416-A430 WeakPolarHBondContact CA-O 3.1Å; N416-A430 PolarHBondContact OD1-O 3.46Å; M421-A430 HydrophobicContact CB-CB 3.75Å; M421-A430 HydrophobicContact CE-CB 4.15Å; M421-A430 PolarHBondContact O-N 3.25Å; M421-A430 VanDerWaalsContact O-N 3.11Å; A430-A919 CarbonylContact C-O 3.54Å; A430-A919 WeakPolarHBondContact CA-O 3.4Å; A430-F920 HydrophobicContact CB-CB 4.13Å
431	K	90	Very high	88.8	Confident	110 Å²	110	45.5 Å²	45.5	48%	0.478	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	110.9	-178.7	-166.9	173.7	-175.7	175.2	0	110.9	N416 R433 Y918 A919	N416-K431 VanDerWaalsContact OD1-CA 3.31Å; N416-K431 WeakPolarHBondContact OD1-CA 3.44Å; K431-R433 HydrophobicContact CG-CG 4.29Å; K431-R433 PolarHBondContact O-N 3.47Å; K431-Y918 CarbonylContact O-C 3.12Å; K431-Y918 WeakPolarHBondContact O-CA 2.99Å; K431-A919 PolarHBondContact N-O 2.9Å; K431-A919 PolarHBondContact O-N 3.22Å
432	A	90	Very high	88.8	Confident	8 Å²	8	45.5 Å²	45.5	7%	0.066	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	105.1	164.5	0	0	0	0	0	108.8	S412 I415 N416 Y918	S412-A432 VanDerWaalsContact OG-CB 3.24Å; S412-A432 WeakPolarHBondContact OG-CB 3.48Å; I415-A432 HydrophobicContact CB-CB 4.44Å; I415-A432 HydrophobicContact CG2-CB 4.27Å; N416-A432 PolarHBondContact OD1-N 3.13Å; A432-Y918 HydrophobicContact CB-CD1 3.75Å; A432-Y918 HydrophobicContact CB-CE1 3.7Å
433	R	84.9	Confident	88.8	Confident	91 Å²	91	42.4 Å²	42.4	34%	0.343	22%	0.22	S	C	.	.			trans	-85.7	-34.9	179.3	-59.6	-179.8	65.8	101.5	-1.2	111.2	K431 V913 M914 S916 D917	K431-R433 HydrophobicContact CG-CG 4.29Å; K431-R433 PolarHBondContact O-N 3.47Å; R433-V913 WeakPolarHBondContact CD-O 3.35Å; R433-V913 PolarHBondContact NE-O 3.37Å; R433-M914 PolarHBondContact NH1-SD 3.44Å; R433-M914 PolarHBondContact NH2-O 3.01Å; R433-M914 PolarHBondContact NH2-SD 2.82Å; R433-S916 WeakPolarHBondContact CD-O 3.32Å; R433-D917 WeakPolarHBondContact CA-O 3.31Å; R433-D917 WeakPolarHBondContact CB-O 3.48Å; R433-D917 PolarHBondContact N-O 3.31Å
434	T	82.7	Confident	89	Confident	37 Å²	37	40.7 Å²	40.7	23%	0.227	21%	0.213	C	C	.	.			trans	-103.1	119.3	174.7	-57.1	0	0	0	0	109.9	T436 L437 D917	T434-T436 WeakPolarHBondContact CG2-OG1 3.35Å; T434-L437 HydrophobicContact CG2-CD1 3.8Å; T434-L437 HydrophobicContact CG2-CG 3.78Å; T434-D917 WeakPolarHBondContact CB-OD1 3.49Å; T434-D917 PolarHBondContact N-O 3.28Å; T434-D917 PolarHBondContact OG1-OD1 3.46Å
435	T	83.1	Confident	89.3	Confident	29 Å²	29	39 Å²	39	18%	0.178	20%	0.195	C	C	.	.	S	Bend	trans	-82.2	-19.4	-176.4	60.8	0	0	0	0	113.3	R408 L409 N438	R408-T435 VanDerWaalsContact CB-O 3.31Å; R408-T435 WeakPolarHBondContact CB-O 3.23Å; L409-T435 HydrophobicContact CD2-CG2 3.72Å; T435-N438 PolarHBondContact O-ND2 2.98Å; T435-N438 VanDerWaalsContact O-ND2 3.16Å
436	T	84.1	Confident	89.8	Confident	18 Å²	18	32.5 Å²	32.5	11%	0.11	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83	-11.8	-169.3	52.4	0	0	0	0	115.1	F324 T327 R408 T434	F324-T436 HydrophobicContact CZ-CG2 4.32Å; T327-T436 WeakPolarHBondContact CG2-O 3.09Å; R408-T436 PolarHBondContact NE-O 3.33Å; T434-T436 WeakPolarHBondContact CG2-OG1 3.35Å
437	L	89.6	Confident	90.5	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.5	4.5	-166.6	-57.6	178.1	0	0	0	114.2	K325 T327 T434 E439 Q440 L441 D917 Y918	K325-L437 HydrophobicContact CB-CD1 4.28Å; K325-L437 HydrophobicContact CB-CD2 3.96Å; K325-L437 HydrophobicContact CD-CD1 4Å; T327-L437 HydrophobicContact CG2-CD2 3.77Å; T434-L437 HydrophobicContact CG2-CD1 3.8Å; T434-L437 HydrophobicContact CG2-CG 3.78Å; L437-E439 VanDerWaalsContact C-N 3.35Å; L437-E439 PolarHBondContact O-N 3.37Å; L437-Q440 PolarHBondContact O-N 2.78Å; L437-Q440 VanDerWaalsContact O-N 3.09Å; L437-L441 PolarHBondContact O-N 3.28Å; L437-D917 HydrophobicContact CD1-CB 3.96Å; L437-D917 VanDerWaalsContact CD1-CG 3.41Å; L437-D917 WeakPolarHBondContact CD1-OD1 3.33Å; L437-Y918 VanDerWaalsContact C-OH 3.29Å; L437-Y918 HydrophobicContact CB-CE2 4.49Å; L437-Y918 PolarHBondContact O-OH 3.26Å
438	N	92.9	Very high	91.1	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	12%	0.118	C	C	.	.	G	3₁₀ helix	trans	-59.2	-43.2	-170.5	-60	-38.7	0	0	0	112.4	R408 Q411 S412 T435 Q440 L441 Y918 S937	R408-N438 PolarHBondContact O-ND2 3.48Å; Q411-N438 HydrophobicContact CB-CB 4.28Å; S412-N438 PolarHBondContact N-ND2 3.48Å; T435-N438 PolarHBondContact O-ND2 2.98Å; T435-N438 VanDerWaalsContact O-ND2 3.16Å; N438-Q440 VanDerWaalsContact C-N 3.27Å; N438-Q440 PolarHBondContact O-N 2.83Å; N438-L441 WeakPolarHBondContact O-CB 3.26Å; N438-L441 PolarHBondContact O-N 2.6Å; N438-Y918 VanDerWaalsContact CA-OH 3.26Å; N438-Y918 WeakPolarHBondContact CA-OH 3.31Å; N438-Y918 PolarHBondContact N-OH 3.43Å; N438-Y918 PolarHBondContact OD1-OH 2.85Å; N438-S937 WeakPolarHBondContact O-CB 3.15Å
439	E	92.7	Very high	91.6	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	11%	0.109	C	C	.	.	G	3₁₀ helix	trans	-72.4	-22.2	-179.4	73.5	-78.4	-178.3	0	0	113.3	T327 I329 R408 L437 L441 G442 M941	T327-E439 WeakPolarHBondContact CB-OE1 3.38Å; T327-E439 VanDerWaalsContact CG2-OE1 3.23Å; T327-E439 WeakPolarHBondContact CG2-OE1 3.28Å; T327-E439 PolarHBondContact OG1-OE1 3.13Å; I329-E439 HydrophobicContact CB-CG 4.41Å; I329-E439 HydrophobicContact CD1-CB 4.19Å; I329-E439 HydrophobicContact CD1-CG 3.57Å; I329-E439 HydrophobicContact CG1-CG 4.46Å; R408-E439 IonicContact CZ-OE1 2.95Å; R408-E439 IonicContact NE-OE1 3.35Å; R408-E439 PolarHBondContact NE-OE1 3.49Å; R408-E439 IonicContact NE-OE2 2.75Å; R408-E439 PolarHBondContact NE-OE2 3.09Å; R408-E439 IonicContact NH2-OE1 3.18Å; R408-E439 PolarHBondContact NH2-OE1 3.15Å; R408-E439 IonicContact NH2-OE2 3.53Å; L437-E439 VanDerWaalsContact C-N 3.35Å; L437-E439 PolarHBondContact O-N 3.37Å; E439-L441 VanDerWaalsContact C-N 3.3Å; E439-G442 PolarHBondContact O-N 3.43Å; E439-M941 HydrophobicContact CB-CB 4.01Å; E439-M941 HydrophobicContact CB-CG 4.31Å; E439-M941 HydrophobicContact CG-CB 4.49Å; E439-M941 HydrophobicContact CG-CG 4.26Å
440	Q	93.5	Very high	91.5	Very high	4 Å²	4	19.1 Å²	19.1	2%	0.019	9%	0.092	C	C	.	.	G	3₁₀ helix	trans	-75.6	-22.2	178.4	-169.2	166.5	1.9	0	0	111.8	T327 L437 N438 G442 Q443 V881 I900	T327-Q440 HydrophobicContact CG2-CB 4.19Å; L437-Q440 PolarHBondContact O-N 2.78Å; L437-Q440 VanDerWaalsContact O-N 3.09Å; N438-Q440 VanDerWaalsContact C-N 3.27Å; N438-Q440 PolarHBondContact O-N 2.83Å; Q440-G442 PolarHBondContact O-N 3.47Å; Q440-G442 VanDerWaalsContact O-N 3.17Å; Q440-Q443 PolarHBondContact O-N 3.13Å; Q440-V881 HydrophobicContact CG-CG1 3.68Å; Q440-V881 HydrophobicContact CG-CG2 4.37Å; Q440-I900 HydrophobicContact CB-CD1 3.97Å; Q440-I900 HydrophobicContact CG-CD1 3.98Å; Q440-I900 HydrophobicContact CG-CG1 4.45Å
441	L	95.2	Very high	91.3	Very high	0 Å²	0	19 Å²	19	0%	0	9%	0.09	C	C	.	.	G	3₁₀ helix	trans	-59.2	-21.6	170.1	-68.6	171.4	0	0	0	112.8	I415 L437 N438 E439 Q443 I444 I900 Y918 L929 L930 G934 Y1013	I415-L441 HydrophobicContact CD1-CD1 4.36Å; L437-L441 PolarHBondContact O-N 3.28Å; N438-L441 WeakPolarHBondContact O-CB 3.26Å; N438-L441 PolarHBondContact O-N 2.6Å; E439-L441 VanDerWaalsContact C-N 3.3Å; L441-Q443 VanDerWaalsContact C-N 3.31Å; L441-I444 HydrophobicContact CD2-CD1 4.18Å; L441-I900 HydrophobicContact CD2-CD1 3.8Å; L441-I900 HydrophobicContact CD2-CG2 3.96Å; L441-I900 HydrophobicContact CG-CD1 4.11Å; L441-Y918 HydrophobicContact CD1-CE1 3.88Å; L441-Y918 HydrophobicContact CD1-CE2 4.01Å; L441-Y918 WeakPolarHBondContact CD1-OH 3.46Å; L441-Y918 HydrophobicContact CD2-CD2 4.19Å; L441-Y918 HydrophobicContact CD2-CE2 3.76Å; L441-Y918 HydrophobicContact CG-CE2 4.01Å; L441-L929 HydrophobicContact CD1-CD1 3.79Å; L441-L929 HydrophobicContact CD1-CG 4.09Å; L441-L929 HydrophobicContact CD2-CD2 4.26Å; L441-L929 HydrophobicContact CD2-CG 4.33Å; L441-L930 HydrophobicContact CB-CD2 4.26Å; L441-L930 HydrophobicContact CD2-CD2 3.71Å; L441-G934 VanDerWaalsContact CB-CA 3.46Å; L441-Y1013 PolarHBondContact O-OH 3.06Å
442	G	94.2	Very high	90.8	Very high	1 Å²	1	14.8 Å²	14.8	1%	0.01	7%	0.074	C	C	.	.	G	3₁₀ helix	trans	-84.3	1	175.7	0	0	0	0	0	114.7	E439 Q440 G934 Y1013 G1016	E439-G442 PolarHBondContact O-N 3.43Å; Q440-G442 PolarHBondContact O-N 3.47Å; Q440-G442 VanDerWaalsContact O-N 3.17Å; G442-G934 VanDerWaalsContact CA-C 3.48Å; G442-G934 VanDerWaalsContact CA-O 3.3Å; G442-G934 WeakPolarHBondContact CA-O 3.39Å; G442-G934 PolarHBondContact N-O 3.42Å; G442-Y1013 VanDerWaalsContact C-OH 3.22Å; G442-G1016 CarbonylContact O-C 3.59Å; G442-G1016 VanDerWaalsContact O-CA 3.3Å; G442-G1016 WeakPolarHBondContact O-CA 3.32Å
443	Q	94.1	Very high	90.3	Very high	17 Å²	17	14.6 Å²	14.6	8%	0.079	7%	0.073	C	C	.	.	S	Bend	trans	-124.7	6.5	-171.8	-52.7	-166.5	-75.1	0	0	114.1	Q440 L441 V881 Y938 Y1013 G1016	Q440-Q443 PolarHBondContact O-N 3.13Å; L441-Q443 VanDerWaalsContact C-N 3.31Å; Q443-V881 HydrophobicContact CB-CG2 4.09Å; Q443-V881 WeakPolarHBondContact O-CB 3.18Å; Q443-Y938 HydrophobicContact CG-CD2 3.66Å; Q443-Y938 HydrophobicContact CG-CE2 3.76Å; Q443-Y938 HydrophobicContact CG-CG 4.34Å; Q443-Y1013 PolarHBondContact N-OH 2.9Å; Q443-G1016 PolarHBondContact NE2-O 3.37Å
444	I	95.3	Very high	90.4	Very high	0 Å²	0	10.3 Å²	10.3	0%	0	6%	0.056	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67	135.3	-174.8	-65.3	155.5	0	0	0	110	L441 I447 I723 V881 L883 I900 L930 Y1013 Q1017	L441-I444 HydrophobicContact CD2-CD1 4.18Å; I444-I447 HydrophobicContact CG2-CG1 4.06Å; I444-I723 HydrophobicContact CG2-CG2 4.43Å; I444-V881 HydrophobicContact CG1-CG1 3.98Å; I444-L883 HydrophobicContact CD1-CB 3.97Å; I444-L883 HydrophobicContact CD1-CD1 3.43Å; I444-L883 VanDerWaalsContact CD1-CD1 3.43Å; I444-L883 HydrophobicContact CD1-CG 4.34Å; I444-L883 HydrophobicContact CG1-CB 4.19Å; I444-L883 HydrophobicContact CG1-CD1 4.5Å; I444-L883 HydrophobicContact CG2-CB 3.81Å; I444-I900 HydrophobicContact CD1-CD1 4.14Å; I444-I900 HydrophobicContact CG1-CD1 4.26Å; I444-L930 HydrophobicContact CD1-CD1 4Å; I444-L930 HydrophobicContact CD1-CD2 3.37Å; I444-L930 HydrophobicContact CD1-CG 4.3Å; I444-Y1013 WeakPolarHBondContact CB-OH 3.46Å; I444-Y1013 PolarHBondContact N-OH 3.19Å; I444-Y1013 WeakPolarHBondContact O-CE1 3.14Å; I444-Q1017 WeakPolarHBondContact O-CG 3.36Å; I444-Q1017 PolarHBondContact O-NE2 3.48Å
445	Q	93.8	Very high	90.7	Very high	55 Å²	55	8.6 Å²	8.6	26%	0.257	5%	0.046	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	-30.6	177	-65.8	176.1	13.2	0	0	112.3	K724 A880 V881 Q1017	Q445-K724 PolarHBondContact O-N 3.27Å; Q445-A880 HydrophobicContact CB-CB 4.21Å; Q445-V881 PolarHBondContact N-O 3.31Å; Q445-Q1017 HydrophobicContact CG-CB 4.08Å; Q445-Q1017 HydrophobicContact CG-CG 4.08Å; Q445-Q1017 PolarHBondContact NE2-O 2.79Å; Q445-Q1017 VanDerWaalsContact NE2-O 3.11Å
446	Y	95.2	Very high	90.9	Very high	19 Å²	19	7.2 Å²	7.2	8%	0.075	4%	0.038	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	129.7	-178.6	-66.7	-94.2	0	0	0	110.3	K724 W726 C852 V874 A880 L883	Y446-K724 CarbonylContact C-O 3.6Å; Y446-K724 WeakPolarHBondContact CA-O 3.44Å; Y446-K724 HydrophobicContact CD1-CB 3.88Å; Y446-K724 HydrophobicContact CE1-CB 3.96Å; Y446-K724 HydrophobicContact CE1-CD 3.82Å; Y446-K724 HydrophobicContact CE1-CG 4.37Å; Y446-W726 HydrophobicContact CD1-CZ2 4.49Å; Y446-W726 AromaticContact CD1-NE1 3.84Å; Y446-W726 HydrophobicContact CE1-CZ2 4.28Å; Y446-W726 AromaticContact CE1-NE1 4Å; Y446-C852 WeakPolarHBondContact OH-CB 3.47Å; Y446-C852 PolarHBondContact OH-SG 3.37Å; Y446-V874 HydrophobicContact CD1-CG1 4.43Å; Y446-V874 HydrophobicContact CD2-CG1 4.3Å; Y446-V874 HydrophobicContact CG-CG1 4.22Å; Y446-A880 HydrophobicContact CD2-CB 3.6Å; Y446-A880 HydrophobicContact CE2-CB 3.67Å; Y446-L883 PolarHBondContact O-N 3.14Å
447	I	96.4	Very high	90.8	Very high	0 Å²	0	8.3 Å²	8.3	0%	0	4%	0.042	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	125.8	170.8	-66	170.2	0	0	0	108.1	I444 L718 I723 K724 I725 W726 L883 I885 L926 L930	I444-I447 HydrophobicContact CG2-CG1 4.06Å; I447-L718 HydrophobicContact CD1-CD1 3.9Å; I447-I723 HydrophobicContact CB-CG2 4.46Å; I447-I723 HydrophobicContact CD1-CG2 3.49Å; I447-I723 VanDerWaalsContact CD1-CG2 3.49Å; I447-I723 HydrophobicContact CG1-CG2 3.63Å; I447-K724 PolarHBondContact N-O 2.94Å; I447-I725 HydrophobicContact CB-CG1 4.28Å; I447-I725 CarbonylContact O-C 3.31Å; I447-I725 WeakPolarHBondContact O-CA 3.49Å; I447-W726 PolarHBondContact O-N 3.12Å; I447-L883 CarbonylContact C-O 2.74Å; I447-L883 VanDerWaalsContact CA-O 3.32Å; I447-L883 WeakPolarHBondContact CA-O 3.41Å; I447-L883 HydrophobicContact CG1-CB 4.28Å; I447-L883 HydrophobicContact CG1-CD2 4.18Å; I447-L883 HydrophobicContact CG2-CD2 3.99Å; I447-I885 HydrophobicContact CG2-CG2 4.11Å; I447-L926 HydrophobicContact CD1-CD2 4.1Å; I447-L926 HydrophobicContact CG2-CD2 4.49Å; I447-L930 HydrophobicContact CD1-CD1 3.85Å
448	F	96.5	Very high	90.1	Very high	0 Å²	0	9.9 Å²	9.9	0%	0	5%	0.05	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	112.7	169.7	-56.5	-83.9	0	0	0	108.1	W726 L728 V870 V871 V874 T882 L883 S884 I885 M894	F448-W726 CarbonylContact C-O 3.51Å; F448-W726 WeakPolarHBondContact CA-O 3.44Å; F448-W726 HydrophobicContact CD1-CB 3.73Å; F448-W726 HydrophobicContact CD1-CD2 4.42Å; F448-W726 HydrophobicContact CD1-CE3 4.25Å; F448-W726 HydrophobicContact CD1-CG 4.28Å; F448-W726 HydrophobicContact CE1-CB 4.03Å; F448-W726 AromaticContact CE1-CD2 3.82Å; F448-W726 HydrophobicContact CE1-CD2 3.82Å; F448-W726 AromaticContact CE1-CE3 3.56Å; F448-W726 HydrophobicContact CE1-CE3 3.56Å; F448-W726 HydrophobicContact CE1-CG 4.07Å; F448-W726 HydrophobicContact CE1-CZ3 4.25Å; F448-L728 HydrophobicContact CB-CD1 4.09Å; F448-L728 HydrophobicContact CD1-CD1 3.89Å; F448-L728 HydrophobicContact CD1-CG 4.32Å; F448-L728 HydrophobicContact CG-CD1 4.34Å; F448-V870 HydrophobicContact CE1-CG1 4.17Å; F448-V871 HydrophobicContact CB-CG2 4.13Å; F448-V871 HydrophobicContact CD1-CG2 4.15Å; F448-V871 HydrophobicContact CD2-CB 4.44Å; F448-V871 HydrophobicContact CD2-CG1 4.25Å; F448-V871 HydrophobicContact CD2-CG2 3.71Å; F448-V871 HydrophobicContact CE2-CB 4.46Å; F448-V871 HydrophobicContact CE2-CG1 4.22Å; F448-V871 HydrophobicContact CE2-CG2 4.15Å; F448-V871 HydrophobicContact CG-CG2 3.71Å; F448-V874 HydrophobicContact CE1-CG2 4.15Å; F448-V874 HydrophobicContact CZ-CB 3.81Å; F448-V874 HydrophobicContact CZ-CG1 3.93Å; F448-V874 HydrophobicContact CZ-CG2 3.81Å; F448-T882 HydrophobicContact CE2-CG2 3.71Å; F448-T882 HydrophobicContact CZ-CG2 4.42Å; F448-L883 WeakPolarHBondContact CD2-O 3.16Å; F448-L883 PolarHBondContact N-O 2.8Å; F448-S884 CarbonylContact O-C 3.56Å; F448-S884 VanDerWaalsContact O-CA 3.28Å; F448-S884 WeakPolarHBondContact O-CA 3.28Å; F448-I885 PolarHBondContact O-N 3.32Å; F448-M894 HydrophobicContact CB-SD 3.98Å
449	S	94.6	Very high	89.4	Confident	0 Å²	0	13.4 Å²	13.4	0%	0	7%	0.068	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	138.2	-178.6	-168.7	0	0	0	0	110.2	T454 W726 V727 L728	S449-T454 VanDerWaalsContact OG-CG2 3.27Å; S449-T454 WeakPolarHBondContact OG-CG2 3.3Å; S449-W726 PolarHBondContact N-O 3.38Å; S449-V727 CarbonylContact O-C 3.56Å; S449-V727 WeakPolarHBondContact O-CA 3.31Å; S449-L728 PolarHBondContact O-N 3.15Å
450	D	90.6	Very high	89.1	Confident	9 Å²	9	14.3 Å²	14.3	5%	0.048	7%	0.072	C	C	.	.			trans	-72.4	159.9	157.2	-166	53.9	0	0	0	111	T452 T454 K867 I885 D891	D450-T452 PolarHBondContact OD2-N 2.96Å; D450-T454 WeakPolarHBondContact O-CB 3.28Å; D450-T454 WeakPolarHBondContact O-CG2 3.49Å; D450-K867 IonicContact OD1-NZ 2.7Å; D450-K867 PolarHBondContact OD1-NZ 3.36Å; D450-I885 PolarHBondContact N-O 3.39Å; D450-D891 VanDerWaalsContact CB-OD2 3.31Å; D450-D891 WeakPolarHBondContact CB-OD2 3.21Å
451	K	87.4	Confident	88.8	Confident	0 Å²	0	16.8 Å²	16.8	0%	0	8%	0.084	C	C	.	.	S	Bend	trans	-91.1	-53.3	178.3	-175.4	-118.7	65.6	166.7	0	111.3	L455 T456 D705 V727 T729 D731 I739	K451-L455 PolarHBondContact O-N 2.86Å; K451-L455 VanDerWaalsContact O-N 3.12Å; K451-T456 PolarHBondContact O-N 3.06Å; K451-T456 VanDerWaalsContact O-N 3.16Å; K451-D705 IonicContact NZ-OD2 3.75Å; K451-D705 PolarHBondContact NZ-OD2 3.45Å; K451-D705 VanDerWaalsContact NZ-OD2 3.11Å; K451-V727 HydrophobicContact CB-CG1 4.04Å; K451-T729 HydrophobicContact CB-CG2 4.46Å; K451-D731 VanDerWaalsContact CD-OD2 3.25Å; K451-D731 WeakPolarHBondContact CD-OD2 3.38Å; K451-D731 WeakPolarHBondContact CE-OD2 3.3Å; K451-D731 IonicContact NZ-OD2 2.67Å; K451-D731 PolarHBondContact NZ-OD2 3.32Å; K451-I739 HydrophobicContact CD-CB 4.5Å; K451-I739 HydrophobicContact CD-CG1 4.15Å; K451-I739 HydrophobicContact CD-CG2 4.44Å; K451-I739 HydrophobicContact CG-CB 4.29Å; K451-I739 HydrophobicContact CG-CG1 4.43Å; K451-I739 HydrophobicContact CG-CG2 3.8Å
452	T	80.9	Confident	88.6	Confident	23 Å²	23	16.9 Å²	16.9	14%	0.141	8%	0.084	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.3	135.7	-171.2	-55.1	0	0	0	0	108.1	D450 T454 N458 D887 E908	D450-T452 PolarHBondContact OD2-N 2.96Å; T452-T454 PolarHBondContact O-N 2.85Å; T452-N458 HydrophobicContact CG2-CB 4.29Å; T452-D887 VanDerWaalsContact O-OD1 3.07Å; T452-E908 WeakPolarHBondContact CG2-OE1 3.5Å
453	G	78.4	Confident	88.3	Confident	4 Å²	4	19.7 Å²	19.7	4%	0.041	10%	0.096	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.9	-13.8	176.1	0	0	0	0	0	115.8	T456 Q708 D887	G453-T456 CarbonylContact C-O 3.59Å; G453-T456 VanDerWaalsContact C-O 3.23Å; G453-T456 VanDerWaalsContact CA-O 3.24Å; G453-T456 WeakPolarHBondContact CA-O 3.21Å; G453-T456 PolarHBondContact N-O 2.93Å; G453-Q708 PolarHBondContact O-NE2 2.96Å; G453-D887 VanDerWaalsContact C-CG 3.45Å; G453-D887 WeakPolarHBondContact CA-OD2 3.21Å
454	T	86.9	Confident	88.2	Confident	0 Å²	0	21.2 Å²	21.2	0%	0	10%	0.103	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.4	-62	175	-66.1	0	0	0	0	112.3	S449 D450 T452 Q708 I885 G886 D887 I904 F923	S449-T454 VanDerWaalsContact OG-CG2 3.27Å; S449-T454 WeakPolarHBondContact OG-CG2 3.3Å; D450-T454 WeakPolarHBondContact O-CB 3.28Å; D450-T454 WeakPolarHBondContact O-CG2 3.49Å; T452-T454 PolarHBondContact O-N 2.85Å; T454-Q708 PolarHBondContact O-NE2 3.42Å; T454-Q708 VanDerWaalsContact O-NE2 3.08Å; T454-I885 HydrophobicContact CG2-CG1 4.17Å; T454-I885 HydrophobicContact CG2-CG2 4.15Å; T454-G886 VanDerWaalsContact OG1-CA 3.31Å; T454-G886 WeakPolarHBondContact OG1-CA 3.49Å; T454-D887 PolarHBondContact OG1-N 3.47Å; T454-I904 HydrophobicContact CG2-CD1 3.71Å; T454-F923 HydrophobicContact CG2-CD2 3.88Å; T454-F923 HydrophobicContact CG2-CE2 4.31Å; T454-F923 WeakPolarHBondContact O-CB 3.49Å
455	L	89.9	Confident	88.2	Confident	2 Å²	2	21.2 Å²	21.2	1%	0.01	10%	0.103	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-33.2	174.8	-63.2	177.5	0	0	0	111.1	K451 L707 Q708 V711 I715 V727 F923	K451-L455 PolarHBondContact O-N 2.86Å; K451-L455 VanDerWaalsContact O-N 3.12Å; L455-L707 WeakPolarHBondContact O-CA 3.5Å; L455-Q708 PolarHBondContact O-N 3.06Å; L455-V711 HydrophobicContact CB-CG1 4.48Å; L455-V711 HydrophobicContact CD2-CG1 3.81Å; L455-I715 HydrophobicContact CD2-CD1 4.11Å; L455-V727 HydrophobicContact CD1-CG1 4.38Å; L455-V727 HydrophobicContact CD1-CG2 3.95Å; L455-F923 HydrophobicContact CD2-CD1 4.38Å; L455-F923 HydrophobicContact CD2-CD2 3.96Å; L455-F923 HydrophobicContact CD2-CE1 4.12Å; L455-F923 HydrophobicContact CD2-CE2 3.66Å; L455-F923 HydrophobicContact CD2-CG 4.31Å; L455-F923 HydrophobicContact CD2-CZ 3.75Å
456	T	86.8	Confident	88.2	Confident	0 Å²	0	18.6 Å²	18.6	0%	0	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	156.7	175.8	78	0	0	0	0	111.4	K451 G453 N458 D705 K706 L707 I739	K451-T456 PolarHBondContact O-N 3.06Å; K451-T456 VanDerWaalsContact O-N 3.16Å; G453-T456 CarbonylContact C-O 3.59Å; G453-T456 VanDerWaalsContact C-O 3.23Å; G453-T456 VanDerWaalsContact CA-O 3.24Å; G453-T456 WeakPolarHBondContact CA-O 3.21Å; G453-T456 PolarHBondContact N-O 2.93Å; T456-N458 PolarHBondContact O-N 2.98Å; T456-N458 PolarHBondContact OG1-N 3.4Å; T456-D705 WeakPolarHBondContact CB-OD1 3.45Å; T456-D705 WeakPolarHBondContact CG2-OD1 3.36Å; T456-D705 PolarHBondContact OG1-OD1 3.1Å; T456-D705 VanDerWaalsContact OG1-OD1 3.08Å; T456-K706 CarbonylContact C-O 3.56Å; T456-K706 WeakPolarHBondContact CA-O 3.44Å; T456-K706 WeakPolarHBondContact CB-O 3.21Å; T456-L707 HydrophobicContact CG2-CD2 4.12Å; T456-I739 HydrophobicContact CG2-CD1 3.92Å
457	Q	81.1	Confident	88.1	Confident	41 Å²	41	17.8 Å²	17.8	19%	0.192	9%	0.087	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	-4.3	174.3	-62.1	-178.4	11.5	0	0	111.7	I459 K706 L707 Q708 D709	Q457-I459 HydrophobicContact CB-CB 4.29Å; Q457-I459 HydrophobicContact CB-CD1 4.01Å; Q457-I459 HydrophobicContact CB-CG1 3.99Å; Q457-I459 PolarHBondContact O-N 3.4Å; Q457-K706 PolarHBondContact N-O 3.27Å; Q457-L707 PolarHBondContact NE2-O 2.78Å; Q457-Q708 HydrophobicContact CG-CB 4.28Å; Q457-Q708 HydrophobicContact CG-CG 3.88Å; Q457-D709 PolarHBondContact NE2-OD1 3.03Å
458	N	75.1	Confident	87.7	Confident	33 Å²	33	19.2 Å²	19.2	18%	0.176	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	51.1	34.9	-166.4	-161	12.6	0	0	0	112.3	T452 T456 E908	T452-N458 HydrophobicContact CG2-CB 4.29Å; T456-N458 PolarHBondContact O-N 2.98Å; T456-N458 PolarHBondContact OG1-N 3.4Å; N458-E908 PolarHBondContact ND2-OE1 2.98Å
459	I	79.9	Confident	87.1	Confident	74 Å²	74	20.2 Å²	20.2	38%	0.379	11%	0.11	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	107.6	175.3	-61.6	174.5	0	0	0	107.3	Q457 Q461 K706	Q457-I459 HydrophobicContact CB-CB 4.29Å; Q457-I459 HydrophobicContact CB-CD1 4.01Å; Q457-I459 HydrophobicContact CB-CG1 3.99Å; Q457-I459 PolarHBondContact O-N 3.4Å; I459-Q461 HydrophobicContact CG2-CG 4.24Å; I459-K706 PolarHBondContact O-N 2.96Å
460	M	84.4	Confident	86.8	Confident	18 Å²	18	25.9 Å²	25.9	9%	0.089	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	126.6	178.7	-60.4	-59.4	173.1	0	0	109.8	P550 D551 A554 I703 E704 D705	M460-P550 HydrophobicContact CB-CB 4.33Å; M460-P550 HydrophobicContact CE-CG 4.14Å; M460-P550 HydrophobicContact CG-CB 3.67Å; M460-P550 HydrophobicContact CG-CG 3.86Å; M460-D551 WeakPolarHBondContact CE-OD1 3.33Å; M460-D551 VanDerWaalsContact CG-OD1 3.29Å; M460-D551 WeakPolarHBondContact CG-OD1 3.49Å; M460-A554 HydrophobicContact CB-CB 3.86Å; M460-A554 VanDerWaalsContact O-CB 3.3Å; M460-A554 WeakPolarHBondContact O-CB 3.3Å; M460-I703 HydrophobicContact CB-CG2 3.8Å; M460-I703 HydrophobicContact SD-CG2 4.45Å; M460-E704 WeakPolarHBondContact CA-O 3.49Å; M460-D705 HydrophobicContact CE-CB 4.11Å; M460-D705 HydrophobicContact SD-CB 3.72Å
461	Q	87.3	Confident	86.8	Confident	57 Å²	57	28.4 Å²	28.4	27%	0.266	15%	0.15	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	126.7	178.8	-66	-168	-4.3	0	0	111.2	I459 K463 I703 E704	I459-Q461 HydrophobicContact CG2-CG 4.24Å; Q461-K463 PolarHBondContact O-N 3.4Å; Q461-I703 CarbonylContact O-C 3.58Å; Q461-I703 WeakPolarHBondContact O-CA 3.3Å; Q461-E704 PolarHBondContact N-O 3.45Å; Q461-E704 PolarHBondContact O-N 3.16Å
462	F	91.3	Very high	87	Confident	2 Å²	2	29 Å²	29	1%	0.009	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	118	169	-178.1	-88.5	0	0	0	109.8	C465 F501 F503 L555 A558 F562 T701	F462-C465 HydrophobicContact CE1-CB 4.49Å; F462-C465 HydrophobicContact CE2-CB 4.26Å; F462-C465 HydrophobicContact CZ-CB 3.63Å; F462-F501 HydrophobicContact CB-CE2 4.17Å; F462-F501 HydrophobicContact CD1-CZ 4.24Å; F462-F503 HydrophobicContact CD1-CD2 4.4Å; F462-F503 HydrophobicContact CD1-CE2 4.11Å; F462-F503 AromaticContact CE1-CE2 3.87Å; F462-F503 HydrophobicContact CE1-CE2 3.87Å; F462-F503 HydrophobicContact CE1-CZ 4.48Å; F462-L555 HydrophobicContact CD2-CD2 3.96Å; F462-L555 HydrophobicContact CE2-CD2 4.31Å; F462-A558 HydrophobicContact CB-CB 3.75Å; F462-A558 HydrophobicContact CD1-CB 3.91Å; F462-A558 HydrophobicContact CD2-CB 4Å; F462-A558 HydrophobicContact CE1-CB 4.47Å; F462-A558 HydrophobicContact CG-CB 3.62Å; F462-F562 HydrophobicContact CE1-CE2 4.34Å; F462-T701 HydrophobicContact CE2-CG2 3.92Å
463	K	88.9	Confident	87	Confident	60 Å²	60	28.4 Å²	28.4	26%	0.261	15%	0.151	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	-49.9	-176.3	-72.9	-57.2	-164.1	-170.2	0	113.5	Q461 F503 L648 A702 E704	Q461-K463 PolarHBondContact O-N 3.4Å; K463-F503 WeakPolarHBondContact O-CE2 3.35Å; K463-L648 HydrophobicContact CB-CD1 4.47Å; K463-L648 HydrophobicContact CB-CD2 4.41Å; K463-L648 HydrophobicContact CG-CD2 4.38Å; K463-A702 PolarHBondContact N-O 2.86Å; K463-E704 WeakPolarHBondContact CE-OE2 3.34Å; K463-E704 HydrophobicContact CG-CB 3.66Å; K463-E704 IonicContact NZ-OE2 2.74Å; K463-E704 PolarHBondContact NZ-OE2 3.19Å
464	K	92.2	Very high	87.1	Confident	49 Å²	49	29.5 Å²	29.5	21%	0.213	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	160.9	-173.4	-58.2	-173.8	178.9	-175.6	0	110.1	Y472 F643 E646 L648 A702	K464-Y472 WeakPolarHBondContact CA-O 3.45Å; K464-Y472 WeakPolarHBondContact CB-O 3.25Å; K464-F643 HydrophobicContact CB-CD1 4.22Å; K464-F643 HydrophobicContact CB-CE1 3.73Å; K464-F643 HydrophobicContact CB-CZ 3.96Å; K464-F643 HydrophobicContact CD-CD1 4Å; K464-F643 HydrophobicContact CD-CE1 3.76Å; K464-F643 HydrophobicContact CG-CE1 4.38Å; K464-E646 VanDerWaalsContact CE-OE2 3.23Å; K464-E646 WeakPolarHBondContact CE-OE2 3.23Å; K464-E646 IonicContact NZ-OE1 3.19Å; K464-E646 PolarHBondContact NZ-OE1 2.9Å; K464-E646 IonicContact NZ-OE2 3.71Å; K464-E646 PolarHBondContact NZ-OE2 3.47Å; K464-L648 HydrophobicContact CB-CD1 4.44Å; K464-L648 HydrophobicContact CD-CD1 4.08Å; K464-L648 HydrophobicContact CG-CD1 4.24Å; K464-A702 HydrophobicContact CB-CB 3.99Å; K464-A702 PolarHBondContact N-O 2.55Å; K464-A702 WeakPolarHBondContact O-CA 3.02Å; K464-A702 WeakPolarHBondContact O-CB 3.43Å; K464-A702 PolarHBondContact O-N 3.05Å
465	C	93.9	Very high	86.4	Confident	0 Å²	0	31.8 Å²	31.8	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152	159.9	169.5	57.2	0	0	0	0	110.2	F462 S471 Y472 F523 A700	F462-C465 HydrophobicContact CE1-CB 4.49Å; F462-C465 HydrophobicContact CE2-CB 4.26Å; F462-C465 HydrophobicContact CZ-CB 3.63Å; C465-S471 CarbonylContact O-C 3.56Å; C465-S471 WeakPolarHBondContact O-CA 3.45Å; C465-Y472 PolarHBondContact N-O 2.87Å; C465-Y472 VanDerWaalsContact N-O 3.16Å; C465-Y472 PolarHBondContact O-N 3.4Å; C465-F523 HydrophobicContact CB-CE1 4.17Å; C465-F523 HydrophobicContact CB-CZ 3.7Å; C465-A700 CarbonylContact C-O 3.51Å; C465-A700 VanDerWaalsContact CA-O 3.23Å; C465-A700 WeakPolarHBondContact CA-O 3.26Å; C465-A700 WeakPolarHBondContact CB-O 3.11Å
466	T	94.3	Very high	85.5	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	129.7	167	-178.9	0	0	0	0	108.6	R470 T636 A639 F643 G699 A700	T466-R470 CarbonylContact C-O 3.57Å; T466-R470 VanDerWaalsContact CA-O 3.26Å; T466-R470 WeakPolarHBondContact CA-O 3.4Å; T466-R470 PolarHBondContact OG1-O 3.3Å; T466-T636 HydrophobicContact CG2-CG2 3.71Å; T466-A639 HydrophobicContact CG2-CB 3.99Å; T466-F643 HydrophobicContact CG2-CE2 4.18Å; T466-G699 CarbonylContact O-C 3.45Å; T466-G699 WeakPolarHBondContact O-CA 3.46Å; T466-A700 HydrophobicContact CG2-CB 3.76Å; T466-A700 PolarHBondContact N-O 2.96Å; T466-A700 PolarHBondContact O-N 2.89Å
467	I	93.9	Very high	84.5	Confident	1 Å²	1	34.5 Å²	34.5	1%	0.005	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	127.4	-178.1	-48.3	178.4	0	0	0	107.2	G469 R470 Y472 L508 D519 A520 F523 F524	I467-G469 PolarHBondContact O-N 3.21Å; I467-G469 VanDerWaalsContact O-N 3.11Å; I467-R470 PolarHBondContact N-O 3.21Å; I467-R470 PolarHBondContact O-N 3.36Å; I467-Y472 HydrophobicContact CB-CD2 4.4Å; I467-Y472 HydrophobicContact CB-CE2 3.91Å; I467-Y472 HydrophobicContact CD1-CD2 4.36Å; I467-Y472 HydrophobicContact CD1-CE2 4.32Å; I467-Y472 HydrophobicContact CG1-CD2 4.15Å; I467-Y472 HydrophobicContact CG1-CE2 4.12Å; I467-L508 HydrophobicContact CD1-CD1 4.04Å; I467-D519 HydrophobicContact CG2-CB 4.23Å; I467-A520 HydrophobicContact CD1-CB 4.4Å; I467-A520 HydrophobicContact CG2-CB 4.49Å; I467-F523 HydrophobicContact CB-CD2 4.49Å; I467-F523 HydrophobicContact CD1-CB 4.18Å; I467-F523 HydrophobicContact CD1-CD1 3.78Å; I467-F523 HydrophobicContact CD1-CD2 4.19Å; I467-F523 HydrophobicContact CD1-CE1 4.15Å; I467-F523 HydrophobicContact CD1-CG 3.81Å; I467-F523 HydrophobicContact CD1-CZ 4.49Å; I467-F523 HydrophobicContact CG1-CB 4.49Å; I467-F523 HydrophobicContact CG1-CD1 4.21Å; I467-F523 HydrophobicContact CG1-CD2 3.77Å; I467-F523 HydrophobicContact CG1-CE1 4.34Å; I467-F523 HydrophobicContact CG1-CE2 3.9Å; I467-F523 HydrophobicContact CG1-CG 3.92Å; I467-F523 HydrophobicContact CG1-CZ 4.18Å; I467-F523 HydrophobicContact CG2-CB 4.18Å; I467-F523 HydrophobicContact CG2-CD2 4.29Å; I467-F523 HydrophobicContact CG2-CG 4.41Å; I467-F524 HydrophobicContact CD1-CE2 4.17Å
468	A	88.2	Confident	83.6	Confident	30 Å²	30	36.2 Å²	36.2	25%	0.248	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	48.6	38.4	-177.2	0	0	0	0	0	113.4	R470 D519 I698	A468-R470 PolarHBondContact O-N 2.75Å; A468-D519 HydrophobicContact CB-CB 4.07Å; A468-I698 PolarHBondContact N-O 3.39Å
469	G	83.1	Confident	83	Confident	22 Å²	22	43 Å²	43	23%	0.227	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.6	5.8	178.6	0	0	0	0	0	116.2	I467 T635	I467-G469 PolarHBondContact O-N 3.21Å; I467-G469 VanDerWaalsContact O-N 3.11Å; G469-T635 WeakPolarHBondContact CA-OG1 3.37Å
470	R	89.5	Confident	82.1	Confident	119 Å²	119	40.7 Å²	40.7	45%	0.449	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	127.6	174.5	-174.7	171.1	-178.1	172.1	0.3	111	T466 I467 A468 Y472	T466-R470 CarbonylContact C-O 3.57Å; T466-R470 VanDerWaalsContact CA-O 3.26Å; T466-R470 WeakPolarHBondContact CA-O 3.4Å; T466-R470 PolarHBondContact OG1-O 3.3Å; I467-R470 PolarHBondContact N-O 3.21Å; I467-R470 PolarHBondContact O-N 3.36Å; A468-R470 PolarHBondContact O-N 2.75Å; R470-Y472 HydrophobicContact CB-CE2 4.05Å; R470-Y472 HydrophobicContact CG-CE1 4.41Å; R470-Y472 HydrophobicContact CG-CE2 4.15Å; R470-Y472 WeakPolarHBondContact O-CD2 3.32Å; R470-Y472 WeakPolarHBondContact O-CE2 3.49Å
471	S	90.4	Very high	81.2	Confident	62 Å²	62	42.5 Å²	42.5	43%	0.434	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	138.9	176.8	-56.3	0	0	0	0	112.2	C465 A639	C465-S471 CarbonylContact O-C 3.56Å; C465-S471 WeakPolarHBondContact O-CA 3.45Å; S471-A639 WeakPolarHBondContact OG-CB 3.33Å
472	Y	90.3	Very high	80.3	Confident	11 Å²	11	45 Å²	45	4%	0.043	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	157.9	-179.7	-59.6	-85.2	0	0	0	110.6	K464 C465 I467 R470 D505 F507 L508	K464-Y472 WeakPolarHBondContact CA-O 3.45Å; K464-Y472 WeakPolarHBondContact CB-O 3.25Å; C465-Y472 PolarHBondContact N-O 2.87Å; C465-Y472 VanDerWaalsContact N-O 3.16Å; C465-Y472 PolarHBondContact O-N 3.4Å; I467-Y472 HydrophobicContact CB-CD2 4.4Å; I467-Y472 HydrophobicContact CB-CE2 3.91Å; I467-Y472 HydrophobicContact CD1-CD2 4.36Å; I467-Y472 HydrophobicContact CD1-CE2 4.32Å; I467-Y472 HydrophobicContact CG1-CD2 4.15Å; I467-Y472 HydrophobicContact CG1-CE2 4.12Å; R470-Y472 HydrophobicContact CB-CE2 4.05Å; R470-Y472 HydrophobicContact CG-CE1 4.41Å; R470-Y472 HydrophobicContact CG-CE2 4.15Å; R470-Y472 WeakPolarHBondContact O-CD2 3.32Å; R470-Y472 WeakPolarHBondContact O-CE2 3.49Å; Y472-D505 VanDerWaalsContact CA-OD2 3.28Å; Y472-D505 WeakPolarHBondContact CA-OD2 3.24Å; Y472-D505 WeakPolarHBondContact CB-OD2 3.37Å; Y472-F507 HydrophobicContact CD1-CD1 4.4Å; Y472-F507 AromaticContact CE1-CD1 3.81Å; Y472-F507 HydrophobicContact CE1-CD1 3.81Å; Y472-F507 HydrophobicContact CE1-CE1 4.03Å; Y472-L508 HydrophobicContact CD1-CB 3.74Å; Y472-L508 HydrophobicContact CD1-CD1 3.95Å; Y472-L508 HydrophobicContact CD1-CG 4.27Å; Y472-L508 HydrophobicContact CD2-CD1 4.24Å; Y472-L508 HydrophobicContact CE1-CB 4.26Å; Y472-L508 HydrophobicContact CE1-CD1 3.98Å; Y472-L508 HydrophobicContact CE2-CD1 4.31Å; Y472-L508 HydrophobicContact CG-CB 4.25Å; Y472-L508 HydrophobicContact CG-CD1 4.06Å; Y472-L508 HydrophobicContact CG-CD2 4.21Å; Y472-L508 HydrophobicContact CG-CG 4.41Å
473	G	82.3	Confident	79.1	Confident	12 Å²	12	48.7 Å²	48.7	12%	0.124	30%	0.296	C	S	.	.			trans	110.2	7.2	178.6	0	0	0	0	0	114.8	D505	G473-D505 PolarHBondContact N-OD2 3.15Å
474	G	80.4	Confident	77.7	Confident	27 Å²	27	54.2 Å²	54.2	28%	0.278	33%	0.329	S	S	.	.	S	Bend	trans	-88.8	165.7	166.9	0	0	0	0	0	112.4	T476 D505	G474-T476 PolarHBondContact O-N 3.47Å; G474-D505 WeakPolarHBondContact O-CA 3.49Å; G474-D505 WeakPolarHBondContact O-CB 3.31Å
475	P	71.4	Confident	76.3	Confident	47 Å²	47	59.8 Å²	59.8	31%	0.305	35%	0.353	S	S	.	.	S	Bend	trans	-70.1	100.4	175.7	29	-33.1	0	0	0	110.8	S482 L483 V504	P475-S482 CarbonylContact O-C 3.53Å; P475-S482 WeakPolarHBondContact O-CA 2.91Å; P475-L483 HydrophobicContact CB-CB 4.46Å; P475-L483 WeakPolarHBondContact CB-O 3.42Å; P475-L483 WeakPolarHBondContact CG-O 3.44Å; P475-L483 PolarHBondContact O-N 3.42Å; P475-V504 HydrophobicContact CB-CG1 3.87Å
476	T	70.6	Confident	75.2	Confident	21 Å²	21	66 Å²	66	13%	0.129	39%	0.385	C	S	.	.	B	Isolated β-bridge	trans	-126.6	147.3	-178.7	52.4	0	0	0	0	111.3	G474 A481 D505 H506	G474-T476 PolarHBondContact O-N 3.47Å; T476-A481 CarbonylContact C-O 3.57Å; T476-A481 VanDerWaalsContact CA-O 3.3Å; T476-A481 WeakPolarHBondContact CA-O 3.13Å; T476-D505 WeakPolarHBondContact OG1-CA 3.2Å; T476-D505 PolarHBondContact OG1-OD1 3.41Å; T476-H506 WeakPolarHBondContact O-CB 3.36Å; T476-H506 PolarHBondContact O-N 3.44Å; T476-H506 PolarHBondContact O-ND1 3.45Å
477	T	66.2	Low	74.4	Confident	38 Å²	38	73 Å²	73	23%	0.233	42%	0.415	C	S	.	.			trans	-73.1	166.6	170.1	61.9	0	0	0	0	111.4	E479 G480 A481 L483 F507	T477-E479 PolarHBondContact O-N 2.8Å; T477-E479 VanDerWaalsContact O-N 3.11Å; T477-E479 PolarHBondContact OG1-N 3.36Å; T477-G480 PolarHBondContact O-N 3.4Å; T477-G480 PolarHBondContact OG1-N 2.94Å; T477-A481 HydrophobicContact CG2-CB 4.4Å; T477-A481 PolarHBondContact N-O 3.26Å; T477-A481 PolarHBondContact OG1-N 2.83Å; T477-A481 PolarHBondContact OG1-O 3.26Å; T477-L483 HydrophobicContact CG2-CD1 3.58Å; T477-L483 HydrophobicContact CG2-CD2 4.1Å; T477-L483 HydrophobicContact CG2-CG 3.75Å; T477-F507 WeakPolarHBondContact O-CB 3.45Å
478	S	63.1	Low	73.8	Confident	78 Å²	78	77.1 Å²	77.1	55%	0.545	44%	0.442	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-18	171.7	50.9	0	0	0	0	114.1
479	E	61.4	Low	73.5	Confident	175 Å²	175	76.1 Å²	76.1	82%	0.818	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.4	-3.9	175.9	-62.7	179.9	178.2	0	0	112.7	T477	T477-E479 PolarHBondContact O-N 2.8Å; T477-E479 VanDerWaalsContact O-N 3.11Å; T477-E479 PolarHBondContact OG1-N 3.36Å
480	G	60.8	Low	73.5	Confident	26 Å²	26	80 Å²	80	27%	0.268	45%	0.448	S	S	.	.	S	Bend	trans	93	13.3	175.1	0	0	0	0	0	116.1	T477	T477-G480 PolarHBondContact O-N 3.4Å; T477-G480 PolarHBondContact OG1-N 2.94Å
481	A	65.6	Low	73.2	Confident	56 Å²	56	75.4 Å²	75.4	46%	0.463	43%	0.431	S	S	.	.			trans	-88.1	136.6	176	0	0	0	0	0	111.8	T476 T477	T476-A481 CarbonylContact C-O 3.57Å; T476-A481 VanDerWaalsContact CA-O 3.3Å; T476-A481 WeakPolarHBondContact CA-O 3.13Å; T477-A481 HydrophobicContact CG2-CB 4.4Å; T477-A481 PolarHBondContact N-O 3.26Å; T477-A481 PolarHBondContact OG1-N 2.83Å; T477-A481 PolarHBondContact OG1-O 3.26Å
482	S	69.2	Low	72.9	Confident	110 Å²	110	78 Å²	78	77%	0.769	44%	0.444	S	S	*	.	B	Isolated β-bridge	trans	-69.8	138.4	178.6	-55.2	0	0	0	0	112.2	P475	P475-S482 CarbonylContact O-C 3.53Å; P475-S482 WeakPolarHBondContact O-CA 2.91Å
483	L	65.6	Low	72.5	Confident	79 Å²	79	81.2 Å²	81.2	41%	0.414	46%	0.456	S	S	.	.			trans	-117.2	141.1	-179.8	-76.7	165.1	0	0	0	111.6	P475 T477 K485	P475-L483 HydrophobicContact CB-CB 4.46Å; P475-L483 WeakPolarHBondContact CB-O 3.42Å; P475-L483 WeakPolarHBondContact CG-O 3.44Å; P475-L483 PolarHBondContact O-N 3.42Å; T477-L483 HydrophobicContact CG2-CD1 3.58Å; T477-L483 HydrophobicContact CG2-CD2 4.1Å; T477-L483 HydrophobicContact CG2-CG 3.75Å; L483-K485 VanDerWaalsContact C-N 3.34Å
484	D	59.2	Low	72.6	Confident	175 Å²	175	81.6 Å²	81.6	94%	0.936	46%	0.455	S	S	*	.	S	Bend	trans	-75.9	-20.1	172.4	-68.5	-27.3	0	0	0	113.3
485	K	62.3	Low	72.6	Confident	166 Å²	166	91.5 Å²	91.5	72%	0.722	48%	0.484	S	S	*	.	S	Bend	trans	-99.4	120.1	-179.5	-73.9	-174.7	179	178.7	0	111.3	L483 K487	L483-K485 VanDerWaalsContact C-N 3.34Å; K485-K487 PolarHBondContact O-N 3.02Å
486	I	72.1	Confident	73.2	Confident	132 Å²	132	92 Å²	92	68%	0.677	48%	0.483	S	S	*	.			trans	-72.5	109.8	174.1	-56.3	171.8	0	0	0	108.7	V504	I486-V504 HydrophobicContact CG2-CG1 3.89Å; I486-V504 HydrophobicContact CG2-CG2 4.13Å
487	K	77.1	Confident	73.8	Confident	147 Å²	147	91.8 Å²	91.8	64%	0.639	48%	0.483	S	S	*	.			trans	-118	131.5	165.9	-74.7	-173.1	176.8	-176.7	0	108.7	K485 H506	K485-K487 PolarHBondContact O-N 3.02Å; K487-H506 PolarHBondContact O-CE1 3.29Å
488	P	80.9	Confident	74.5	Confident	86 Å²	86	91.8 Å²	91.8	56%	0.558	48%	0.481	S	S	*	.	P	Polyproline II helix	trans	-71.2	148.6	174.4	28.6	-32	0	0	0	110.8	F503	P488-F503 WeakPolarHBondContact CA-O 3.47Å
489	V	82.5	Confident	75.3	Confident	10 Å²	10	99.4 Å²	99.4	6%	0.061	50%	0.498	C	S	.	.	P	Polyproline II helix	trans	-62.8	140.9	173.9	169.3	0	0	0	0	110.5	W491 F503 V509	V489-W491 HydrophobicContact CB-CZ2 4.29Å; V489-W491 HydrophobicContact CG1-CD2 4.26Å; V489-W491 HydrophobicContact CG1-CE3 4.49Å; V489-W491 HydrophobicContact CG1-CH2 4.38Å; V489-W491 HydrophobicContact CG1-CZ2 4.14Å; V489-F503 HydrophobicContact CG2-CD1 4.39Å; V489-F503 WeakPolarHBondContact CG2-O 3.1Å; V489-F503 PolarHBondContact N-O 2.93Å; V489-V509 HydrophobicContact CG1-CG1 4.37Å; V489-V509 HydrophobicContact CG1-CG2 3.77Å; V489-V509 HydrophobicContact CG2-CG2 4.13Å
490	D	82.6	Confident	76.2	Confident	102 Å²	102	99.6 Å²	99.6	55%	0.545	50%	0.496	S	S	.	.	P	Polyproline II helix	trans	-81.7	121.2	169.4	-175.6	10.9	0	0	0	111.7	T492 W493	D490-T492 WeakPolarHBondContact OD1-CB 3.43Å; D490-T492 WeakPolarHBondContact OD1-CG2 3.37Å; D490-T492 PolarHBondContact OD1-N 3.32Å; D490-T492 PolarHBondContact OD1-OG1 2.75Å; D490-T492 PolarHBondContact OD2-OG1 2.93Å; D490-W493 VanDerWaalsContact O-CD1 3.26Å; D490-W493 PolarHBondContact O-NE1 3.11Å
491	W	84.3	Confident	77.4	Confident	24 Å²	24	99.4 Å²	99.4	9%	0.091	49%	0.488	C	S	.	.			trans	-96.7	1.5	-178.8	-61.9	110.9	0	0	0	114.7	V489 W493 N494 A497 F501 F503 V509 N561 F562	V489-W491 HydrophobicContact CB-CZ2 4.29Å; V489-W491 HydrophobicContact CG1-CD2 4.26Å; V489-W491 HydrophobicContact CG1-CE3 4.49Å; V489-W491 HydrophobicContact CG1-CH2 4.38Å; V489-W491 HydrophobicContact CG1-CZ2 4.14Å; W491-W493 HydrophobicContact CE3-CZ2 4.3Å; W491-W493 AromaticContact CE3-NE1 3.97Å; W491-W493 HydrophobicContact CZ3-CZ2 4.2Å; W491-W493 PolarHBondContact O-N 3.37Å; W491-N494 PolarHBondContact O-N 3.08Å; W491-A497 HydrophobicContact CB-CB 3.67Å; W491-A497 HydrophobicContact CG-CB 4.4Å; W491-F501 AromaticContact CE2-CD1 3.64Å; W491-F501 HydrophobicContact CH2-CD1 4.1Å; W491-F501 AromaticContact CH2-CE1 3.76Å; W491-F501 HydrophobicContact CH2-CE1 3.76Å; W491-F501 AromaticContact CZ2-CD1 3.36Å; W491-F501 HydrophobicContact CZ2-CD1 3.36Å; W491-F501 AromaticContact CZ2-CE1 3.31Å; W491-F501 HydrophobicContact CZ2-CE1 3.31Å; W491-F501 AromaticContact NE1-CD1 3.79Å; W491-F501 PolarHBondContact NE1-O 2.75Å; W491-F501 VanDerWaalsContact NE1-O 3.15Å; W491-F503 HydrophobicContact CH2-CB 4.44Å; W491-F503 HydrophobicContact CZ2-CB 3.66Å; W491-F503 HydrophobicContact CZ2-CG 4.48Å; W491-V509 HydrophobicContact CH2-CG2 4.37Å; W491-N561 HydrophobicContact CD2-CB 4.29Å; W491-N561 HydrophobicContact CE3-CB 3.94Å; W491-N561 HydrophobicContact CH2-CB 3.98Å; W491-N561 HydrophobicContact CZ2-CB 4.3Å; W491-N561 VanDerWaalsContact CZ3-C 3.48Å; W491-N561 HydrophobicContact CZ3-CB 3.79Å; W491-N561 WeakPolarHBondContact CZ3-O 3.37Å; W491-F562 HydrophobicContact CH2-CD1 4.07Å; W491-F562 HydrophobicContact CH2-CD2 4.49Å; W491-F562 AromaticContact CH2-CE1 3.8Å; W491-F562 HydrophobicContact CH2-CE1 3.8Å; W491-F562 HydrophobicContact CH2-CE2 4.21Å; W491-F562 HydrophobicContact CH2-CG 4.42Å; W491-F562 AromaticContact CH2-CZ 3.87Å; W491-F562 HydrophobicContact CH2-CZ 3.87Å; W491-F562 HydrophobicContact CZ3-CD1 4.21Å; W491-F562 HydrophobicContact CZ3-CE1 4.36Å
492	T	82.9	Confident	78.2	Confident	116 Å²	116	103.2 Å²	103.2	71%	0.712	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.3	-23.3	-176.7	51.6	0	0	0	0	115	D490 N494	D490-T492 WeakPolarHBondContact OD1-CB 3.43Å; D490-T492 WeakPolarHBondContact OD1-CG2 3.37Å; D490-T492 PolarHBondContact OD1-N 3.32Å; D490-T492 PolarHBondContact OD1-OG1 2.75Å; D490-T492 PolarHBondContact OD2-OG1 2.93Å; T492-N494 PolarHBondContact O-N 3.4Å
493	W	82.6	Confident	79	Confident	79 Å²	79	98.1 Å²	98.1	30%	0.299	46%	0.461	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-17.2	177.6	66.6	-85.2	0	0	0	114.1	D490 W491 V509 K513 M579	D490-W493 VanDerWaalsContact O-CD1 3.26Å; D490-W493 PolarHBondContact O-NE1 3.11Å; W491-W493 HydrophobicContact CE3-CZ2 4.3Å; W491-W493 AromaticContact CE3-NE1 3.97Å; W491-W493 HydrophobicContact CZ3-CZ2 4.2Å; W491-W493 PolarHBondContact O-N 3.37Å; W493-V509 HydrophobicContact CZ2-CG1 4.25Å; W493-K513 VanDerWaalsContact CG-CE 3.45Å; W493-K513 VanDerWaalsContact CG-NZ 3.27Å; W493-M579 HydrophobicContact CZ3-CE 4.14Å; W493-M579 HydrophobicContact CZ3-SD 4.41Å
494	N	83.3	Confident	79.9	Confident	19 Å²	19	96.1 Å²	96.1	10%	0.102	45%	0.451	C	S	.	.			trans	-112.2	111.6	178.7	177.5	-1.1	0	0	0	109.9	W491 T492 H496 A497 R560 N561	W491-N494 PolarHBondContact O-N 3.08Å; T492-N494 PolarHBondContact O-N 3.4Å; N494-H496 PolarHBondContact O-N 2.63Å; N494-H496 PolarHBondContact OD1-N 3.11Å; N494-A497 HydrophobicContact CB-CB 4.05Å; N494-A497 WeakPolarHBondContact O-CB 3.5Å; N494-A497 PolarHBondContact O-N 3.12Å; N494-R560 PolarHBondContact ND2-O 3.38Å; N494-N561 PolarHBondContact ND2-O 3.44Å
495	R	82	Confident	81.2	Confident	235 Å²	235	88 Å²	88	89%	0.887	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-34.1	-178.9	-179.2	179.4	178.6	-177.7	-1	112.7
496	H	83.2	Confident	82.2	Confident	58 Å²	58	83 Å²	83	27%	0.269	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.7	3.3	-178	-64.6	-77.9	0	0	0	112.2	N494 R560 V565	N494-H496 PolarHBondContact O-N 2.63Å; N494-H496 PolarHBondContact OD1-N 3.11Å; H496-R560 PolarHBondContact O-NE 3.16Å; H496-R560 PolarHBondContact O-NH2 3.02Å; H496-V565 HydrophobicContact CB-CG1 4.09Å; H496-V565 HydrophobicContact CB-CG2 3.99Å
497	A	82.7	Confident	82.9	Confident	16 Å²	16	78.1 Å²	78.1	13%	0.132	36%	0.361	C	S	.	.			trans	-58	142.8	-177.6	0	0	0	0	0	113.6	W491 N494 N561	W491-A497 HydrophobicContact CB-CB 3.67Å; W491-A497 HydrophobicContact CG-CB 4.4Å; N494-A497 HydrophobicContact CB-CB 4.05Å; N494-A497 WeakPolarHBondContact O-CB 3.5Å; N494-A497 PolarHBondContact O-N 3.12Å; A497-N561 VanDerWaalsContact CA-OD1 3.28Å; A497-N561 WeakPolarHBondContact CA-OD1 3.4Å; A497-N561 WeakPolarHBondContact CB-OD1 3.48Å
498	D	81.6	Confident	83.3	Confident	38 Å²	38	71.1 Å²	71.1	20%	0.203	33%	0.33	C	S	.	.			trans	-78.2	119.5	170.5	-176.3	-12.4	0	0	0	109.2	K500 F501 T557 N561	D498-K500 PolarHBondContact O-N 2.78Å; D498-K500 WeakPolarHBondContact OD1-CB 3.35Å; D498-K500 PolarHBondContact OD1-N 2.83Å; D498-F501 HydrophobicContact CB-CB 4.31Å; D498-F501 WeakPolarHBondContact O-CB 3.23Å; D498-F501 PolarHBondContact O-N 2.82Å; D498-F501 VanDerWaalsContact O-N 3.14Å; D498-T557 HydrophobicContact CB-CG2 4.11Å; D498-N561 PolarHBondContact N-OD1 3.11Å
499	R	79.9	Confident	83.6	Confident	238 Å²	238	67.4 Å²	67.4	90%	0.898	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-20.6	-179	-62.9	-178.7	179.5	178.6	1.1	113.3
500	K	80.8	Confident	83.7	Confident	179 Å²	179	68.5 Å²	68.5	78%	0.778	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.1	-14	178.9	-62.3	179.4	-178.3	176.5	0	112.6	D498 Q502	D498-K500 PolarHBondContact O-N 2.78Å; D498-K500 WeakPolarHBondContact OD1-CB 3.35Å; D498-K500 PolarHBondContact OD1-N 2.83Å; K500-Q502 PolarHBondContact O-N 3.16Å
501	F	84.3	Confident	83.8	Confident	23 Å²	23	65.2 Å²	65.2	10%	0.101	30%	0.299	C	S	.	.			trans	-74.7	119.5	-177.1	-175.2	-108.7	0	0	0	111.7	F462 W491 D498 F503 A558 N561 F562	F462-F501 HydrophobicContact CB-CE2 4.17Å; F462-F501 HydrophobicContact CD1-CZ 4.24Å; W491-F501 AromaticContact CE2-CD1 3.64Å; W491-F501 HydrophobicContact CH2-CD1 4.1Å; W491-F501 AromaticContact CH2-CE1 3.76Å; W491-F501 HydrophobicContact CH2-CE1 3.76Å; W491-F501 AromaticContact CZ2-CD1 3.36Å; W491-F501 HydrophobicContact CZ2-CD1 3.36Å; W491-F501 AromaticContact CZ2-CE1 3.31Å; W491-F501 HydrophobicContact CZ2-CE1 3.31Å; W491-F501 AromaticContact NE1-CD1 3.79Å; W491-F501 PolarHBondContact NE1-O 2.75Å; W491-F501 VanDerWaalsContact NE1-O 3.15Å; D498-F501 HydrophobicContact CB-CB 4.31Å; D498-F501 WeakPolarHBondContact O-CB 3.23Å; D498-F501 PolarHBondContact O-N 2.82Å; D498-F501 VanDerWaalsContact O-N 3.14Å; F501-F503 HydrophobicContact CD1-CB 4.47Å; F501-F503 HydrophobicContact CE1-CB 3.83Å; F501-F503 HydrophobicContact CE1-CG 4.41Å; F501-F503 HydrophobicContact CZ-CB 4.32Å; F501-F503 HydrophobicContact CZ-CD2 4.38Å; F501-A558 HydrophobicContact CE2-CB 4.14Å; F501-A558 HydrophobicContact CZ-CB 4.05Å; F501-N561 WeakPolarHBondContact CB-ND2 3.42Å; F501-N561 HydrophobicContact CD1-CB 3.61Å; F501-N561 VanDerWaalsContact CD1-CG 3.48Å; F501-N561 VanDerWaalsContact CD1-ND2 3.31Å; F501-N561 WeakPolarHBondContact CD1-ND2 3.41Å; F501-N561 HydrophobicContact CE1-CB 3.88Å; F501-N561 HydrophobicContact CG-CB 4.29Å; F501-N561 WeakPolarHBondContact CG-ND2 3.39Å; F501-F562 HydrophobicContact CE1-CE2 4.24Å; F501-F562 HydrophobicContact CZ-CE2 4.3Å
502	Q	83.1	Confident	84	Confident	135 Å²	135	64.1 Å²	64.1	63%	0.631	30%	0.295	S	S	*	.			trans	-109.1	125.2	178.4	-65	-174.8	-1.2	0	0	110.4	K500	K500-Q502 PolarHBondContact O-N 3.16Å
503	F	85.7	Confident	84.1	Confident	4 Å²	4	63.3 Å²	63.3	2%	0.018	28%	0.282	C	S	.	.			trans	-141	148	174.7	-162.8	-110.6	0	0	0	109.1	F462 K463 P488 V489 W491 F501 D505 L508 F562	F462-F503 HydrophobicContact CD1-CD2 4.4Å; F462-F503 HydrophobicContact CD1-CE2 4.11Å; F462-F503 AromaticContact CE1-CE2 3.87Å; F462-F503 HydrophobicContact CE1-CE2 3.87Å; F462-F503 HydrophobicContact CE1-CZ 4.48Å; K463-F503 WeakPolarHBondContact O-CE2 3.35Å; P488-F503 WeakPolarHBondContact CA-O 3.47Å; V489-F503 HydrophobicContact CG2-CD1 4.39Å; V489-F503 WeakPolarHBondContact CG2-O 3.1Å; V489-F503 PolarHBondContact N-O 2.93Å; W491-F503 HydrophobicContact CH2-CB 4.44Å; W491-F503 HydrophobicContact CZ2-CB 3.66Å; W491-F503 HydrophobicContact CZ2-CG 4.48Å; F501-F503 HydrophobicContact CD1-CB 4.47Å; F501-F503 HydrophobicContact CE1-CB 3.83Å; F501-F503 HydrophobicContact CE1-CG 4.41Å; F501-F503 HydrophobicContact CZ-CB 4.32Å; F501-F503 HydrophobicContact CZ-CD2 4.38Å; F503-D505 HydrophobicContact CD1-CB 4.26Å; F503-D505 HydrophobicContact CE1-CB 3.56Å; F503-D505 HydrophobicContact CZ-CB 4.02Å; F503-L508 HydrophobicContact CE1-CB 4.38Å; F503-L508 HydrophobicContact CE1-CD2 3.94Å; F503-L508 HydrophobicContact CZ-CD2 3.85Å; F503-F562 HydrophobicContact CD1-CE1 4.27Å; F503-F562 AromaticContact CD1-CZ 3.68Å; F503-F562 HydrophobicContact CD1-CZ 3.68Å; F503-F562 HydrophobicContact CD2-CZ 4.41Å; F503-F562 HydrophobicContact CE1-CE1 4.12Å; F503-F562 AromaticContact CE1-CZ 3.55Å; F503-F562 HydrophobicContact CE1-CZ 3.55Å; F503-F562 HydrophobicContact CE2-CZ 4.33Å; F503-F562 HydrophobicContact CG-CZ 4.11Å; F503-F562 AromaticContact CZ-CZ 3.91Å; F503-F562 HydrophobicContact CZ-CZ 3.91Å
504	V	85.2	Confident	84.2	Confident	36 Å²	36	62.2 Å²	62.2	22%	0.218	29%	0.286	C	S	.	.			trans	-111.9	-25.2	-168	-163.5	0	0	0	0	112.7	P475 I486 H506	P475-V504 HydrophobicContact CB-CG1 3.87Å; I486-V504 HydrophobicContact CG2-CG1 3.89Å; I486-V504 HydrophobicContact CG2-CG2 4.13Å; V504-H506 PolarHBondContact O-N 2.89Å; V504-H506 PolarHBondContact O-ND1 2.82Å
505	D	85.2	Confident	84.3	Confident	4 Å²	4	66.6 Å²	66.6	2%	0.021	30%	0.304	C	S	.	.	B	Isolated β-bridge	trans	-81.3	107.4	-174.7	-173.4	-32.3	0	0	0	111.1	Y472 G473 G474 T476 F503 F507 L508	Y472-D505 VanDerWaalsContact CA-OD2 3.28Å; Y472-D505 WeakPolarHBondContact CA-OD2 3.24Å; Y472-D505 WeakPolarHBondContact CB-OD2 3.37Å; G473-D505 PolarHBondContact N-OD2 3.15Å; G474-D505 WeakPolarHBondContact O-CA 3.49Å; G474-D505 WeakPolarHBondContact O-CB 3.31Å; T476-D505 WeakPolarHBondContact OG1-CA 3.2Å; T476-D505 PolarHBondContact OG1-OD1 3.41Å; F503-D505 HydrophobicContact CD1-CB 4.26Å; F503-D505 HydrophobicContact CE1-CB 3.56Å; F503-D505 HydrophobicContact CZ-CB 4.02Å; D505-F507 WeakPolarHBondContact OD1-CA 3.43Å; D505-F507 WeakPolarHBondContact OD1-CB 3.11Å; D505-F507 PolarHBondContact OD1-N 3.49Å; D505-L508 PolarHBondContact OD1-N 3.14Å
506	H	84.9	Confident	84.2	Confident	61 Å²	61	64 Å²	64	28%	0.282	30%	0.299	S	S	.	.	H	α-helix	trans	-80.1	-21.4	-179.4	-66.4	64.1	0	0	0	112.4	T476 K487 V504 A510	T476-H506 WeakPolarHBondContact O-CB 3.36Å; T476-H506 PolarHBondContact O-N 3.44Å; T476-H506 PolarHBondContact O-ND1 3.45Å; K487-H506 PolarHBondContact O-CE1 3.29Å; V504-H506 PolarHBondContact O-N 2.89Å; V504-H506 PolarHBondContact O-ND1 2.82Å; H506-A510 PolarHBondContact O-N 2.97Å; H506-A510 VanDerWaalsContact O-N 3.13Å
507	F	85.8	Confident	84.3	Confident	30 Å²	30	63.2 Å²	63.2	13%	0.132	30%	0.297	C	S	.	.	H	α-helix	trans	-71.4	-42.6	-177.4	179.5	-103	0	0	0	111.3	Y472 T477 D505 V509 A510 N511	Y472-F507 HydrophobicContact CD1-CD1 4.4Å; Y472-F507 AromaticContact CE1-CD1 3.81Å; Y472-F507 HydrophobicContact CE1-CD1 3.81Å; Y472-F507 HydrophobicContact CE1-CE1 4.03Å; T477-F507 WeakPolarHBondContact O-CB 3.45Å; D505-F507 WeakPolarHBondContact OD1-CA 3.43Å; D505-F507 WeakPolarHBondContact OD1-CB 3.11Å; D505-F507 PolarHBondContact OD1-N 3.49Å; F507-V509 VanDerWaalsContact C-N 3.28Å; F507-V509 PolarHBondContact O-N 3.11Å; F507-A510 PolarHBondContact O-N 2.69Å; F507-N511 WeakPolarHBondContact CE1-ND2 3.48Å; F507-N511 VanDerWaalsContact CZ-ND2 3.31Å; F507-N511 WeakPolarHBondContact CZ-ND2 3.29Å; F507-N511 WeakPolarHBondContact CZ-OD1 3.29Å; F507-N511 PolarHBondContact O-N 2.74Å
508	L	86.8	Confident	84.6	Confident	0 Å²	0	70.5 Å²	70.5	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-57.6	-42.8	175.6	-178.1	58.5	0	0	0	111.9	I467 Y472 F503 D505 N511 I512 F524 F562	I467-L508 HydrophobicContact CD1-CD1 4.04Å; Y472-L508 HydrophobicContact CD1-CB 3.74Å; Y472-L508 HydrophobicContact CD1-CD1 3.95Å; Y472-L508 HydrophobicContact CD1-CG 4.27Å; Y472-L508 HydrophobicContact CD2-CD1 4.24Å; Y472-L508 HydrophobicContact CE1-CB 4.26Å; Y472-L508 HydrophobicContact CE1-CD1 3.98Å; Y472-L508 HydrophobicContact CE2-CD1 4.31Å; Y472-L508 HydrophobicContact CG-CB 4.25Å; Y472-L508 HydrophobicContact CG-CD1 4.06Å; Y472-L508 HydrophobicContact CG-CD2 4.21Å; Y472-L508 HydrophobicContact CG-CG 4.41Å; F503-L508 HydrophobicContact CE1-CB 4.38Å; F503-L508 HydrophobicContact CE1-CD2 3.94Å; F503-L508 HydrophobicContact CZ-CD2 3.85Å; D505-L508 PolarHBondContact OD1-N 3.14Å; L508-N511 PolarHBondContact O-N 3.3Å; L508-I512 HydrophobicContact CD1-CD1 4.04Å; L508-I512 HydrophobicContact CD1-CG1 4.43Å; L508-I512 HydrophobicContact CG-CD1 3.93Å; L508-I512 WeakPolarHBondContact O-CD1 3.38Å; L508-I512 WeakPolarHBondContact O-CG1 3.45Å; L508-I512 PolarHBondContact O-N 3.03Å; L508-F524 HydrophobicContact CD1-CE2 4.43Å; L508-F524 HydrophobicContact CD2-CE2 4.28Å; L508-F524 HydrophobicContact CD2-CZ 4.09Å; L508-F562 HydrophobicContact CD2-CE1 3.92Å; L508-F562 HydrophobicContact CD2-CZ 3.9Å; L508-F562 HydrophobicContact CG-CE1 4.08Å
509	V	85.4	Confident	85	Confident	8 Å²	8	72.3 Å²	72.3	5%	0.048	34%	0.335	C	S	.	.	H	α-helix	trans	-64.4	-42.5	178.7	179.9	0	0	0	0	110.8	V489 W491 W493 F507 I512 K513 F562	V489-V509 HydrophobicContact CG1-CG1 4.37Å; V489-V509 HydrophobicContact CG1-CG2 3.77Å; V489-V509 HydrophobicContact CG2-CG2 4.13Å; W491-V509 HydrophobicContact CH2-CG2 4.37Å; W493-V509 HydrophobicContact CZ2-CG1 4.25Å; F507-V509 VanDerWaalsContact C-N 3.28Å; F507-V509 PolarHBondContact O-N 3.11Å; V509-I512 PolarHBondContact O-N 3.5Å; V509-K513 HydrophobicContact CG1-CD 4.19Å; V509-K513 WeakPolarHBondContact O-CB 3.31Å; V509-K513 VanDerWaalsContact O-CG 3.29Å; V509-K513 WeakPolarHBondContact O-CG 3.31Å; V509-K513 PolarHBondContact O-N 2.94Å; V509-F562 HydrophobicContact CG2-CD1 4.4Å; V509-F562 HydrophobicContact CG2-CE1 3.81Å
510	A	85	Confident	85.5	Confident	34 Å²	34	61 Å²	61	28%	0.281	29%	0.293	S	S	.	.	H	α-helix	trans	-62.8	-41.4	175.8	0	0	0	0	0	111.8	H506 F507 K513 S514	H506-A510 PolarHBondContact O-N 2.97Å; H506-A510 VanDerWaalsContact O-N 3.13Å; F507-A510 PolarHBondContact O-N 2.69Å; A510-K513 PolarHBondContact O-N 3.29Å; A510-S514 PolarHBondContact O-N 2.95Å
511	N	86.2	Confident	86	Confident	32 Å²	32	54.2 Å²	54.2	17%	0.171	27%	0.265	C	S	.	.	H	α-helix	trans	-62.5	-46.3	177.3	-78.7	-5.6	0	0	0	112.3	F507 L508 S514 K515	F507-N511 WeakPolarHBondContact CE1-ND2 3.48Å; F507-N511 VanDerWaalsContact CZ-ND2 3.31Å; F507-N511 WeakPolarHBondContact CZ-ND2 3.29Å; F507-N511 WeakPolarHBondContact CZ-OD1 3.29Å; F507-N511 PolarHBondContact O-N 2.74Å; L508-N511 PolarHBondContact O-N 3.3Å; N511-S514 WeakPolarHBondContact O-CB 3.28Å; N511-S514 PolarHBondContact O-N 3.5Å; N511-S514 PolarHBondContact O-OG 2.61Å; N511-K515 PolarHBondContact O-N 3.02Å
512	I	87.3	Confident	86.4	Confident	2 Å²	2	54.4 Å²	54.4	1%	0.01	27%	0.266	C	S	.	.	H	α-helix	trans	-64.4	-43.1	178.5	-66.1	161.6	0	0	0	110.7	L508 V509 S514 K515 A520 L521 F524 F562 F564 M579	L508-I512 HydrophobicContact CD1-CD1 4.04Å; L508-I512 HydrophobicContact CD1-CG1 4.43Å; L508-I512 HydrophobicContact CG-CD1 3.93Å; L508-I512 WeakPolarHBondContact O-CD1 3.38Å; L508-I512 WeakPolarHBondContact O-CG1 3.45Å; L508-I512 PolarHBondContact O-N 3.03Å; V509-I512 PolarHBondContact O-N 3.5Å; I512-S514 PolarHBondContact O-N 3.4Å; I512-K515 PolarHBondContact O-N 3.47Å; I512-A520 HydrophobicContact CG1-CB 4.42Å; I512-L521 HydrophobicContact CG2-CD2 4.38Å; I512-F524 HydrophobicContact CD1-CD2 3.7Å; I512-F524 HydrophobicContact CD1-CE2 3.42Å; I512-F524 VanDerWaalsContact CD1-CE2 3.42Å; I512-F524 HydrophobicContact CD1-CZ 4.29Å; I512-F524 HydrophobicContact CG1-CD2 4.44Å; I512-F524 HydrophobicContact CG1-CE2 4.43Å; I512-F562 HydrophobicContact CD1-CB 4.1Å; I512-F562 HydrophobicContact CD1-CD1 3.39Å; I512-F562 HydrophobicContact CD1-CE1 4.06Å; I512-F562 HydrophobicContact CD1-CG 3.98Å; I512-F564 HydrophobicContact CG2-CE2 4.47Å; I512-M579 HydrophobicContact CG2-CE 4.25Å; I512-M579 HydrophobicContact CG2-SD 4.09Å
513	K	85.1	Confident	87	Confident	99 Å²	99	48 Å²	48	43%	0.43	24%	0.236	S	C	.	.	H	α-helix	trans	-59.6	-33.9	175.2	-76.5	178.5	178.5	-178.5	0	112.7	W493 V509 A510 K515	W493-K513 VanDerWaalsContact CG-CE 3.45Å; W493-K513 VanDerWaalsContact CG-NZ 3.27Å; V509-K513 HydrophobicContact CG1-CD 4.19Å; V509-K513 WeakPolarHBondContact O-CB 3.31Å; V509-K513 VanDerWaalsContact O-CG 3.29Å; V509-K513 WeakPolarHBondContact O-CG 3.31Å; V509-K513 PolarHBondContact O-N 2.94Å; A510-K513 PolarHBondContact O-N 3.29Å; K513-K515 PolarHBondContact O-N 3.37Å
514	S	84.9	Confident	87.4	Confident	56 Å²	56	47.8 Å²	47.8	39%	0.392	24%	0.235	S	C	.	.	H	α-helix	trans	-69	-19.7	177.8	83.5	0	0	0	0	113.8	A510 N511 I512 K516	A510-S514 PolarHBondContact O-N 2.95Å; N511-S514 WeakPolarHBondContact O-CB 3.28Å; N511-S514 PolarHBondContact O-N 3.5Å; N511-S514 PolarHBondContact O-OG 2.61Å; I512-S514 PolarHBondContact O-N 3.4Å; S514-K516 PolarHBondContact O-N 3.28Å; S514-K516 PolarHBondContact OG-N 3.32Å
515	K	84.4	Confident	87.9	Confident	111 Å²	111	47.2 Å²	47.2	48%	0.483	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.2	14.6	-173.7	-58.2	-174.9	178.2	-173.3	0	115.1	N511 I512 K513 L521	N511-K515 PolarHBondContact O-N 3.02Å; I512-K515 PolarHBondContact O-N 3.47Å; K513-K515 PolarHBondContact O-N 3.37Å; K515-L521 HydrophobicContact CB-CD1 4.43Å
516	K	80.8	Confident	88.4	Confident	179 Å²	179	47 Å²	47	78%	0.778	23%	0.228	S	C	*	.			trans	-84.7	-32.7	-178.1	-69.2	-176.3	179.4	179.5	0	113.3	S514 K518	S514-K516 PolarHBondContact O-N 3.28Å; S514-K516 PolarHBondContact OG-N 3.32Å; K516-K518 PolarHBondContact O-N 2.83Å
517	D	85.4	Confident	88.9	Confident	42 Å²	42	44.2 Å²	44.2	23%	0.225	22%	0.216	C	C	.	.			trans	-85.5	103	-178.9	-172.1	-17.3	0	0	0	110.2	D519 A520 L521	D517-D519 PolarHBondContact OD1-N 3.42Å; D517-D519 VanDerWaalsContact OD1-N 3.12Å; D517-A520 HydrophobicContact CB-CB 3.99Å; D517-A520 PolarHBondContact OD1-N 3.09Å; D517-A520 VanDerWaalsContact OD1-N 3.16Å; D517-L521 WeakPolarHBondContact O-CG 3.47Å; D517-L521 PolarHBondContact O-N 3.45Å
518	K	88.2	Confident	89.3	Confident	170 Å²	170	42.8 Å²	42.8	74%	0.739	21%	0.209	S	C	*	.	H	α-helix	trans	-69	-33.9	-178	-69.3	-174.5	178.6	179.8	0	112.3	K516 L521 E522	K516-K518 PolarHBondContact O-N 2.83Å; K518-L521 PolarHBondContact O-N 3.27Å; K518-E522 WeakPolarHBondContact O-CB 3.11Å; K518-E522 PolarHBondContact O-N 2.98Å
519	D	89.8	Confident	89.7	Confident	76 Å²	76	42.8 Å²	42.8	41%	0.406	21%	0.209	S	C	.	.	H	α-helix	trans	-72.1	-38	-177.4	-63.4	-39.8	0	0	0	110.5	I467 A468 D517 E522 F523	I467-D519 HydrophobicContact CG2-CB 4.23Å; A468-D519 HydrophobicContact CB-CB 4.07Å; D517-D519 PolarHBondContact OD1-N 3.42Å; D517-D519 VanDerWaalsContact OD1-N 3.12Å; D519-E522 PolarHBondContact O-N 3.43Å; D519-F523 VanDerWaalsContact O-CB 3.28Å; D519-F523 WeakPolarHBondContact O-CB 3.44Å; D519-F523 PolarHBondContact O-N 2.91Å
520	A	90.9	Very high	90.1	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-64	-40.6	172.7	0	0	0	0	0	113	I467 I512 D517 F523 F524	I467-A520 HydrophobicContact CD1-CB 4.4Å; I467-A520 HydrophobicContact CG2-CB 4.49Å; I512-A520 HydrophobicContact CG1-CB 4.42Å; D517-A520 HydrophobicContact CB-CB 3.99Å; D517-A520 PolarHBondContact OD1-N 3.09Å; D517-A520 VanDerWaalsContact OD1-N 3.16Å; A520-F523 PolarHBondContact O-N 3.49Å; A520-F524 WeakPolarHBondContact O-CD2 3.31Å; A520-F524 PolarHBondContact O-N 3.04Å
521	L	92.4	Very high	90.4	Very high	37 Å²	37	40.8 Å²	40.8	19%	0.194	19%	0.194	C	C	.	.	H	α-helix	trans	-65.7	-42.9	175.9	-65.7	172.7	0	0	0	111.4	I512 K515 D517 K518 F523 K525 F564	I512-L521 HydrophobicContact CG2-CD2 4.38Å; K515-L521 HydrophobicContact CB-CD1 4.43Å; D517-L521 WeakPolarHBondContact O-CG 3.47Å; D517-L521 PolarHBondContact O-N 3.45Å; K518-L521 PolarHBondContact O-N 3.27Å; L521-F523 VanDerWaalsContact C-N 3.34Å; L521-K525 VanDerWaalsContact O-CB 3.25Å; L521-K525 WeakPolarHBondContact O-CB 3.48Å; L521-K525 PolarHBondContact O-N 3Å; L521-F564 HydrophobicContact CB-CZ 4.16Å; L521-F564 HydrophobicContact CD2-CE2 4.2Å; L521-F564 HydrophobicContact CD2-CZ 3.73Å; L521-F564 WeakPolarHBondContact O-CZ 3.35Å
522	E	92.6	Very high	90.4	Very high	26 Å²	26	41.3 Å²	41.3	12%	0.121	20%	0.198	C	C	.	.	H	α-helix	trans	-66.6	-36.8	178.7	-164.7	69.9	-172.1	0	0	111.9	K518 D519 K525 L526 R612 Y614 I698	K518-E522 WeakPolarHBondContact O-CB 3.11Å; K518-E522 PolarHBondContact O-N 2.98Å; D519-E522 PolarHBondContact O-N 3.43Å; E522-K525 PolarHBondContact O-N 3.47Å; E522-L526 WeakPolarHBondContact O-CB 3.38Å; E522-L526 PolarHBondContact O-N 3.44Å; E522-R612 IonicContact OE1-CZ 3.98Å; E522-R612 IonicContact OE1-NH1 3.69Å; E522-R612 PolarHBondContact OE1-NH1 3.41Å; E522-R612 IonicContact OE2-NH1 2.82Å; E522-Y614 WeakPolarHBondContact OE1-CE1 2.69Å; E522-Y614 PolarHBondContact OE1-OH 3.43Å; E522-I698 HydrophobicContact CG-CD1 4.06Å
523	F	95.3	Very high	90.4	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-57.7	-53.9	176.1	-177.2	-85.7	0	0	0	112.1	C465 I467 D519 A520 L521 L526 L527 L653 I698 T701	C465-F523 HydrophobicContact CB-CE1 4.17Å; C465-F523 HydrophobicContact CB-CZ 3.7Å; I467-F523 HydrophobicContact CB-CD2 4.49Å; I467-F523 HydrophobicContact CD1-CB 4.18Å; I467-F523 HydrophobicContact CD1-CD1 3.78Å; I467-F523 HydrophobicContact CD1-CD2 4.19Å; I467-F523 HydrophobicContact CD1-CE1 4.15Å; I467-F523 HydrophobicContact CD1-CG 3.81Å; I467-F523 HydrophobicContact CD1-CZ 4.49Å; I467-F523 HydrophobicContact CG1-CB 4.49Å; I467-F523 HydrophobicContact CG1-CD1 4.21Å; I467-F523 HydrophobicContact CG1-CD2 3.77Å; I467-F523 HydrophobicContact CG1-CE1 4.34Å; I467-F523 HydrophobicContact CG1-CE2 3.9Å; I467-F523 HydrophobicContact CG1-CG 3.92Å; I467-F523 HydrophobicContact CG1-CZ 4.18Å; I467-F523 HydrophobicContact CG2-CB 4.18Å; I467-F523 HydrophobicContact CG2-CD2 4.29Å; I467-F523 HydrophobicContact CG2-CG 4.41Å; D519-F523 VanDerWaalsContact O-CB 3.28Å; D519-F523 WeakPolarHBondContact O-CB 3.44Å; D519-F523 PolarHBondContact O-N 2.91Å; A520-F523 PolarHBondContact O-N 3.49Å; L521-F523 VanDerWaalsContact C-N 3.34Å; F523-L526 PolarHBondContact O-N 3.12Å; F523-L527 HydrophobicContact CD1-CD1 4.14Å; F523-L527 HydrophobicContact CE1-CD1 3.72Å; F523-L527 HydrophobicContact CE1-CG 4.49Å; F523-L527 HydrophobicContact CZ-CD1 4.5Å; F523-L527 PolarHBondContact O-N 2.94Å; F523-L653 HydrophobicContact CD1-CD1 4.36Å; F523-L653 HydrophobicContact CD2-CD1 3.61Å; F523-L653 HydrophobicContact CE1-CD1 4.13Å; F523-L653 HydrophobicContact CE2-CD1 3.36Å; F523-L653 HydrophobicContact CE2-CG 4.24Å; F523-L653 HydrophobicContact CG-CD1 4.12Å; F523-L653 HydrophobicContact CZ-CD1 3.64Å; F523-I698 HydrophobicContact CB-CG2 3.89Å; F523-I698 HydrophobicContact CD2-CG2 4.02Å; F523-I698 HydrophobicContact CG-CG2 4.47Å; F523-T701 HydrophobicContact CE1-CG2 4.21Å; F523-T701 HydrophobicContact CE2-CG2 4.36Å; F523-T701 HydrophobicContact CZ-CG2 3.56Å
524	F	94.9	Very high	90.2	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-73.2	-29.4	-179.6	-74.5	-70.1	0	0	0	112.9	I467 L508 I512 A520 L527 S528 A559 F562 F564	I467-F524 HydrophobicContact CD1-CE2 4.17Å; L508-F524 HydrophobicContact CD1-CE2 4.43Å; L508-F524 HydrophobicContact CD2-CE2 4.28Å; L508-F524 HydrophobicContact CD2-CZ 4.09Å; I512-F524 HydrophobicContact CD1-CD2 3.7Å; I512-F524 HydrophobicContact CD1-CE2 3.42Å; I512-F524 VanDerWaalsContact CD1-CE2 3.42Å; I512-F524 HydrophobicContact CD1-CZ 4.29Å; I512-F524 HydrophobicContact CG1-CD2 4.44Å; I512-F524 HydrophobicContact CG1-CE2 4.43Å; A520-F524 WeakPolarHBondContact O-CD2 3.31Å; A520-F524 PolarHBondContact O-N 3.04Å; F524-L527 HydrophobicContact CD1-CD1 4.09Å; F524-L527 HydrophobicContact CE1-CD1 4.31Å; F524-L527 PolarHBondContact O-N 3.3Å; F524-S528 PolarHBondContact O-N 3.14Å; F524-S528 VanDerWaalsContact O-N 3.1Å; F524-S528 PolarHBondContact O-OG 3.38Å; F524-A559 HydrophobicContact CD1-CB 4.4Å; F524-F562 HydrophobicContact CD1-CB 3.97Å; F524-F562 AromaticContact CD1-CD2 3.87Å; F524-F562 HydrophobicContact CD1-CD2 3.87Å; F524-F562 HydrophobicContact CD1-CG 4.16Å; F524-F562 HydrophobicContact CD2-CB 4.27Å; F524-F562 HydrophobicContact CD2-CG 4.48Å; F524-F562 HydrophobicContact CE1-CB 4.05Å; F524-F562 AromaticContact CE1-CD2 3.14Å; F524-F562 HydrophobicContact CE1-CD2 3.14Å; F524-F562 AromaticContact CE1-CE2 3.68Å; F524-F562 HydrophobicContact CE1-CE2 3.68Å; F524-F562 AromaticContact CE1-CG 3.71Å; F524-F562 HydrophobicContact CE1-CG 3.71Å; F524-F562 HydrophobicContact CE2-CB 4.38Å; F524-F562 HydrophobicContact CE2-CD1 4.4Å; F524-F562 HydrophobicContact CE2-CD2 4.25Å; F524-F562 HydrophobicContact CE2-CG 4.1Å; F524-F562 HydrophobicContact CG-CB 4.08Å; F524-F562 HydrophobicContact CZ-CB 4.25Å; F524-F562 HydrophobicContact CZ-CD1 4.16Å; F524-F562 AromaticContact CZ-CD2 3.38Å; F524-F562 HydrophobicContact CZ-CD2 3.38Å; F524-F562 HydrophobicContact CZ-CE1 4.34Å; F524-F562 AromaticContact CZ-CE2 3.64Å; F524-F562 HydrophobicContact CZ-CE2 3.64Å; F524-F562 AromaticContact CZ-CG 3.67Å; F524-F562 HydrophobicContact CZ-CG 3.67Å; F524-F562 HydrophobicContact CZ-CZ 4.11Å; F524-F564 HydrophobicContact CB-CB 4.47Å; F524-F564 HydrophobicContact CB-CD2 3.37Å; F524-F564 HydrophobicContact CB-CE2 3.64Å; F524-F564 HydrophobicContact CB-CG 3.94Å; F524-F564 HydrophobicContact CB-CZ 4.39Å; F524-F564 HydrophobicContact CG-CD2 4.35Å
525	K	94.5	Very high	90.2	Very high	24 Å²	24	38 Å²	38	10%	0.104	18%	0.181	C	C	.	.	H	α-helix	trans	-59.7	-48.5	170.4	-174.1	-178.7	-56.6	-129.5	0	111.4	L521 E522 L527 S528 L529 F564 I576 E578 F606	L521-K525 VanDerWaalsContact O-CB 3.25Å; L521-K525 WeakPolarHBondContact O-CB 3.48Å; L521-K525 PolarHBondContact O-N 3Å; E522-K525 PolarHBondContact O-N 3.47Å; K525-L527 VanDerWaalsContact C-N 3.32Å; K525-L527 PolarHBondContact O-N 3.26Å; K525-S528 PolarHBondContact O-N 3.2Å; K525-S528 VanDerWaalsContact O-N 3.09Å; K525-S528 PolarHBondContact O-OG 2.96Å; K525-L529 HydrophobicContact CD-CD1 4.38Å; K525-L529 HydrophobicContact CG-CD1 3.75Å; K525-L529 WeakPolarHBondContact O-CG 3.17Å; K525-L529 PolarHBondContact O-N 2.9Å; K525-F564 HydrophobicContact CB-CD1 4.11Å; K525-F564 HydrophobicContact CB-CE1 3.96Å; K525-I576 HydrophobicContact CG-CD1 4.37Å; K525-E578 WeakPolarHBondContact CD-OE1 3.3Å; K525-E578 WeakPolarHBondContact CE-OE1 3.39Å; K525-E578 IonicContact NZ-OE1 3.91Å; K525-E578 PolarHBondContact NZ-OE1 2.95Å; K525-E578 IonicContact NZ-OE2 2.83Å; K525-E578 PolarHBondContact NZ-OE2 3.24Å; K525-F606 HydrophobicContact CD-CE1 4.47Å
526	L	95.4	Very high	89.8	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-57.1	-46.2	176.1	-175.2	164.1	0	0	0	111.2	E522 F523 S528 L529 C530 Y614 L653 C654 I698	E522-L526 WeakPolarHBondContact O-CB 3.38Å; E522-L526 PolarHBondContact O-N 3.44Å; F523-L526 PolarHBondContact O-N 3.12Å; L526-S528 PolarHBondContact O-N 3.01Å; L526-L529 PolarHBondContact O-N 3.29Å; L526-C530 HydrophobicContact CD2-CB 4.07Å; L526-C530 PolarHBondContact O-N 2.82Å; L526-Y614 HydrophobicContact CB-CD1 3.99Å; L526-Y614 HydrophobicContact CB-CE1 4.1Å; L526-Y614 HydrophobicContact CB-CG 4.4Å; L526-Y614 HydrophobicContact CD1-CD1 3.47Å; L526-Y614 VanDerWaalsContact CD1-CD1 3.47Å; L526-Y614 HydrophobicContact CD1-CE1 4.15Å; L526-Y614 HydrophobicContact CD1-CG 4.13Å; L526-Y614 HydrophobicContact CG-CD1 3.61Å; L526-Y614 HydrophobicContact CG-CE1 4.24Å; L526-Y614 HydrophobicContact CG-CG 3.86Å; L526-L653 HydrophobicContact CD1-CB 4.09Å; L526-L653 HydrophobicContact CD2-CB 4.36Å; L526-L653 HydrophobicContact CD2-CD1 4.31Å; L526-L653 HydrophobicContact CD2-CD2 3.79Å; L526-L653 HydrophobicContact CD2-CG 4.38Å; L526-C654 WeakPolarHBondContact CD1-O 3.34Å; L526-I698 HydrophobicContact CD1-CD1 3.68Å
527	L	95.1	Very high	89.4	Confident	3 Å²	3	30.5 Å²	30.5	2%	0.016	16%	0.159	C	C	.	.	H	α-helix	trans	-60.4	-30.1	177.8	-68.5	-175	0	0	0	113.4	F523 F524 K525 H531 L555 A559 L653 T701	F523-L527 HydrophobicContact CD1-CD1 4.14Å; F523-L527 HydrophobicContact CE1-CD1 3.72Å; F523-L527 HydrophobicContact CE1-CG 4.49Å; F523-L527 HydrophobicContact CZ-CD1 4.5Å; F523-L527 PolarHBondContact O-N 2.94Å; F524-L527 HydrophobicContact CD1-CD1 4.09Å; F524-L527 HydrophobicContact CE1-CD1 4.31Å; F524-L527 PolarHBondContact O-N 3.3Å; K525-L527 VanDerWaalsContact C-N 3.32Å; K525-L527 PolarHBondContact O-N 3.26Å; L527-H531 PolarHBondContact O-CD2 2.96Å; L527-L555 HydrophobicContact CD1-CD2 4.31Å; L527-L555 HydrophobicContact CD2-CB 4.22Å; L527-L555 HydrophobicContact CD2-CD1 4.19Å; L527-L555 HydrophobicContact CD2-CD2 3.97Å; L527-L555 HydrophobicContact CD2-CG 4.36Å; L527-A559 HydrophobicContact CB-CB 3.94Å; L527-L653 HydrophobicContact CD2-CD1 3.59Å; L527-L653 HydrophobicContact CD2-CD2 3.88Å; L527-L653 HydrophobicContact CD2-CG 4.39Å; L527-L653 HydrophobicContact CG-CD1 3.94Å; L527-T701 HydrophobicContact CD1-CG2 4.23Å; L527-T701 HydrophobicContact CD2-CG2 4.14Å
528	S	94.9	Very high	88.7	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.1	-5.1	176.2	68.2	0	0	0	0	115.2	F524 K525 L526 H531 I576	F524-S528 PolarHBondContact O-N 3.14Å; F524-S528 VanDerWaalsContact O-N 3.1Å; F524-S528 PolarHBondContact O-OG 3.38Å; K525-S528 PolarHBondContact O-N 3.2Å; K525-S528 VanDerWaalsContact O-N 3.09Å; K525-S528 PolarHBondContact O-OG 2.96Å; L526-S528 PolarHBondContact O-N 3.01Å; S528-H531 VanDerWaalsContact C-NE2 3.34Å; S528-H531 PolarHBondContact O-NE2 3.11Å; S528-I576 WeakPolarHBondContact OG-CD1 3.4Å
529	L	94.6	Very high	87.5	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-118.9	-41.7	-175.2	-72	176.6	0	0	0	112.9	K525 L526 H531 I574 I576 Y585 I602 L604 Y614	K525-L529 HydrophobicContact CD-CD1 4.38Å; K525-L529 HydrophobicContact CG-CD1 3.75Å; K525-L529 WeakPolarHBondContact O-CG 3.17Å; K525-L529 PolarHBondContact O-N 2.9Å; L526-L529 PolarHBondContact O-N 3.29Å; L529-H531 PolarHBondContact O-N 3.11Å; L529-I574 HydrophobicContact CD2-CB 4.41Å; L529-I574 HydrophobicContact CD2-CG2 3.7Å; L529-I576 HydrophobicContact CD1-CD1 4.39Å; L529-I576 HydrophobicContact CD2-CD1 3.92Å; L529-I576 HydrophobicContact CD2-CG1 4.36Å; L529-I576 HydrophobicContact CD2-CG2 3.88Å; L529-I576 HydrophobicContact CG-CD1 4.07Å; L529-Y585 HydrophobicContact CD1-CD2 4.44Å; L529-Y585 HydrophobicContact CD1-CE1 4.48Å; L529-Y585 HydrophobicContact CD1-CE2 4.38Å; L529-Y585 HydrophobicContact CD2-CD2 3.69Å; L529-Y585 HydrophobicContact CD2-CE2 4.14Å; L529-Y585 HydrophobicContact CD2-CG 4.12Å; L529-I602 WeakPolarHBondContact O-CD1 3.36Å; L529-L604 HydrophobicContact CB-CD1 3.84Å; L529-L604 HydrophobicContact CD1-CD1 3.8Å; L529-L604 HydrophobicContact CD2-CD1 4.06Å; L529-L604 HydrophobicContact CG-CD1 4.11Å; L529-Y614 HydrophobicContact CD1-CD2 4.41Å; L529-Y614 HydrophobicContact CD1-CE2 3.77Å
530	C	93.9	Very high	86.1	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	20%	0.2	C	C	.	.	S	Bend	trans	-91	79.6	-177.5	-170.8	0	0	0	0	110.5	L526 I602 K616	L526-C530 HydrophobicContact CD2-CB 4.07Å; L526-C530 PolarHBondContact O-N 2.82Å; C530-I602 HydrophobicContact CB-CG2 3.7Å; C530-K616 WeakPolarHBondContact O-CD 3.33Å; C530-K616 WeakPolarHBondContact O-CE 3.46Å; C530-K616 PolarHBondContact O-NZ 2.83Å
531	H	91.9	Very high	85.1	Confident	0 Å²	0	37 Å²	37	0%	0	23%	0.227	C	C	.	.	S	Bend	trans	-163.3	171.4	176.2	60.5	77.7	0	0	0	112.5	L527 S528 L529 V533 V556 F566 R569	L527-H531 PolarHBondContact O-CD2 2.96Å; S528-H531 VanDerWaalsContact C-NE2 3.34Å; S528-H531 PolarHBondContact O-NE2 3.11Å; L529-H531 PolarHBondContact O-N 3.11Å; H531-V533 HydrophobicContact CB-CG2 4.11Å; H531-V533 WeakPolarHBondContact ND1-CB 3.48Å; H531-V533 PolarHBondContact ND1-N 2.82Å; H531-V533 VanDerWaalsContact ND1-N 3.14Å; H531-V533 PolarHBondContact ND1-O 2.95Å; H531-V556 HydrophobicContact CB-CG2 3.95Å; H531-V556 WeakPolarHBondContact CD2-CG2 3.41Å; H531-V556 VanDerWaalsContact CG-CG2 3.49Å; H531-F566 AromaticContact CE1-CD1 3.85Å; H531-F566 AromaticContact CE1-CD2 3.8Å; H531-F566 AromaticContact CE1-CE1 3.98Å; H531-F566 AromaticContact CE1-CE2 3.95Å; H531-F566 AromaticContact CE1-CG 3.76Å; H531-F566 AromaticContact NE2-CG 3.97Å; H531-R569 PolarHBondContact O-NH1 3.08Å
532	T	87.1	Confident	84.4	Confident	43 Å²	43	40.1 Å²	40.1	26%	0.264	24%	0.24	S	C	.	.			trans	-103.9	1.2	171.6	62.5	0	0	0	0	114	M534 E552 M600	T532-M534 PolarHBondContact O-N 2.82Å; T532-E552 PolarHBondContact N-OE2 3.08Å; T532-E552 PolarHBondContact OG1-OE2 3.33Å; T532-M600 HydrophobicContact CG2-CE 3.36Å; T532-M600 HydrophobicContact CG2-SD 4.45Å
533	V	86.8	Confident	84	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	24%	0.238	C	C	.	.			trans	-54.2	136.3	179.3	-174.7	0	0	0	0	111.9	H531 Y545 Q546 A547 E552 V556 F566	H531-V533 HydrophobicContact CB-CG2 4.11Å; H531-V533 WeakPolarHBondContact ND1-CB 3.48Å; H531-V533 PolarHBondContact ND1-N 2.82Å; H531-V533 VanDerWaalsContact ND1-N 3.14Å; H531-V533 PolarHBondContact ND1-O 2.95Å; V533-Y545 HydrophobicContact CG1-CG 4.14Å; V533-Q546 WeakPolarHBondContact CA-O 3.33Å; V533-Q546 WeakPolarHBondContact CG1-O 3.22Å; V533-A547 HydrophobicContact CB-CB 4.44Å; V533-A547 HydrophobicContact CG1-CB 4.39Å; V533-A547 HydrophobicContact CG2-CB 3.67Å; V533-E552 HydrophobicContact CG2-CB 3.83Å; V533-V556 HydrophobicContact CB-CG2 4.08Å; V533-V556 HydrophobicContact CG1-CG1 4.47Å; V533-V556 HydrophobicContact CG2-CB 4.2Å; V533-V556 HydrophobicContact CG2-CG2 3.56Å; V533-F566 WeakPolarHBondContact O-CE1 3.33Å; V533-F566 WeakPolarHBondContact O-CZ 3.4Å
534	M	81.4	Confident	83.4	Confident	56 Å²	56	41.8 Å²	41.8	28%	0.276	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	155.8	173.8	-63.6	-61.3	-69	0	0	110	T532 Y545 Q546	T532-M534 PolarHBondContact O-N 2.82Å; M534-Y545 WeakPolarHBondContact O-CA 3.33Å; M534-Q546 PolarHBondContact N-O 3.07Å; M534-Q546 PolarHBondContact O-N 2.81Å
535	V	83.9	Confident	82.9	Confident	32 Å²	32	43.3 Å²	43.3	19%	0.194	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	129.2	-177	56.6	0	0	0	0	110.2	L543 V544 Y545 F566 L567	V535-L543 HydrophobicContact CG2-CB 4.01Å; V535-L543 HydrophobicContact CG2-CD2 3.77Å; V535-L543 HydrophobicContact CG2-CG 4.32Å; V535-V544 WeakPolarHBondContact CA-O 3.44Å; V535-Y545 HydrophobicContact CB-CD1 3.91Å; V535-Y545 HydrophobicContact CB-CE1 4.01Å; V535-Y545 HydrophobicContact CG2-CD1 3.84Å; V535-Y545 HydrophobicContact CG2-CE1 3.72Å; V535-F566 HydrophobicContact CB-CD1 3.93Å; V535-F566 HydrophobicContact CB-CE1 3.77Å; V535-F566 HydrophobicContact CG1-CD1 3.95Å; V535-F566 HydrophobicContact CG1-CE1 3.53Å; V535-F566 HydrophobicContact CG1-CZ 4.11Å; V535-L567 VanDerWaalsContact CG1-C 3.48Å; V535-L567 WeakPolarHBondContact CG1-O 3.29Å
536	E	75.6	Confident	82.1	Confident	49 Å²	49	44.3 Å²	44.3	23%	0.229	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	141.4	172.3	-169	172.3	-164.8	0	0	108.8	K200 N298 L543 V544 Q546	K200-E536 IonicContact NZ-OE1 3.29Å; K200-E536 PolarHBondContact NZ-OE1 3.46Å; N298-E536 PolarHBondContact OD1-OE2 2.93Å; E536-L543 WeakPolarHBondContact O-CA 3.3Å; E536-V544 PolarHBondContact N-O 3.08Å; E536-V544 PolarHBondContact O-N 3.08Å; E536-Q546 PolarHBondContact OE2-NE2 3.44Å
537	S	72.4	Confident	81.3	Confident	83 Å²	83	45 Å²	45	58%	0.58	27%	0.268	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.1	114.9	170.6	-65.8	0	0	0	0	108.5
538	N	71.1	Confident	80	Confident	75 Å²	75	47.8 Å²	47.8	40%	0.401	29%	0.292	S	S	.	.			trans	-64.3	161.2	172.4	-82	-10.3	0	0	0	110.9	G540 G541 E542 V544	N538-G540 PolarHBondContact O-N 2.75Å; N538-G541 PolarHBondContact O-N 3.07Å; N538-E542 PolarHBondContact N-O 2.89Å; N538-V544 VanDerWaalsContact ND2-CG2 3.27Å; N538-V544 WeakPolarHBondContact ND2-CG2 3.42Å
539	E	62.8	Low	79	Confident	215 Å²	215	49.9 Å²	49.9	100%	1.005	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53	-23.4	176.3	-64.9	-178.9	172.9	0	0	113.4
540	G	60.4	Low	78.3	Confident	79 Å²	79	51.6 Å²	51.6	81%	0.814	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.4	4.5	175.2	0	0	0	0	0	116.3	N538 E542	N538-G540 PolarHBondContact O-N 2.75Å; G540-E542 VanDerWaalsContact C-N 3.31Å; G540-E542 PolarHBondContact O-N 2.86Å
541	G	69.3	Low	77.7	Confident	55 Å²	55	53 Å²	53	57%	0.567	33%	0.325	S	S	*	.	S	Bend	trans	76.2	11.7	-178.5	0	0	0	0	0	115.2	N538	N538-G541 PolarHBondContact O-N 3.07Å
542	E	78.9	Confident	77.5	Confident	102 Å²	102	53.9 Å²	53.9	48%	0.477	33%	0.329	S	S	.	.			trans	-85.4	131.2	173.3	-168.4	173.8	-166.5	0	0	110.2	N538 G540	N538-E542 PolarHBondContact N-O 2.89Å; G540-E542 VanDerWaalsContact C-N 3.31Å; G540-E542 PolarHBondContact O-N 2.86Å
543	L	83.5	Confident	77.6	Confident	15 Å²	15	52.5 Å²	52.5	8%	0.079	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	128	177.9	-60	175	0	0	0	109.7	V535 E536 Y545 R560 V565 L567	V535-L543 HydrophobicContact CG2-CB 4.01Å; V535-L543 HydrophobicContact CG2-CD2 3.77Å; V535-L543 HydrophobicContact CG2-CG 4.32Å; E536-L543 WeakPolarHBondContact O-CA 3.3Å; L543-Y545 HydrophobicContact CB-CE1 4.48Å; L543-R560 PolarHBondContact O-NH1 2.86Å; L543-V565 HydrophobicContact CD1-CG1 3.67Å; L543-L567 HydrophobicContact CD1-CD2 4.09Å
544	V	82.9	Confident	77.8	Confident	47 Å²	47	53 Å²	53	29%	0.285	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	122.4	173.1	-179.8	0	0	0	0	108.4	V535 E536 N538 Q546	V535-V544 WeakPolarHBondContact CA-O 3.44Å; E536-V544 PolarHBondContact N-O 3.08Å; E536-V544 PolarHBondContact O-N 3.08Å; N538-V544 VanDerWaalsContact ND2-CG2 3.27Å; N538-V544 WeakPolarHBondContact ND2-CG2 3.42Å; V544-Q546 HydrophobicContact CG1-CG 4.39Å
545	Y	85.4	Confident	78.3	Confident	31 Å²	31	50.4 Å²	50.4	12%	0.122	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	131.5	176.4	-67.4	-21.2	0	0	0	110.8	V533 M534 V535 L543 V556 R560 F566	V533-Y545 HydrophobicContact CG1-CG 4.14Å; M534-Y545 WeakPolarHBondContact O-CA 3.33Å; V535-Y545 HydrophobicContact CB-CD1 3.91Å; V535-Y545 HydrophobicContact CB-CE1 4.01Å; V535-Y545 HydrophobicContact CG2-CD1 3.84Å; V535-Y545 HydrophobicContact CG2-CE1 3.72Å; L543-Y545 HydrophobicContact CB-CE1 4.48Å; Y545-V556 HydrophobicContact CD2-CB 4.34Å; Y545-V556 HydrophobicContact CD2-CG1 3.85Å; Y545-V556 HydrophobicContact CE2-CB 4.4Å; Y545-V556 HydrophobicContact CE2-CG1 3.58Å; Y545-R560 HydrophobicContact CE2-CB 3.74Å; Y545-R560 VanDerWaalsContact CE2-CD 3.41Å; Y545-R560 HydrophobicContact CE2-CG 4.15Å; Y545-F566 HydrophobicContact CD1-CD1 4.39Å; Y545-F566 HydrophobicContact CE1-CB 4.28Å; Y545-F566 HydrophobicContact CE1-CD1 4.04Å; Y545-F566 WeakPolarHBondContact CE1-O 3.33Å; Y545-F566 PolarHBondContact OH-N 3.1Å; Y545-F566 PolarHBondContact OH-O 2.84Å
546	Q	76.4	Confident	78.8	Confident	46 Å²	46	48.9 Å²	48.9	22%	0.215	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	122.4	179.2	-65.6	170.4	3.6	0	0	108	N298 V533 M534 E536 V544	N298-Q546 PolarHBondContact ND2-OE1 2.75Å; V533-Q546 WeakPolarHBondContact CA-O 3.33Å; V533-Q546 WeakPolarHBondContact CG1-O 3.22Å; M534-Q546 PolarHBondContact N-O 3.07Å; M534-Q546 PolarHBondContact O-N 2.81Å; E536-Q546 PolarHBondContact OE2-NE2 3.44Å; V544-Q546 HydrophobicContact CG1-CG 4.39Å
547	A	78.1	Confident	79.6	Confident	14 Å²	14	47.8 Å²	47.8	12%	0.116	30%	0.302	C	S	.	.			trans	-123.9	142.1	-172.8	0	0	0	0	0	110.2	V533 S549 E552	V533-A547 HydrophobicContact CB-CB 4.44Å; V533-A547 HydrophobicContact CG1-CB 4.39Å; V533-A547 HydrophobicContact CG2-CB 3.67Å; A547-S549 WeakPolarHBondContact CB-O 3.21Å; A547-S549 PolarHBondContact O-N 3.19Å; A547-E552 HydrophobicContact CB-CB 4.42Å
548	A	68	Low	80.5	Confident	62 Å²	62	43.8 Å²	43.8	51%	0.512	27%	0.274	S	S	.	.	S	Bend	trans	-65.9	-31.5	171.5	0	0	0	0	0	111.6	N232	N232-A548 PolarHBondContact ND2-O 2.76Å
549	S	75.1	Confident	81.6	Confident	43 Å²	43	40.2 Å²	40.2	30%	0.301	26%	0.255	S	S	.	.	S	Bend	trans	-119.1	131.4	173.1	169.3	0	0	0	0	110.6	A547 D551 E552 G553	A547-S549 WeakPolarHBondContact CB-O 3.21Å; A547-S549 PolarHBondContact O-N 3.19Å; S549-D551 PolarHBondContact O-N 3.41Å; S549-D551 PolarHBondContact OG-N 3.42Å; S549-E552 PolarHBondContact O-N 3.38Å; S549-E552 VanDerWaalsContact O-N 3.12Å; S549-G553 PolarHBondContact O-N 2.92Å
550	P	78.4	Confident	83.1	Confident	36 Å²	36	30.6 Å²	30.6	23%	0.234	21%	0.21	C	C	.	.	H	α-helix	trans	-65	-26.7	179.7	29	-35.4	0	0	0	112.2	M460 E552 G553 A554	M460-P550 HydrophobicContact CB-CB 4.33Å; M460-P550 HydrophobicContact CE-CG 4.14Å; M460-P550 HydrophobicContact CG-CB 3.67Å; M460-P550 HydrophobicContact CG-CG 3.86Å; P550-E552 VanDerWaalsContact C-N 3.33Å; P550-E552 PolarHBondContact O-N 3.34Å; P550-G553 PolarHBondContact O-N 2.56Å; P550-A554 PolarHBondContact O-N 3.33Å
551	D	83.2	Confident	84.5	Confident	29 Å²	29	26.8 Å²	26.8	16%	0.155	17%	0.171	C	C	.	.	H	α-helix	trans	-60.5	-44.3	174	-63.3	15.7	0	0	0	110.1	M460 S549 A554 L555 R649 I703	M460-D551 WeakPolarHBondContact CE-OD1 3.33Å; M460-D551 VanDerWaalsContact CG-OD1 3.29Å; M460-D551 WeakPolarHBondContact CG-OD1 3.49Å; S549-D551 PolarHBondContact O-N 3.41Å; S549-D551 PolarHBondContact OG-N 3.42Å; D551-A554 PolarHBondContact O-N 2.91Å; D551-L555 VanDerWaalsContact O-CG 3.3Å; D551-L555 WeakPolarHBondContact O-CG 3.25Å; D551-L555 PolarHBondContact O-N 3.11Å; D551-L555 VanDerWaalsContact O-N 3.12Å; D551-R649 IonicContact OD1-NH1 3.86Å; D551-R649 PolarHBondContact OD1-NH1 3.42Å; D551-R649 IonicContact OD2-NH1 2.87Å; D551-R649 PolarHBondContact OD2-NH1 2.84Å; D551-I703 HydrophobicContact CB-CD1 4.2Å
552	E	87.1	Confident	85.6	Confident	20 Å²	20	24.2 Å²	24.2	9%	0.093	14%	0.144	C	C	.	.	H	α-helix	trans	-65.9	-43.1	175.5	-61.2	-157.5	141.4	0	0	111.9	T532 V533 A547 S549 P550 A554 L555 V556 M600 K616	T532-E552 PolarHBondContact N-OE2 3.08Å; T532-E552 PolarHBondContact OG1-OE2 3.33Å; V533-E552 HydrophobicContact CG2-CB 3.83Å; A547-E552 HydrophobicContact CB-CB 4.42Å; S549-E552 PolarHBondContact O-N 3.38Å; S549-E552 VanDerWaalsContact O-N 3.12Å; P550-E552 VanDerWaalsContact C-N 3.33Å; P550-E552 PolarHBondContact O-N 3.34Å; E552-A554 VanDerWaalsContact C-N 3.28Å; E552-A554 PolarHBondContact O-N 3.42Å; E552-L555 PolarHBondContact O-N 3.33Å; E552-L555 VanDerWaalsContact O-N 3.16Å; E552-V556 WeakPolarHBondContact O-CG2 3.4Å; E552-V556 PolarHBondContact O-N 3Å; E552-M600 VanDerWaalsContact OE1-SD 3.32Å; E552-K616 WeakPolarHBondContact OE1-CE 3.38Å; E552-K616 IonicContact OE1-NZ 4Å; E552-K616 PolarHBondContact OE1-NZ 2.75Å
553	G	88.8	Confident	86.1	Confident	13 Å²	13	19.6 Å²	19.6	13%	0.134	12%	0.123	C	C	.	.	H	α-helix	trans	-56.2	-43.6	176.6	0	0	0	0	0	112	S549 P550 T557	S549-G553 PolarHBondContact O-N 2.92Å; P550-G553 PolarHBondContact O-N 2.56Å; G553-T557 VanDerWaalsContact O-CB 3.22Å; G553-T557 WeakPolarHBondContact O-CB 3.48Å; G553-T557 PolarHBondContact O-N 2.87Å; G553-T557 PolarHBondContact O-OG1 3.35Å
554	A	90	Very high	86.6	Confident	10 Å²	10	19 Å²	19	8%	0.083	12%	0.12	C	C	.	.	H	α-helix	trans	-64.3	-41.6	176.8	0	0	0	0	0	112.5	M460 P550 D551 E552 A558 I703	M460-A554 HydrophobicContact CB-CB 3.86Å; M460-A554 VanDerWaalsContact O-CB 3.3Å; M460-A554 WeakPolarHBondContact O-CB 3.3Å; P550-A554 PolarHBondContact O-N 3.33Å; D551-A554 PolarHBondContact O-N 2.91Å; E552-A554 VanDerWaalsContact C-N 3.28Å; E552-A554 PolarHBondContact O-N 3.42Å; A554-A558 WeakPolarHBondContact O-CB 3.46Å; A554-A558 PolarHBondContact O-N 2.78Å; A554-I703 HydrophobicContact CB-CG2 4.48Å
555	L	93.8	Very high	87.1	Confident	3 Å²	3	16.9 Å²	16.9	2%	0.016	11%	0.107	C	C	.	.	H	α-helix	trans	-65.5	-46.4	178.5	-71.5	176.2	0	0	0	112.7	F462 L527 D551 E552 T557 A558 A559 L651 T701 I703	F462-L555 HydrophobicContact CD2-CD2 3.96Å; F462-L555 HydrophobicContact CE2-CD2 4.31Å; L527-L555 HydrophobicContact CD1-CD2 4.31Å; L527-L555 HydrophobicContact CD2-CB 4.22Å; L527-L555 HydrophobicContact CD2-CD1 4.19Å; L527-L555 HydrophobicContact CD2-CD2 3.97Å; L527-L555 HydrophobicContact CD2-CG 4.36Å; D551-L555 VanDerWaalsContact O-CG 3.3Å; D551-L555 WeakPolarHBondContact O-CG 3.25Å; D551-L555 PolarHBondContact O-N 3.11Å; D551-L555 VanDerWaalsContact O-N 3.12Å; E552-L555 PolarHBondContact O-N 3.33Å; E552-L555 VanDerWaalsContact O-N 3.16Å; L555-T557 VanDerWaalsContact C-N 3.33Å; L555-A558 WeakPolarHBondContact O-CB 3.15Å; L555-A558 PolarHBondContact O-N 2.88Å; L555-A559 PolarHBondContact O-N 3.17Å; L555-L651 HydrophobicContact CD1-CD1 4.03Å; L555-T701 HydrophobicContact CD2-CG2 3.74Å; L555-I703 HydrophobicContact CD1-CD1 4.25Å; L555-I703 HydrophobicContact CD2-CD1 3.84Å; L555-I703 HydrophobicContact CD2-CG1 4.28Å; L555-I703 HydrophobicContact CG-CD1 3.82Å
556	V	93.4	Very high	87.5	Confident	0 Å²	0	15.4 Å²	15.4	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-69.7	-35.3	179.3	-176.3	0	0	0	0	110.6	H531 V533 Y545 E552 A559 R560 F566	H531-V556 HydrophobicContact CB-CG2 3.95Å; H531-V556 WeakPolarHBondContact CD2-CG2 3.41Å; H531-V556 VanDerWaalsContact CG-CG2 3.49Å; V533-V556 HydrophobicContact CB-CG2 4.08Å; V533-V556 HydrophobicContact CG1-CG1 4.47Å; V533-V556 HydrophobicContact CG2-CB 4.2Å; V533-V556 HydrophobicContact CG2-CG2 3.56Å; Y545-V556 HydrophobicContact CD2-CB 4.34Å; Y545-V556 HydrophobicContact CD2-CG1 3.85Å; Y545-V556 HydrophobicContact CE2-CB 4.4Å; Y545-V556 HydrophobicContact CE2-CG1 3.58Å; E552-V556 WeakPolarHBondContact O-CG2 3.4Å; E552-V556 PolarHBondContact O-N 3Å; V556-A559 PolarHBondContact O-N 2.9Å; V556-R560 WeakPolarHBondContact O-CB 3.43Å; V556-R560 PolarHBondContact O-N 3.01Å; V556-F566 HydrophobicContact CG1-CB 3.99Å
557	T	91.8	Very high	88.1	Confident	25 Å²	25	15 Å²	15	15%	0.153	10%	0.101	C	C	.	.	H	α-helix	trans	-64.6	-40.1	172.5	-58.2	0	0	0	0	111.4	D498 G553 L555 R560 N561	D498-T557 HydrophobicContact CB-CG2 4.11Å; G553-T557 VanDerWaalsContact O-CB 3.22Å; G553-T557 WeakPolarHBondContact O-CB 3.48Å; G553-T557 PolarHBondContact O-N 2.87Å; G553-T557 PolarHBondContact O-OG1 3.35Å; L555-T557 VanDerWaalsContact C-N 3.33Å; T557-R560 WeakPolarHBondContact O-CB 3.45Å; T557-R560 PolarHBondContact O-N 2.81Å; T557-N561 PolarHBondContact O-N 3.47Å; T557-N561 VanDerWaalsContact O-N 3.14Å; T557-N561 PolarHBondContact O-ND2 2.94Å
558	A	92.7	Very high	88.5	Confident	0 Å²	0	17 Å²	17	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-60.5	-52	172.4	0	0	0	0	0	110.7	F462 F501 A554 L555 R560 N561 F562	F462-A558 HydrophobicContact CB-CB 3.75Å; F462-A558 HydrophobicContact CD1-CB 3.91Å; F462-A558 HydrophobicContact CD2-CB 4Å; F462-A558 HydrophobicContact CE1-CB 4.47Å; F462-A558 HydrophobicContact CG-CB 3.62Å; F501-A558 HydrophobicContact CE2-CB 4.14Å; F501-A558 HydrophobicContact CZ-CB 4.05Å; A554-A558 WeakPolarHBondContact O-CB 3.46Å; A554-A558 PolarHBondContact O-N 2.78Å; L555-A558 WeakPolarHBondContact O-CB 3.15Å; L555-A558 PolarHBondContact O-N 2.88Å; A558-R560 VanDerWaalsContact C-N 3.29Å; A558-R560 PolarHBondContact O-N 2.77Å; A558-N561 PolarHBondContact O-N 3.01Å; A558-F562 WeakPolarHBondContact O-CD2 3.09Å; A558-F562 PolarHBondContact O-N 2.81Å; A558-F562 VanDerWaalsContact O-N 3.09Å
559	A	94.3	Very high	89.2	Confident	0 Å²	0	16.4 Å²	16.4	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-54.5	-43.9	178.1	0	0	0	0	0	112.7	F524 L527 L555 V556 N561 F562 G563 F564	F524-A559 HydrophobicContact CD1-CB 4.4Å; L527-A559 HydrophobicContact CB-CB 3.94Å; L555-A559 PolarHBondContact O-N 3.17Å; V556-A559 PolarHBondContact O-N 2.9Å; A559-N561 PolarHBondContact O-N 3.35Å; A559-F562 CarbonylContact O-C 3.54Å; A559-F562 PolarHBondContact O-N 2.85Å; A559-G563 PolarHBondContact O-N 3.39Å; A559-F564 CarbonylContact C-O 3.45Å; A559-F564 HydrophobicContact CB-CB 4.31Å; A559-F564 CarbonylContact O-C 3.36Å; A559-F564 PolarHBondContact O-N 3.06Å
560	R	92.6	Very high	89.4	Confident	12 Å²	12	18 Å²	18	5%	0.045	11%	0.106	C	C	.	.	H	α-helix	trans	-54.4	-48.5	174.3	169.4	-178.1	177.8	-176.5	-4.9	112	N494 H496 L543 Y545 V556 T557 A558 F562 G563 F564 V565	N494-R560 PolarHBondContact ND2-O 3.38Å; H496-R560 PolarHBondContact O-NE 3.16Å; H496-R560 PolarHBondContact O-NH2 3.02Å; L543-R560 PolarHBondContact O-NH1 2.86Å; Y545-R560 HydrophobicContact CE2-CB 3.74Å; Y545-R560 VanDerWaalsContact CE2-CD 3.41Å; Y545-R560 HydrophobicContact CE2-CG 4.15Å; V556-R560 WeakPolarHBondContact O-CB 3.43Å; V556-R560 PolarHBondContact O-N 3.01Å; T557-R560 WeakPolarHBondContact O-CB 3.45Å; T557-R560 PolarHBondContact O-N 2.81Å; A558-R560 VanDerWaalsContact C-N 3.29Å; A558-R560 PolarHBondContact O-N 2.77Å; R560-F562 VanDerWaalsContact C-N 3.34Å; R560-F562 PolarHBondContact O-N 2.98Å; R560-G563 PolarHBondContact O-N 3.2Å; R560-G563 VanDerWaalsContact O-N 3.14Å; R560-F564 VanDerWaalsContact CA-O 3.32Å; R560-F564 WeakPolarHBondContact CA-O 3.47Å; R560-F564 PolarHBondContact N-O 3.13Å; R560-F564 VanDerWaalsContact N-O 3.15Å; R560-V565 HydrophobicContact CG-CG1 4.35Å; R560-V565 HydrophobicContact CG-CG2 4.32Å
561	N	91.2	Very high	89.1	Confident	0 Å²	0	20.6 Å²	20.6	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-65.3	-37.7	-179.2	-75.1	-57.2	0	0	0	112.2	W491 N494 A497 D498 F501 T557 A558 A559 G563	W491-N561 HydrophobicContact CD2-CB 4.29Å; W491-N561 HydrophobicContact CE3-CB 3.94Å; W491-N561 HydrophobicContact CH2-CB 3.98Å; W491-N561 HydrophobicContact CZ2-CB 4.3Å; W491-N561 VanDerWaalsContact CZ3-C 3.48Å; W491-N561 HydrophobicContact CZ3-CB 3.79Å; W491-N561 WeakPolarHBondContact CZ3-O 3.37Å; N494-N561 PolarHBondContact ND2-O 3.44Å; A497-N561 VanDerWaalsContact CA-OD1 3.28Å; A497-N561 WeakPolarHBondContact CA-OD1 3.4Å; A497-N561 WeakPolarHBondContact CB-OD1 3.48Å; D498-N561 PolarHBondContact N-OD1 3.11Å; F501-N561 WeakPolarHBondContact CB-ND2 3.42Å; F501-N561 HydrophobicContact CD1-CB 3.61Å; F501-N561 VanDerWaalsContact CD1-CG 3.48Å; F501-N561 VanDerWaalsContact CD1-ND2 3.31Å; F501-N561 WeakPolarHBondContact CD1-ND2 3.41Å; F501-N561 HydrophobicContact CE1-CB 3.88Å; F501-N561 HydrophobicContact CG-CB 4.29Å; F501-N561 WeakPolarHBondContact CG-ND2 3.39Å; T557-N561 PolarHBondContact O-N 3.47Å; T557-N561 VanDerWaalsContact O-N 3.14Å; T557-N561 PolarHBondContact O-ND2 2.94Å; A558-N561 PolarHBondContact O-N 3.01Å; A559-N561 PolarHBondContact O-N 3.35Å; N561-G563 PolarHBondContact O-N 2.69Å
562	F	91.4	Very high	89	Confident	1 Å²	1	24.4 Å²	24.4	0%	0.004	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.4	6.9	174.6	-70.4	-74.1	0	0	0	114.7	F462 W491 F501 F503 L508 V509 I512 F524 A558 A559 R560	F462-F562 HydrophobicContact CE1-CE2 4.34Å; W491-F562 HydrophobicContact CH2-CD1 4.07Å; W491-F562 HydrophobicContact CH2-CD2 4.49Å; W491-F562 AromaticContact CH2-CE1 3.8Å; W491-F562 HydrophobicContact CH2-CE1 3.8Å; W491-F562 HydrophobicContact CH2-CE2 4.21Å; W491-F562 HydrophobicContact CH2-CG 4.42Å; W491-F562 AromaticContact CH2-CZ 3.87Å; W491-F562 HydrophobicContact CH2-CZ 3.87Å; W491-F562 HydrophobicContact CZ3-CD1 4.21Å; W491-F562 HydrophobicContact CZ3-CE1 4.36Å; F501-F562 HydrophobicContact CE1-CE2 4.24Å; F501-F562 HydrophobicContact CZ-CE2 4.3Å; F503-F562 HydrophobicContact CD1-CE1 4.27Å; F503-F562 AromaticContact CD1-CZ 3.68Å; F503-F562 HydrophobicContact CD1-CZ 3.68Å; F503-F562 HydrophobicContact CD2-CZ 4.41Å; F503-F562 HydrophobicContact CE1-CE1 4.12Å; F503-F562 AromaticContact CE1-CZ 3.55Å; F503-F562 HydrophobicContact CE1-CZ 3.55Å; F503-F562 HydrophobicContact CE2-CZ 4.33Å; F503-F562 HydrophobicContact CG-CZ 4.11Å; F503-F562 AromaticContact CZ-CZ 3.91Å; F503-F562 HydrophobicContact CZ-CZ 3.91Å; L508-F562 HydrophobicContact CD2-CE1 3.92Å; L508-F562 HydrophobicContact CD2-CZ 3.9Å; L508-F562 HydrophobicContact CG-CE1 4.08Å; V509-F562 HydrophobicContact CG2-CD1 4.4Å; V509-F562 HydrophobicContact CG2-CE1 3.81Å; I512-F562 HydrophobicContact CD1-CB 4.1Å; I512-F562 HydrophobicContact CD1-CD1 3.39Å; I512-F562 HydrophobicContact CD1-CE1 4.06Å; I512-F562 HydrophobicContact CD1-CG 3.98Å; F524-F562 HydrophobicContact CD1-CB 3.97Å; F524-F562 AromaticContact CD1-CD2 3.87Å; F524-F562 HydrophobicContact CD1-CD2 3.87Å; F524-F562 HydrophobicContact CD1-CG 4.16Å; F524-F562 HydrophobicContact CD2-CB 4.27Å; F524-F562 HydrophobicContact CD2-CG 4.48Å; F524-F562 HydrophobicContact CE1-CB 4.05Å; F524-F562 AromaticContact CE1-CD2 3.14Å; F524-F562 HydrophobicContact CE1-CD2 3.14Å; F524-F562 AromaticContact CE1-CE2 3.68Å; F524-F562 HydrophobicContact CE1-CE2 3.68Å; F524-F562 AromaticContact CE1-CG 3.71Å; F524-F562 HydrophobicContact CE1-CG 3.71Å; F524-F562 HydrophobicContact CE2-CB 4.38Å; F524-F562 HydrophobicContact CE2-CD1 4.4Å; F524-F562 HydrophobicContact CE2-CD2 4.25Å; F524-F562 HydrophobicContact CE2-CG 4.1Å; F524-F562 HydrophobicContact CG-CB 4.08Å; F524-F562 HydrophobicContact CZ-CB 4.25Å; F524-F562 HydrophobicContact CZ-CD1 4.16Å; F524-F562 AromaticContact CZ-CD2 3.38Å; F524-F562 HydrophobicContact CZ-CD2 3.38Å; F524-F562 HydrophobicContact CZ-CE1 4.34Å; F524-F562 AromaticContact CZ-CE2 3.64Å; F524-F562 HydrophobicContact CZ-CE2 3.64Å; F524-F562 AromaticContact CZ-CG 3.67Å; F524-F562 HydrophobicContact CZ-CG 3.67Å; F524-F562 HydrophobicContact CZ-CZ 4.11Å; A558-F562 WeakPolarHBondContact O-CD2 3.09Å; A558-F562 PolarHBondContact O-N 2.81Å; A558-F562 VanDerWaalsContact O-N 3.09Å; A559-F562 CarbonylContact O-C 3.54Å; A559-F562 PolarHBondContact O-N 2.85Å; R560-F562 VanDerWaalsContact C-N 3.34Å; R560-F562 PolarHBondContact O-N 2.98Å
563	G	89.8	Confident	89.1	Confident	4 Å²	4	25.8 Å²	25.8	4%	0.041	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	95.8	8.6	171.5	0	0	0	0	0	115.1	A559 R560 N561 S577 M579	A559-G563 PolarHBondContact O-N 3.39Å; R560-G563 PolarHBondContact O-N 3.2Å; R560-G563 VanDerWaalsContact O-N 3.14Å; N561-G563 PolarHBondContact O-N 2.69Å; G563-S577 VanDerWaalsContact O-O 3.06Å; G563-M579 WeakPolarHBondContact O-CA 3.38Å; G563-M579 PolarHBondContact O-N 2.8Å
564	F	94	Very high	89.3	Confident	4 Å²	4	25.1 Å²	25.1	2%	0.018	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	87.5	173.4	-66.7	-95.4	0	0	0	109	I512 L521 F524 K525 A559 R560 E578	I512-F564 HydrophobicContact CG2-CE2 4.47Å; L521-F564 HydrophobicContact CB-CZ 4.16Å; L521-F564 HydrophobicContact CD2-CE2 4.2Å; L521-F564 HydrophobicContact CD2-CZ 3.73Å; L521-F564 WeakPolarHBondContact O-CZ 3.35Å; F524-F564 HydrophobicContact CB-CB 4.47Å; F524-F564 HydrophobicContact CB-CD2 3.37Å; F524-F564 HydrophobicContact CB-CE2 3.64Å; F524-F564 HydrophobicContact CB-CG 3.94Å; F524-F564 HydrophobicContact CB-CZ 4.39Å; F524-F564 HydrophobicContact CG-CD2 4.35Å; K525-F564 HydrophobicContact CB-CD1 4.11Å; K525-F564 HydrophobicContact CB-CE1 3.96Å; A559-F564 CarbonylContact C-O 3.45Å; A559-F564 HydrophobicContact CB-CB 4.31Å; A559-F564 CarbonylContact O-C 3.36Å; A559-F564 PolarHBondContact O-N 3.06Å; R560-F564 VanDerWaalsContact CA-O 3.32Å; R560-F564 WeakPolarHBondContact CA-O 3.47Å; R560-F564 PolarHBondContact N-O 3.13Å; R560-F564 VanDerWaalsContact N-O 3.15Å; F564-E578 HydrophobicContact CD1-CB 4.49Å; F564-E578 HydrophobicContact CD1-CG 4.28Å; F564-E578 HydrophobicContact CE1-CB 4.46Å; F564-E578 HydrophobicContact CE1-CG 4.44Å
565	V	93.6	Very high	89.4	Confident	1 Å²	1	25.6 Å²	25.6	1%	0.006	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	121.9	-169.5	-174	0	0	0	0	109.7	H496 L543 R560 L567 I576 S577	H496-V565 HydrophobicContact CB-CG1 4.09Å; H496-V565 HydrophobicContact CB-CG2 3.99Å; L543-V565 HydrophobicContact CD1-CG1 3.67Å; R560-V565 HydrophobicContact CG-CG1 4.35Å; R560-V565 HydrophobicContact CG-CG2 4.32Å; V565-L567 HydrophobicContact CG1-CD2 3.96Å; V565-I576 CarbonylContact O-C 3.58Å; V565-I576 VanDerWaalsContact O-CA 3.22Å; V565-I576 WeakPolarHBondContact O-CA 3.48Å; V565-I576 WeakPolarHBondContact O-CB 3.43Å; V565-S577 PolarHBondContact N-O 2.81Å; V565-S577 PolarHBondContact O-N 3.37Å
566	F	93.7	Very high	89.4	Confident	0 Å²	0	25.5 Å²	25.5	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	123.8	172	170.8	-114	0	0	0	110.1	H531 V533 V535 Y545 V556 S568 R569 I574 I576	H531-F566 AromaticContact CE1-CD1 3.85Å; H531-F566 AromaticContact CE1-CD2 3.8Å; H531-F566 AromaticContact CE1-CE1 3.98Å; H531-F566 AromaticContact CE1-CE2 3.95Å; H531-F566 AromaticContact CE1-CG 3.76Å; H531-F566 AromaticContact NE2-CG 3.97Å; V533-F566 WeakPolarHBondContact O-CE1 3.33Å; V533-F566 WeakPolarHBondContact O-CZ 3.4Å; V535-F566 HydrophobicContact CB-CD1 3.93Å; V535-F566 HydrophobicContact CB-CE1 3.77Å; V535-F566 HydrophobicContact CG1-CD1 3.95Å; V535-F566 HydrophobicContact CG1-CE1 3.53Å; V535-F566 HydrophobicContact CG1-CZ 4.11Å; Y545-F566 HydrophobicContact CD1-CD1 4.39Å; Y545-F566 HydrophobicContact CE1-CB 4.28Å; Y545-F566 HydrophobicContact CE1-CD1 4.04Å; Y545-F566 WeakPolarHBondContact CE1-O 3.33Å; Y545-F566 PolarHBondContact OH-N 3.1Å; Y545-F566 PolarHBondContact OH-O 2.84Å; V556-F566 HydrophobicContact CG1-CB 3.99Å; F566-S568 WeakPolarHBondContact CE2-O 3.43Å; F566-R569 HydrophobicContact CE2-CB 3.83Å; F566-R569 HydrophobicContact CZ-CB 3.61Å; F566-I574 HydrophobicContact CD2-CG2 4.21Å; F566-I574 HydrophobicContact CE2-CG2 4.04Å; F566-I576 HydrophobicContact CD2-CG2 4.26Å
567	L	89.5	Confident	89.4	Confident	39 Å²	39	26.1 Å²	26.1	20%	0.204	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	-43.3	-170.6	-65.3	178.3	0	0	0	113.7	V535 L543 V565 T575 E582	V535-L567 VanDerWaalsContact CG1-C 3.48Å; V535-L567 WeakPolarHBondContact CG1-O 3.29Å; L543-L567 HydrophobicContact CD1-CD2 4.09Å; V565-L567 HydrophobicContact CG1-CD2 3.96Å; L567-T575 HydrophobicContact CB-CG2 4.5Å; L567-T575 HydrophobicContact CD1-CG2 4.39Å; L567-T575 PolarHBondContact N-O 2.83Å; L567-E582 HydrophobicContact CD1-CG 3.83Å
568	S	86.2	Confident	89.4	Confident	55 Å²	55	26.9 Å²	26.9	39%	0.385	15%	0.146	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.9	160.4	176.3	62.6	0	0	0	0	111.6	F566 T575	F566-S568 WeakPolarHBondContact CE2-O 3.43Å; S568-T575 PolarHBondContact N-O 2.86Å; S568-T575 PolarHBondContact O-N 3.4Å
569	R	83	Confident	89.1	Confident	50 Å²	50	29 Å²	29	19%	0.189	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	138	175.9	171	176.6	174.4	162.4	4.5	110	H531 F566 T573 I574 M587	H531-R569 PolarHBondContact O-NH1 3.08Å; F566-R569 HydrophobicContact CE2-CB 3.83Å; F566-R569 HydrophobicContact CZ-CB 3.61Å; R569-T573 WeakPolarHBondContact CA-O 3.29Å; R569-I574 HydrophobicContact CB-CG1 4.42Å; R569-I574 HydrophobicContact CG-CG1 4.06Å; R569-M587 HydrophobicContact CG-CE 4.24Å
570	T	79.4	Confident	88.6	Confident	75 Å²	75	32 Å²	32	46%	0.46	19%	0.188	S	C	.	.			trans	-113.8	-174.3	165.4	71.5	0	0	0	0	109.5	D572 T573	T570-D572 VanDerWaalsContact C-N 3.26Å; T570-D572 PolarHBondContact O-N 3.16Å; T570-D572 PolarHBondContact OG1-N 3.4Å; T570-T573 PolarHBondContact N-O 2.86Å; T570-T573 PolarHBondContact OG1-N 3.29Å; T570-T573 PolarHBondContact OG1-OG1 3.25Å
571	Q	71.6	Confident	88.4	Confident	91 Å²	91	38.2 Å²	38.2	43%	0.425	22%	0.217	S	C	.	.	S	Bend	trans	-65.2	-31.6	172.8	-74.6	-173.7	-11.6	0	0	112.4	N217	N217-Q571 PolarHBondContact ND2-NE2 3.39Å; N217-Q571 PolarHBondContact ND2-OE1 3.23Å
572	D	81.9	Confident	88.5	Confident	110 Å²	110	45.6 Å²	45.6	59%	0.588	25%	0.252	S	S	*	.	S	Bend	trans	-111.8	-10.4	-171.6	-56.8	-43.9	0	0	0	113.3	T570 E586 M587	T570-D572 VanDerWaalsContact C-N 3.26Å; T570-D572 PolarHBondContact O-N 3.16Å; T570-D572 PolarHBondContact OG1-N 3.4Å; D572-E586 CarbonylContact O-C 3.56Å; D572-E586 WeakPolarHBondContact O-CA 3.38Å; D572-M587 PolarHBondContact O-N 3.46Å
573	T	89.4	Confident	88.5	Confident	48 Å²	48	46.4 Å²	46.4	29%	0.294	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	148.9	-176.5	64	0	0	0	0	113.8	R569 T570 T584 Y585	R569-T573 WeakPolarHBondContact CA-O 3.29Å; T570-T573 PolarHBondContact N-O 2.86Å; T570-T573 PolarHBondContact OG1-N 3.29Å; T570-T573 PolarHBondContact OG1-OG1 3.25Å; T573-T584 HydrophobicContact CG2-CG2 4.35Å; T573-Y585 CarbonylContact C-O 3.57Å; T573-Y585 WeakPolarHBondContact CA-O 3.49Å
574	I	92.3	Very high	88.7	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	128.9	170.2	-66	175.4	0	0	0	108.6	L529 F566 R569 I576 T584 Y585 M587 I602 L604	L529-I574 HydrophobicContact CD2-CB 4.41Å; L529-I574 HydrophobicContact CD2-CG2 3.7Å; F566-I574 HydrophobicContact CD2-CG2 4.21Å; F566-I574 HydrophobicContact CE2-CG2 4.04Å; R569-I574 HydrophobicContact CB-CG1 4.42Å; R569-I574 HydrophobicContact CG-CG1 4.06Å; I574-I576 HydrophobicContact CG2-CG2 4.06Å; I574-T584 WeakPolarHBondContact O-CA 3.39Å; I574-Y585 PolarHBondContact N-O 3.13Å; I574-Y585 PolarHBondContact O-N 2.75Å; I574-M587 HydrophobicContact CD1-CE 3.77Å; I574-M587 HydrophobicContact CG1-CE 3.7Å; I574-I602 HydrophobicContact CD1-CD1 3.47Å; I574-I602 VanDerWaalsContact CD1-CD1 3.47Å; I574-L604 HydrophobicContact CD1-CD2 4.4Å
575	T	92	Very high	88.7	Confident	20 Å²	20	49.9 Å²	49.9	12%	0.123	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	126.6	177.3	-56.6	0	0	0	0	110.4	L567 S568 A583 T584	L567-T575 HydrophobicContact CB-CG2 4.5Å; L567-T575 HydrophobicContact CD1-CG2 4.39Å; L567-T575 PolarHBondContact N-O 2.83Å; S568-T575 PolarHBondContact N-O 2.86Å; S568-T575 PolarHBondContact O-N 3.4Å; T575-A583 WeakPolarHBondContact CA-O 3.45Å; T575-T584 PolarHBondContact OG1-OG1 2.64Å; T575-T584 VanDerWaalsContact OG1-OG1 3.06Å
576	I	94.4	Very high	88.8	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	152.7	176.7	65.4	170.7	0	0	0	110.6	K525 S528 L529 V565 F566 I574 E578 E582 A583 Y585	K525-I576 HydrophobicContact CG-CD1 4.37Å; S528-I576 WeakPolarHBondContact OG-CD1 3.4Å; L529-I576 HydrophobicContact CD1-CD1 4.39Å; L529-I576 HydrophobicContact CD2-CD1 3.92Å; L529-I576 HydrophobicContact CD2-CG1 4.36Å; L529-I576 HydrophobicContact CD2-CG2 3.88Å; L529-I576 HydrophobicContact CG-CD1 4.07Å; V565-I576 CarbonylContact O-C 3.58Å; V565-I576 VanDerWaalsContact O-CA 3.22Å; V565-I576 WeakPolarHBondContact O-CA 3.48Å; V565-I576 WeakPolarHBondContact O-CB 3.43Å; F566-I576 HydrophobicContact CD2-CG2 4.26Å; I574-I576 HydrophobicContact CG2-CG2 4.06Å; I576-E578 HydrophobicContact CD1-CG 3.73Å; I576-E578 WeakPolarHBondContact CD1-OE1 3.5Å; I576-E578 HydrophobicContact CG1-CG 3.98Å; I576-E582 WeakPolarHBondContact O-CA 3.42Å; I576-A583 PolarHBondContact N-O 3.36Å; I576-A583 PolarHBondContact O-N 2.86Å; I576-Y585 HydrophobicContact CD1-CE2 3.82Å; I576-Y585 HydrophobicContact CG1-CD2 4.27Å; I576-Y585 HydrophobicContact CG1-CE2 3.71Å
577	S	92.6	Very high	88.7	Confident	14 Å²	14	54.7 Å²	54.7	10%	0.098	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	108.7	167.2	150.8	0	0	0	0	109.4	G563 V565 Q581	G563-S577 VanDerWaalsContact O-O 3.06Å; V565-S577 PolarHBondContact N-O 2.81Å; V565-S577 PolarHBondContact O-N 3.37Å; S577-Q581 CarbonylContact C-O 3.57Å; S577-Q581 WeakPolarHBondContact CA-O 3.43Å
578	E	90.9	Very high	88.8	Confident	40 Å²	40	55.2 Å²	55.2	19%	0.187	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	102.9	175.1	-56.8	-165.8	164.7	0	0	110.6	K525 F564 I576 G580 Q581 A583 Y585	K525-E578 WeakPolarHBondContact CD-OE1 3.3Å; K525-E578 WeakPolarHBondContact CE-OE1 3.39Å; K525-E578 IonicContact NZ-OE1 3.91Å; K525-E578 PolarHBondContact NZ-OE1 2.95Å; K525-E578 IonicContact NZ-OE2 2.83Å; K525-E578 PolarHBondContact NZ-OE2 3.24Å; F564-E578 HydrophobicContact CD1-CB 4.49Å; F564-E578 HydrophobicContact CD1-CG 4.28Å; F564-E578 HydrophobicContact CE1-CB 4.46Å; F564-E578 HydrophobicContact CE1-CG 4.44Å; I576-E578 HydrophobicContact CD1-CG 3.73Å; I576-E578 WeakPolarHBondContact CD1-OE1 3.5Å; I576-E578 HydrophobicContact CG1-CG 3.98Å; E578-G580 PolarHBondContact O-N 2.75Å; E578-G580 VanDerWaalsContact O-N 3.1Å; E578-Q581 PolarHBondContact N-O 3.06Å; E578-Q581 PolarHBondContact O-N 2.91Å; E578-A583 HydrophobicContact CG-CB 4.46Å; E578-Y585 PolarHBondContact OE1-OH 3.29Å
579	M	86.8	Confident	89	Confident	45 Å²	45	53.3 Å²	53.3	22%	0.222	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	51.9	36.3	179	-60.4	-66.3	-74.7	0	0	113	W493 I512 G563	W493-M579 HydrophobicContact CZ3-CE 4.14Å; W493-M579 HydrophobicContact CZ3-SD 4.41Å; I512-M579 HydrophobicContact CG2-CE 4.25Å; I512-M579 HydrophobicContact CG2-SD 4.09Å; G563-M579 WeakPolarHBondContact O-CA 3.38Å; G563-M579 PolarHBondContact O-N 2.8Å
580	G	84.3	Confident	89.2	Confident	64 Å²	64	52.8 Å²	52.8	66%	0.66	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	92.1	1	-179.3	0	0	0	0	0	115.7	E578	E578-G580 PolarHBondContact O-N 2.75Å; E578-G580 VanDerWaalsContact O-N 3.1Å
581	Q	89.3	Confident	89.8	Confident	142 Å²	142	49.2 Å²	49.2	66%	0.664	27%	0.271	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.1	123.7	174.2	-66.6	-177.7	-5.3	0	0	110.6	S577 E578	S577-Q581 CarbonylContact C-O 3.57Å; S577-Q581 WeakPolarHBondContact CA-O 3.43Å; E578-Q581 PolarHBondContact N-O 3.06Å; E578-Q581 PolarHBondContact O-N 2.91Å
582	E	92.3	Very high	90.3	Very high	154 Å²	154	48.9 Å²	48.9	72%	0.72	27%	0.272	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.9	129.5	177.3	-66.1	-174.8	174.2	0	0	111.4	L567 I576	L567-E582 HydrophobicContact CD1-CG 3.83Å; I576-E582 WeakPolarHBondContact O-CA 3.42Å
583	A	92.6	Very high	90.4	Very high	19 Å²	19	49.1 Å²	49.1	16%	0.157	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	133.5	175.5	0	0	0	0	0	109.4	T575 I576 E578 Y585	T575-A583 WeakPolarHBondContact CA-O 3.45Å; I576-A583 PolarHBondContact N-O 3.36Å; I576-A583 PolarHBondContact O-N 2.86Å; E578-A583 HydrophobicContact CG-CB 4.46Å; A583-Y585 HydrophobicContact CB-CE2 3.73Å
584	T	93.9	Very high	89.5	Confident	73 Å²	73	49.2 Å²	49.2	45%	0.448	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	130.7	177.5	-59.8	0	0	0	0	109.8	T573 I574 T575 P607	T573-T584 HydrophobicContact CG2-CG2 4.35Å; I574-T584 WeakPolarHBondContact O-CA 3.39Å; T575-T584 PolarHBondContact OG1-OG1 2.64Å; T575-T584 VanDerWaalsContact OG1-OG1 3.06Å; T584-P607 WeakPolarHBondContact O-CG 3.25Å
585	Y	93.9	Very high	88.3	Confident	8 Å²	8	53 Å²	53	3%	0.031	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	135.8	-177.9	-64.6	-88	0	0	0	109.6	L529 T573 I574 I576 E578 A583 F606	L529-Y585 HydrophobicContact CD1-CD2 4.44Å; L529-Y585 HydrophobicContact CD1-CE1 4.48Å; L529-Y585 HydrophobicContact CD1-CE2 4.38Å; L529-Y585 HydrophobicContact CD2-CD2 3.69Å; L529-Y585 HydrophobicContact CD2-CE2 4.14Å; L529-Y585 HydrophobicContact CD2-CG 4.12Å; T573-Y585 CarbonylContact C-O 3.57Å; T573-Y585 WeakPolarHBondContact CA-O 3.49Å; I574-Y585 PolarHBondContact N-O 3.13Å; I574-Y585 PolarHBondContact O-N 2.75Å; I576-Y585 HydrophobicContact CD1-CE2 3.82Å; I576-Y585 HydrophobicContact CG1-CD2 4.27Å; I576-Y585 HydrophobicContact CG1-CE2 3.71Å; E578-Y585 PolarHBondContact OE1-OH 3.29Å; A583-Y585 HydrophobicContact CB-CE2 3.73Å; Y585-F606 HydrophobicContact CD1-CD1 4.25Å; Y585-F606 HydrophobicContact CD1-CD2 4.22Å; Y585-F606 HydrophobicContact CD1-CE1 4.36Å; Y585-F606 HydrophobicContact CD1-CE2 4.31Å; Y585-F606 HydrophobicContact CD1-CG 4.13Å; Y585-F606 HydrophobicContact CD1-CZ 4.37Å; Y585-F606 HydrophobicContact CE1-CB 4.46Å; Y585-F606 AromaticContact CE1-CD1 3.53Å; Y585-F606 HydrophobicContact CE1-CD1 3.53Å; Y585-F606 HydrophobicContact CE1-CD2 4.27Å; Y585-F606 AromaticContact CE1-CE1 3.55Å; Y585-F606 HydrophobicContact CE1-CE1 3.55Å; Y585-F606 HydrophobicContact CE1-CE2 4.28Å; Y585-F606 AromaticContact CE1-CG 3.86Å; Y585-F606 HydrophobicContact CE1-CG 3.86Å; Y585-F606 AromaticContact CE1-CZ 3.93Å; Y585-F606 HydrophobicContact CE1-CZ 3.93Å
586	E	94.3	Very high	87.1	Confident	85 Å²	85	56.4 Å²	56.4	40%	0.397	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	121	174.3	-177.8	-175.2	176.7	0	0	108.7	D572 L588 L604 K605	D572-E586 CarbonylContact O-C 3.56Å; D572-E586 WeakPolarHBondContact O-CA 3.38Å; E586-L588 HydrophobicContact CG-CD2 4.26Å; E586-L604 CarbonylContact O-C 3.54Å; E586-L604 WeakPolarHBondContact O-CA 3.45Å; E586-K605 HydrophobicContact CB-CB 4.19Å; E586-K605 PolarHBondContact N-O 2.99Å; E586-K605 PolarHBondContact O-N 3.47Å; E586-K605 IonicContact OE1-NZ 2.71Å; E586-K605 WeakPolarHBondContact OE2-CD 3.46Å; E586-K605 WeakPolarHBondContact OE2-CE 3.41Å; E586-K605 IonicContact OE2-NZ 2.67Å; E586-K605 PolarHBondContact OE2-NZ 3.34Å
587	M	91.8	Very high	86.5	Confident	16 Å²	16	56.9 Å²	56.9	8%	0.079	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	111.3	178.3	-171.6	-169.2	-37.1	0	0	109.8	R569 D572 I574 L590 I602 L604	R569-M587 HydrophobicContact CG-CE 4.24Å; D572-M587 PolarHBondContact O-N 3.46Å; I574-M587 HydrophobicContact CD1-CE 3.77Å; I574-M587 HydrophobicContact CG1-CE 3.7Å; M587-L590 HydrophobicContact SD-CB 4.17Å; M587-I602 HydrophobicContact CG-CD1 4.16Å; M587-I602 HydrophobicContact CG-CG1 4.27Å; M587-I602 HydrophobicContact SD-CD1 4.37Å; M587-L604 HydrophobicContact CB-CD2 4.08Å; M587-L604 HydrophobicContact CG-CD2 4.23Å
588	L	91.6	Very high	86.1	Confident	50 Å²	50	59.3 Å²	59.3	26%	0.262	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	-38.2	-179.4	-63.2	-177.9	0	0	0	112.3	E586 I603 K605 I611 F663	E586-L588 HydrophobicContact CG-CD2 4.26Å; L588-I603 HydrophobicContact CB-CB 4.41Å; L588-I603 HydrophobicContact CB-CG2 4.15Å; L588-I603 HydrophobicContact CD1-CG2 4.2Å; L588-I603 PolarHBondContact N-O 2.86Å; L588-K605 HydrophobicContact CD1-CB 3.95Å; L588-K605 HydrophobicContact CD2-CB 4.36Å; L588-K605 HydrophobicContact CG-CB 4.09Å; L588-I611 HydrophobicContact CD1-CD1 4.03Å; L588-I611 HydrophobicContact CD1-CG1 4.14Å; L588-I611 HydrophobicContact CD1-CG2 3.9Å; L588-F663 HydrophobicContact CB-CE1 4.21Å; L588-F663 HydrophobicContact CB-CE2 3.92Å; L588-F663 HydrophobicContact CB-CZ 3.54Å; L588-F663 HydrophobicContact CD1-CD1 4.08Å; L588-F663 HydrophobicContact CD1-CD2 4.41Å; L588-F663 HydrophobicContact CD1-CE1 3.79Å; L588-F663 HydrophobicContact CD1-CE2 4.15Å; L588-F663 HydrophobicContact CD1-CG 4.4Å; L588-F663 HydrophobicContact CD1-CZ 3.85Å; L588-F663 HydrophobicContact CD2-CE1 4.49Å; L588-F663 HydrophobicContact CG-CE1 4.41Å; L588-F663 HydrophobicContact CG-CZ 4.21Å
589	A	90	Very high	86.1	Confident	15 Å²	15	57.6 Å²	57.6	12%	0.124	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.8	143.8	175.9	0	0	0	0	0	111.1	L591 I603 W666	A589-L591 HydrophobicContact CB-CD1 4.17Å; A589-I603 HydrophobicContact CB-CB 4.27Å; A589-I603 HydrophobicContact CB-CD1 4.16Å; A589-I603 HydrophobicContact CB-CG1 4.33Å; A589-I603 PolarHBondContact N-O 2.88Å; A589-I603 PolarHBondContact O-N 2.66Å; A589-W666 HydrophobicContact CB-CH2 3.78Å; A589-W666 HydrophobicContact CB-CZ3 3.81Å
590	L	88.9	Confident	86.3	Confident	39 Å²	39	55.6 Å²	55.6	20%	0.204	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	120.7	169.5	-171.4	74.6	0	0	0	108.1	M587 D592 M600 I602	M587-L590 HydrophobicContact SD-CB 4.17Å; L590-D592 WeakPolarHBondContact CD2-OD1 3.35Å; L590-M600 HydrophobicContact CD1-CE 3.6Å; L590-M600 HydrophobicContact CD2-CE 4.48Å; L590-M600 HydrophobicContact CG-CE 4.17Å; L590-I602 HydrophobicContact CD1-CB 4.22Å; L590-I602 HydrophobicContact CD1-CD1 3.93Å; L590-I602 HydrophobicContact CD1-CG1 3.97Å
591	L	90.8	Very high	86.9	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	94.6	173	-66.3	71.6	0	0	0	106.5	A589 S601 I603 W666 Y688 I691 E692	A589-L591 HydrophobicContact CB-CD1 4.17Å; L591-S601 PolarHBondContact N-O 3.37Å; L591-S601 PolarHBondContact O-N 3Å; L591-I603 HydrophobicContact CD1-CD1 4.2Å; L591-I603 HydrophobicContact CD1-CG1 4.22Å; L591-W666 HydrophobicContact CD1-CH2 4.11Å; L591-W666 HydrophobicContact CD1-CZ2 4.31Å; L591-W666 HydrophobicContact CD2-CZ2 4.37Å; L591-Y688 HydrophobicContact CD2-CD1 3.38Å; L591-Y688 HydrophobicContact CD2-CD2 4.47Å; L591-Y688 HydrophobicContact CD2-CE1 4.05Å; L591-Y688 HydrophobicContact CD2-CG 3.62Å; L591-Y688 HydrophobicContact CG-CD1 3.62Å; L591-Y688 HydrophobicContact CG-CE1 3.75Å; L591-Y688 HydrophobicContact CG-CG 4.06Å; L591-I691 HydrophobicContact CD2-CG2 4.09Å; L591-E692 HydrophobicContact CD2-CG 4.42Å
592	D	83.4	Confident	87.1	Confident	84 Å²	84	45.8 Å²	45.8	45%	0.449	24%	0.24	S	C	.	.			trans	-57.3	156.4	-175.1	-77.7	-38	0	0	0	112.8	L590 N594 R597	L590-D592 WeakPolarHBondContact CD2-OD1 3.35Å; D592-N594 PolarHBondContact O-N 2.91Å; D592-R597 PolarHBondContact O-NH1 3.41Å
593	F	82.6	Confident	87.3	Confident	116 Å²	116	38.4 Å²	38.4	51%	0.509	21%	0.205	S	C	.	.			trans	-65.2	124.6	172.8	177.4	-92.2	0	0	0	109.6	M600	F593-M600 HydrophobicContact CB-CB 4.26Å
594	N	71.1	Confident	87.4	Confident	50 Å²	50	37.5 Å²	37.5	27%	0.267	20%	0.198	S	C	.	.			trans	-114.4	141.9	164.8	-174.5	0.7	0	0	0	108.7	D592 D596 R597 K598	D592-N594 PolarHBondContact O-N 2.91Å; N594-D596 PolarHBondContact ND2-OD2 3Å; N594-D596 PolarHBondContact O-N 2.99Å; N594-D596 PolarHBondContact OD1-N 2.91Å; N594-D596 PolarHBondContact OD1-OD2 3.42Å; N594-R597 HydrophobicContact CB-CB 4.19Å; N594-R597 HydrophobicContact CB-CG 4.34Å; N594-R597 PolarHBondContact O-N 2.94Å; N594-K598 PolarHBondContact O-N 3.12Å
595	S	66.4	Low	87.4	Confident	78 Å²	78	37.7 Å²	37.7	55%	0.545	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.4	-33.4	174.2	-69.7	0	0	0	0	112.7	K598	S595-K598 WeakPolarHBondContact O-CG 3.21Å
596	D	67.1	Low	87.4	Confident	92 Å²	92	37.8 Å²	37.8	49%	0.492	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.5	-45.3	-179.8	-49.9	-35.3	0	0	0	110.4	N594 K598	N594-D596 PolarHBondContact ND2-OD2 3Å; N594-D596 PolarHBondContact O-N 2.99Å; N594-D596 PolarHBondContact OD1-N 2.91Å; N594-D596 PolarHBondContact OD1-OD2 3.42Å; D596-K598 PolarHBondContact O-N 3.25Å
597	R	82.3	Confident	87.1	Confident	11 Å²	11	38.3 Å²	38.3	4%	0.042	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-28.1	178	-71	177.6	52.6	-127.2	-5.4	113.7	D592 N594 R599 V621 D685 E692	D592-R597 PolarHBondContact O-NH1 3.41Å; N594-R597 HydrophobicContact CB-CB 4.19Å; N594-R597 HydrophobicContact CB-CG 4.34Å; N594-R597 PolarHBondContact O-N 2.94Å; R597-R599 HydrophobicContact CB-CG 4.32Å; R597-R599 WeakPolarHBondContact O-CG 3.28Å; R597-R599 PolarHBondContact O-N 3.45Å; R597-R599 VanDerWaalsContact O-N 3.11Å; R597-R599 PolarHBondContact O-NH1 2.9Å; R597-V621 WeakPolarHBondContact O-CG1 3.49Å; R597-D685 WeakPolarHBondContact CD-OD1 3.39Å; R597-E692 IonicContact CZ-OE1 3.74Å; R597-E692 IonicContact NE-OE2 3.92Å; R597-E692 IonicContact NH2-OE1 3.8Å; R597-E692 PolarHBondContact NH2-OE1 3.4Å; R597-E692 IonicContact NH2-OE2 2.69Å; R597-E692 PolarHBondContact NH2-OE2 3.32Å
598	K	83.6	Confident	86.9	Confident	65 Å²	65	42.4 Å²	42.4	28%	0.283	23%	0.226	S	C	.	.			trans	51.5	27.8	-179	-52.1	173.8	-170.1	164	0	114.9	N594 S595 D596 G617 A618 V621	N594-K598 PolarHBondContact O-N 3.12Å; S595-K598 WeakPolarHBondContact O-CG 3.21Å; D596-K598 PolarHBondContact O-N 3.25Å; K598-G617 WeakPolarHBondContact O-CA 3.44Å; K598-A618 HydrophobicContact CB-CB 4.33Å; K598-A618 PolarHBondContact O-N 3.1Å; K598-A618 VanDerWaalsContact O-N 3.14Å; K598-V621 HydrophobicContact CB-CG2 4Å; K598-V621 HydrophobicContact CD-CG2 3.89Å; K598-V621 HydrophobicContact CG-CG2 4.46Å
599	R	90.9	Very high	86.7	Confident	4 Å²	4	42.3 Å²	42.3	2%	0.015	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	156.4	-178.4	68.3	-163	177.8	-96.8	4.2	110.2	R597 K616 I622 E689 E692	R597-R599 HydrophobicContact CB-CG 4.32Å; R597-R599 WeakPolarHBondContact O-CG 3.28Å; R597-R599 PolarHBondContact O-N 3.45Å; R597-R599 VanDerWaalsContact O-N 3.11Å; R597-R599 PolarHBondContact O-NH1 2.9Å; R599-K616 CarbonylContact C-O 3.58Å; R599-K616 VanDerWaalsContact CA-O 3.28Å; R599-K616 WeakPolarHBondContact CA-O 3.43Å; R599-I622 HydrophobicContact CB-CD1 4.4Å; R599-E689 IonicContact CZ-OE2 2.86Å; R599-E689 IonicContact NH1-OE2 2.86Å; R599-E689 IonicContact NH2-OE1 2.78Å; R599-E689 IonicContact NH2-OE2 3.29Å; R599-E689 PolarHBondContact NH2-OE2 3.24Å; R599-E692 IonicContact CZ-OE2 2.74Å; R599-E692 IonicContact NE-OE1 3.74Å; R599-E692 IonicContact NE-OE2 3.76Å; R599-E692 PolarHBondContact NE-OE2 3.07Å; R599-E692 IonicContact NH2-OE2 2.61Å; R599-E692 PolarHBondContact NH2-OE2 2.95Å
600	M	92.4	Very high	86.8	Confident	2 Å²	2	45.6 Å²	45.6	1%	0.01	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	136.9	174.4	-173.5	-168.9	-168.1	0	0	108.3	T532 E552 L590 F593 C615 K616	T532-M600 HydrophobicContact CG2-CE 3.36Å; T532-M600 HydrophobicContact CG2-SD 4.45Å; E552-M600 VanDerWaalsContact OE1-SD 3.32Å; L590-M600 HydrophobicContact CD1-CE 3.6Å; L590-M600 HydrophobicContact CD2-CE 4.48Å; L590-M600 HydrophobicContact CG-CE 4.17Å; F593-M600 HydrophobicContact CB-CB 4.26Å; M600-C615 WeakPolarHBondContact O-CA 3.3Å; M600-K616 HydrophobicContact CB-CG 4.25Å; M600-K616 PolarHBondContact N-O 2.87Å; M600-K616 PolarHBondContact O-N 2.98Å
601	S	95	Very high	87.1	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	147.5	176.9	-56.9	0	0	0	0	111.5	L591 Y614 C615 E692	L591-S601 PolarHBondContact N-O 3.37Å; L591-S601 PolarHBondContact O-N 3Å; S601-Y614 CarbonylContact C-O 3.54Å; S601-Y614 WeakPolarHBondContact CA-O 3.2Å; S601-C615 WeakPolarHBondContact OG-CB 3.3Å; S601-C615 PolarHBondContact OG-SG 3.46Å; S601-C615 VanDerWaalsContact OG-SG 3.33Å; S601-E692 WeakPolarHBondContact CB-OE1 3.44Å; S601-E692 PolarHBondContact OG-OE1 3.49Å
602	I	94.8	Very high	87.4	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	137.3	172.4	-165.9	170.5	0	0	0	109.3	L529 C530 I574 M587 L590 L604 L613 Y614	L529-I602 WeakPolarHBondContact O-CD1 3.36Å; C530-I602 HydrophobicContact CB-CG2 3.7Å; I574-I602 HydrophobicContact CD1-CD1 3.47Å; I574-I602 VanDerWaalsContact CD1-CD1 3.47Å; M587-I602 HydrophobicContact CG-CD1 4.16Å; M587-I602 HydrophobicContact CG-CG1 4.27Å; M587-I602 HydrophobicContact SD-CD1 4.37Å; L590-I602 HydrophobicContact CD1-CB 4.22Å; L590-I602 HydrophobicContact CD1-CD1 3.93Å; L590-I602 HydrophobicContact CD1-CG1 3.97Å; I602-L604 HydrophobicContact CD1-CD1 4.48Å; I602-L604 HydrophobicContact CD1-CD2 3.74Å; I602-L604 HydrophobicContact CD1-CG 4.24Å; I602-L604 HydrophobicContact CG1-CD2 3.85Å; I602-L604 HydrophobicContact CG1-CG 4.07Å; I602-L604 HydrophobicContact CG2-CD1 4.27Å; I602-L604 HydrophobicContact CG2-CG 4.27Å; I602-L613 WeakPolarHBondContact O-CA 3.37Å; I602-Y614 HydrophobicContact CG2-CD2 4.44Å; I602-Y614 PolarHBondContact N-O 3.23Å; I602-Y614 PolarHBondContact O-N 3.26Å
603	I	95.4	Very high	88	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	117.5	175.8	-52.9	-177.3	0	0	0	108	L588 A589 L591 I611 L613 F663 W666 I691	L588-I603 HydrophobicContact CB-CB 4.41Å; L588-I603 HydrophobicContact CB-CG2 4.15Å; L588-I603 HydrophobicContact CD1-CG2 4.2Å; L588-I603 PolarHBondContact N-O 2.86Å; A589-I603 HydrophobicContact CB-CB 4.27Å; A589-I603 HydrophobicContact CB-CD1 4.16Å; A589-I603 HydrophobicContact CB-CG1 4.33Å; A589-I603 PolarHBondContact N-O 2.88Å; A589-I603 PolarHBondContact O-N 2.66Å; L591-I603 HydrophobicContact CD1-CD1 4.2Å; L591-I603 HydrophobicContact CD1-CG1 4.22Å; I603-I611 HydrophobicContact CG2-CG2 3.7Å; I603-L613 HydrophobicContact CD1-CD1 4.18Å; I603-L613 HydrophobicContact CG1-CB 4.31Å; I603-L613 HydrophobicContact CG1-CD1 3.96Å; I603-L613 HydrophobicContact CG1-CG 4.32Å; I603-F663 HydrophobicContact CD1-CD2 4.31Å; I603-F663 HydrophobicContact CD1-CE2 4.12Å; I603-F663 HydrophobicContact CG2-CD2 4Å; I603-F663 HydrophobicContact CG2-CE2 3.94Å; I603-W666 HydrophobicContact CD1-CE3 4.29Å; I603-W666 HydrophobicContact CD1-CH2 4.03Å; I603-W666 HydrophobicContact CD1-CZ3 3.91Å; I603-I691 HydrophobicContact CD1-CD1 3.6Å
604	L	94.9	Very high	88.6	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	141.5	-176.3	-62.6	177.5	0	0	0	110.8	L529 I574 E586 M587 I602 F606 I611 R612 Y614	L529-L604 HydrophobicContact CB-CD1 3.84Å; L529-L604 HydrophobicContact CD1-CD1 3.8Å; L529-L604 HydrophobicContact CD2-CD1 4.06Å; L529-L604 HydrophobicContact CG-CD1 4.11Å; I574-L604 HydrophobicContact CD1-CD2 4.4Å; E586-L604 CarbonylContact O-C 3.54Å; E586-L604 WeakPolarHBondContact O-CA 3.45Å; M587-L604 HydrophobicContact CB-CD2 4.08Å; M587-L604 HydrophobicContact CG-CD2 4.23Å; I602-L604 HydrophobicContact CD1-CD1 4.48Å; I602-L604 HydrophobicContact CD1-CD2 3.74Å; I602-L604 HydrophobicContact CD1-CG 4.24Å; I602-L604 HydrophobicContact CG1-CD2 3.85Å; I602-L604 HydrophobicContact CG1-CG 4.07Å; I602-L604 HydrophobicContact CG2-CD1 4.27Å; I602-L604 HydrophobicContact CG2-CG 4.27Å; L604-F606 HydrophobicContact CB-CE2 4.3Å; L604-I611 WeakPolarHBondContact O-CA 3.36Å; L604-R612 PolarHBondContact N-O 3.46Å; L604-R612 PolarHBondContact O-N 3.43Å; L604-Y614 HydrophobicContact CD1-CD2 4.2Å; L604-Y614 HydrophobicContact CD1-CE2 4.4Å
605	K	94.7	Very high	89.8	Confident	76 Å²	76	34 Å²	34	33%	0.33	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	122.4	166.1	177.9	170.1	155.1	-130.9	0	108.9	E586 L588 R610 I611	E586-K605 HydrophobicContact CB-CB 4.19Å; E586-K605 PolarHBondContact N-O 2.99Å; E586-K605 PolarHBondContact O-N 3.47Å; E586-K605 IonicContact OE1-NZ 2.71Å; E586-K605 WeakPolarHBondContact OE2-CD 3.46Å; E586-K605 WeakPolarHBondContact OE2-CE 3.41Å; E586-K605 IonicContact OE2-NZ 2.67Å; E586-K605 PolarHBondContact OE2-NZ 3.34Å; L588-K605 HydrophobicContact CD1-CB 3.95Å; L588-K605 HydrophobicContact CD2-CB 4.36Å; L588-K605 HydrophobicContact CG-CB 4.09Å; K605-R610 WeakPolarHBondContact CA-O 3.35Å; K605-I611 HydrophobicContact CB-CG1 4.35Å; K605-I611 HydrophobicContact CG-CG1 4.39Å
606	F	92.6	Very high	91.2	Very high	11 Å²	11	30.9 Å²	30.9	5%	0.048	16%	0.164	C	C	.	.			trans	-82.1	162.1	-174.5	-79	-121.9	0	0	0	110.9	K525 Y585 L604 D608 G609 R610 R612 Y614	K525-F606 HydrophobicContact CD-CE1 4.47Å; Y585-F606 HydrophobicContact CD1-CD1 4.25Å; Y585-F606 HydrophobicContact CD1-CD2 4.22Å; Y585-F606 HydrophobicContact CD1-CE1 4.36Å; Y585-F606 HydrophobicContact CD1-CE2 4.31Å; Y585-F606 HydrophobicContact CD1-CG 4.13Å; Y585-F606 HydrophobicContact CD1-CZ 4.37Å; Y585-F606 HydrophobicContact CE1-CB 4.46Å; Y585-F606 AromaticContact CE1-CD1 3.53Å; Y585-F606 HydrophobicContact CE1-CD1 3.53Å; Y585-F606 HydrophobicContact CE1-CD2 4.27Å; Y585-F606 AromaticContact CE1-CE1 3.55Å; Y585-F606 HydrophobicContact CE1-CE1 3.55Å; Y585-F606 HydrophobicContact CE1-CE2 4.28Å; Y585-F606 AromaticContact CE1-CG 3.86Å; Y585-F606 HydrophobicContact CE1-CG 3.86Å; Y585-F606 AromaticContact CE1-CZ 3.93Å; Y585-F606 HydrophobicContact CE1-CZ 3.93Å; L604-F606 HydrophobicContact CB-CE2 4.3Å; F606-D608 WeakPolarHBondContact CB-OD1 3.46Å; F606-D608 PolarHBondContact O-N 2.89Å; F606-D608 VanDerWaalsContact O-N 3.15Å; F606-G609 PolarHBondContact O-N 3.01Å; F606-R610 HydrophobicContact CB-CG 3.84Å; F606-R610 HydrophobicContact CD1-CG 4.36Å; F606-R610 HydrophobicContact CD2-CG 3.96Å; F606-R610 HydrophobicContact CG-CG 3.77Å; F606-R610 PolarHBondContact N-O 2.8Å; F606-R612 HydrophobicContact CD2-CB 4.3Å; F606-R612 HydrophobicContact CE2-CB 3.72Å; F606-R612 HydrophobicContact CE2-CG 4.47Å; F606-R612 HydrophobicContact CZ-CB 4.45Å; F606-Y614 HydrophobicContact CE2-CE2 4.26Å; F606-Y614 AromaticContact CZ-CE2 3.9Å; F606-Y614 HydrophobicContact CZ-CE2 3.9Å; F606-Y614 WeakPolarHBondContact CZ-OH 3.37Å
607	P	88.7	Confident	92.3	Very high	95 Å²	95	26.6 Å²	26.6	62%	0.617	14%	0.142	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57	-26	172.3	-25.6	34.2	0	0	0	114.4	T584 G609	T584-P607 WeakPolarHBondContact O-CG 3.25Å; P607-G609 VanDerWaalsContact C-N 3.26Å; P607-G609 PolarHBondContact O-N 3.29Å
608	D	88.4	Confident	92.6	Very high	103 Å²	103	27 Å²	27	55%	0.551	15%	0.147	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.9	-0.5	176.5	64.4	4	0	0	0	113.4	F606 R610	F606-D608 WeakPolarHBondContact CB-OD1 3.46Å; F606-D608 PolarHBondContact O-N 2.89Å; F606-D608 VanDerWaalsContact O-N 3.15Å; D608-R610 WeakPolarHBondContact OD1-CD 3.49Å; D608-R610 VanDerWaalsContact OD1-CG 3.22Å; D608-R610 WeakPolarHBondContact OD1-CG 3.33Å; D608-R610 PolarHBondContact OD1-N 3.15Å; D608-R610 VanDerWaalsContact OD1-N 3.12Å; D608-R610 IonicContact OD1-NE 3.26Å; D608-R610 VanDerWaalsContact OD2-CD 3.31Å; D608-R610 WeakPolarHBondContact OD2-CD 3.45Å; D608-R610 IonicContact OD2-CZ 3.55Å; D608-R610 IonicContact OD2-NE 2.96Å; D608-R610 IonicContact OD2-NH1 3.43Å; D608-R610 PolarHBondContact OD2-NH1 3.23Å
609	G	86.4	Confident	92.7	Very high	48 Å²	48	25.9 Å²	25.9	50%	0.495	15%	0.145	S	C	.	.	S	Bend	trans	87.3	-3.5	178.9	0	0	0	0	0	115	F606 P607	F606-G609 PolarHBondContact O-N 3.01Å; P607-G609 VanDerWaalsContact C-N 3.26Å; P607-G609 PolarHBondContact O-N 3.29Å
610	R	93.4	Very high	92.4	Very high	84 Å²	84	29.9 Å²	29.9	32%	0.317	17%	0.169	S	C	.	.			trans	-75.4	144.4	177.4	85.7	-163.2	178.9	-158.3	17.8	111.1	K605 F606 D608	K605-R610 WeakPolarHBondContact CA-O 3.35Å; F606-R610 HydrophobicContact CB-CG 3.84Å; F606-R610 HydrophobicContact CD1-CG 4.36Å; F606-R610 HydrophobicContact CD2-CG 3.96Å; F606-R610 HydrophobicContact CG-CG 3.77Å; F606-R610 PolarHBondContact N-O 2.8Å; D608-R610 WeakPolarHBondContact OD1-CD 3.49Å; D608-R610 VanDerWaalsContact OD1-CG 3.22Å; D608-R610 WeakPolarHBondContact OD1-CG 3.33Å; D608-R610 PolarHBondContact OD1-N 3.15Å; D608-R610 VanDerWaalsContact OD1-N 3.12Å; D608-R610 IonicContact OD1-NE 3.26Å; D608-R610 VanDerWaalsContact OD2-CD 3.31Å; D608-R610 WeakPolarHBondContact OD2-CD 3.45Å; D608-R610 IonicContact OD2-CZ 3.55Å; D608-R610 IonicContact OD2-NE 2.96Å; D608-R610 IonicContact OD2-NH1 3.43Å; D608-R610 PolarHBondContact OD2-NH1 3.23Å
611	I	95.2	Very high	92.2	Very high	19 Å²	19	30.4 Å²	30.4	10%	0.097	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	124.2	173.8	-57.6	173.7	0	0	0	108	L588 I603 L604 K605 I658 A660 F663	L588-I611 HydrophobicContact CD1-CD1 4.03Å; L588-I611 HydrophobicContact CD1-CG1 4.14Å; L588-I611 HydrophobicContact CD1-CG2 3.9Å; I603-I611 HydrophobicContact CG2-CG2 3.7Å; L604-I611 WeakPolarHBondContact O-CA 3.36Å; K605-I611 HydrophobicContact CB-CG1 4.35Å; K605-I611 HydrophobicContact CG-CG1 4.39Å; I611-I658 HydrophobicContact CG2-CB 4.24Å; I611-I658 PolarHBondContact O-N 3.23Å; I611-A660 HydrophobicContact CD1-CB 4.44Å; I611-F663 HydrophobicContact CD1-CB 4.22Å; I611-F663 HydrophobicContact CD1-CD1 4.38Å; I611-F663 HydrophobicContact CD1-CG 4.38Å
612	R	95.3	Very high	92	Very high	26 Å²	26	30.4 Å²	30.4	10%	0.098	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	134.3	-179.4	179.1	169.2	-70.7	-177.2	-5.4	109.9	E522 L604 F606 Y614 Y655 D657	E522-R612 IonicContact OE1-CZ 3.98Å; E522-R612 IonicContact OE1-NH1 3.69Å; E522-R612 PolarHBondContact OE1-NH1 3.41Å; E522-R612 IonicContact OE2-NH1 2.82Å; L604-R612 PolarHBondContact N-O 3.46Å; L604-R612 PolarHBondContact O-N 3.43Å; F606-R612 HydrophobicContact CD2-CB 4.3Å; F606-R612 HydrophobicContact CE2-CB 3.72Å; F606-R612 HydrophobicContact CE2-CG 4.47Å; F606-R612 HydrophobicContact CZ-CB 4.45Å; R612-Y614 HydrophobicContact CG-CD1 4.45Å; R612-Y614 HydrophobicContact CG-CE1 4.19Å; R612-Y655 HydrophobicContact CG-CD2 4.47Å; R612-D657 IonicContact CZ-OD1 3.53Å; R612-D657 IonicContact CZ-OD2 2.69Å; R612-D657 IonicContact NE-OD1 3.5Å; R612-D657 PolarHBondContact NE-OD1 3.48Å; R612-D657 IonicContact NE-OD2 2.71Å; R612-D657 IonicContact NH2-OD1 3.34Å; R612-D657 PolarHBondContact NH2-OD1 3.01Å; R612-D657 IonicContact NH2-OD2 3.48Å; R612-D657 PolarHBondContact NH2-OD2 2.89Å
613	L	96	Very high	91.8	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	127.3	168.6	175.8	148.8	0	0	0	108.6	I602 I603 C615 Y655 K656 I658 I691 L695	I602-L613 WeakPolarHBondContact O-CA 3.37Å; I603-L613 HydrophobicContact CD1-CD1 4.18Å; I603-L613 HydrophobicContact CG1-CB 4.31Å; I603-L613 HydrophobicContact CG1-CD1 3.96Å; I603-L613 HydrophobicContact CG1-CG 4.32Å; L613-C615 HydrophobicContact CD2-CB 4.02Å; L613-Y655 CarbonylContact O-C 3.59Å; L613-Y655 WeakPolarHBondContact O-CA 3.47Å; L613-K656 HydrophobicContact CD2-CB 4.44Å; L613-K656 PolarHBondContact N-O 3.12Å; L613-K656 PolarHBondContact O-N 3.27Å; L613-I658 HydrophobicContact CB-CD1 3.59Å; L613-I658 HydrophobicContact CB-CG1 4.28Å; L613-I658 HydrophobicContact CD1-CD1 4.15Å; L613-I691 HydrophobicContact CD1-CG1 4.02Å; L613-I691 HydrophobicContact CD1-CG2 4.12Å; L613-L695 HydrophobicContact CD2-CD2 3.64Å
614	Y	96.8	Very high	91.6	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	137.6	168	-73.3	-55.7	0	0	0	109.5	E522 L526 L529 S601 I602 L604 F606 R612	E522-Y614 WeakPolarHBondContact OE1-CE1 2.69Å; E522-Y614 PolarHBondContact OE1-OH 3.43Å; L526-Y614 HydrophobicContact CB-CD1 3.99Å; L526-Y614 HydrophobicContact CB-CE1 4.1Å; L526-Y614 HydrophobicContact CB-CG 4.4Å; L526-Y614 HydrophobicContact CD1-CD1 3.47Å; L526-Y614 VanDerWaalsContact CD1-CD1 3.47Å; L526-Y614 HydrophobicContact CD1-CE1 4.15Å; L526-Y614 HydrophobicContact CD1-CG 4.13Å; L526-Y614 HydrophobicContact CG-CD1 3.61Å; L526-Y614 HydrophobicContact CG-CE1 4.24Å; L526-Y614 HydrophobicContact CG-CG 3.86Å; L529-Y614 HydrophobicContact CD1-CD2 4.41Å; L529-Y614 HydrophobicContact CD1-CE2 3.77Å; S601-Y614 CarbonylContact C-O 3.54Å; S601-Y614 WeakPolarHBondContact CA-O 3.2Å; I602-Y614 HydrophobicContact CG2-CD2 4.44Å; I602-Y614 PolarHBondContact N-O 3.23Å; I602-Y614 PolarHBondContact O-N 3.26Å; L604-Y614 HydrophobicContact CD1-CD2 4.2Å; L604-Y614 HydrophobicContact CD1-CE2 4.4Å; F606-Y614 HydrophobicContact CE2-CE2 4.26Å; F606-Y614 AromaticContact CZ-CE2 3.9Å; F606-Y614 HydrophobicContact CZ-CE2 3.9Å; F606-Y614 WeakPolarHBondContact CZ-OH 3.37Å; R612-Y614 HydrophobicContact CG-CD1 4.45Å; R612-Y614 HydrophobicContact CG-CE1 4.19Å
615	C	95.4	Very high	91.5	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	134.2	-179.8	179.7	0	0	0	0	110	M600 S601 L613 I622 C654 L695	M600-C615 WeakPolarHBondContact O-CA 3.3Å; S601-C615 WeakPolarHBondContact OG-CB 3.3Å; S601-C615 PolarHBondContact OG-SG 3.46Å; S601-C615 VanDerWaalsContact OG-SG 3.33Å; L613-C615 HydrophobicContact CD2-CB 4.02Å; C615-I622 VanDerWaalsContact SG-CD1 3.58Å; C615-C654 PolarHBondContact N-O 2.82Å; C615-C654 PolarHBondContact O-N 3.16Å; C615-C654 VanDerWaalsContact O-O 3.14Å; C615-C654 PolarHBondContact O-SG 2.93Å; C615-L695 HydrophobicContact CB-CD1 4.11Å; C615-L695 HydrophobicContact CB-CD2 4.49Å
616	K	95.1	Very high	91.4	Very high	13 Å²	13	37.6 Å²	37.6	6%	0.057	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	138.1	170.4	67.9	-177.9	-176.2	-174.8	0	109.5	C530 E552 R599 M600 C652 L653	C530-K616 WeakPolarHBondContact O-CD 3.33Å; C530-K616 WeakPolarHBondContact O-CE 3.46Å; C530-K616 PolarHBondContact O-NZ 2.83Å; E552-K616 WeakPolarHBondContact OE1-CE 3.38Å; E552-K616 IonicContact OE1-NZ 4Å; E552-K616 PolarHBondContact OE1-NZ 2.75Å; R599-K616 CarbonylContact C-O 3.58Å; R599-K616 VanDerWaalsContact CA-O 3.28Å; R599-K616 WeakPolarHBondContact CA-O 3.43Å; M600-K616 HydrophobicContact CB-CG 4.25Å; M600-K616 PolarHBondContact N-O 2.87Å; M600-K616 PolarHBondContact O-N 2.98Å; K616-C652 WeakPolarHBondContact CA-O 3.13Å; K616-L653 HydrophobicContact CB-CD2 3.58Å
617	G	91.9	Very high	91.4	Very high	2 Å²	2	38 Å²	38	2%	0.021	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-172.1	-179.2	-177.8	0	0	0	0	0	114.2	K598 L651 C652	K598-G617 WeakPolarHBondContact O-CA 3.44Å; G617-L651 CarbonylContact O-C 3.53Å; G617-L651 WeakPolarHBondContact O-CA 3.38Å; G617-C652 PolarHBondContact N-O 3Å; G617-C652 VanDerWaalsContact N-O 3.09Å; G617-C652 PolarHBondContact O-N 2.82Å
618	A	87.6	Confident	91.4	Very high	19 Å²	19	39 Å²	39	16%	0.157	22%	0.216	C	C	.	.			trans	-61.8	145.1	176	0	0	0	0	0	111.6	K598 T620 V621 I622	K598-A618 HydrophobicContact CB-CB 4.33Å; K598-A618 PolarHBondContact O-N 3.1Å; K598-A618 VanDerWaalsContact O-N 3.14Å; A618-T620 PolarHBondContact O-N 3.46Å; A618-V621 HydrophobicContact CB-CG2 4.47Å; A618-V621 PolarHBondContact O-N 3.32Å; A618-I622 WeakPolarHBondContact O-CG1 3.48Å; A618-I622 PolarHBondContact O-N 3.14Å
619	D	85.8	Confident	91.3	Very high	42 Å²	42	40.2 Å²	40.2	23%	0.225	22%	0.223	C	C	.	.	H	α-helix	trans	-51.2	-52.9	179	53.7	-3.9	0	0	0	113.4	V621 I622 Y623 L640	D619-V621 VanDerWaalsContact C-N 3.31Å; D619-V621 PolarHBondContact O-N 3.16Å; D619-I622 PolarHBondContact O-N 3.18Å; D619-Y623 WeakPolarHBondContact O-CB 3.3Å; D619-Y623 WeakPolarHBondContact O-CD2 3.44Å; D619-Y623 PolarHBondContact O-N 3.33Å; D619-L640 HydrophobicContact CB-CD1 3.95Å; D619-L640 HydrophobicContact CB-CD2 4.49Å
620	T	83.9	Confident	91.3	Very high	87 Å²	87	38.7 Å²	38.7	53%	0.534	20%	0.204	S	C	.	.	H	α-helix	trans	-54.1	-43.9	178.3	46.6	0	0	0	0	112.9	A618 E624	A618-T620 PolarHBondContact O-N 3.46Å; T620-E624 WeakPolarHBondContact O-CG 3.34Å
621	V	89	Confident	90.9	Very high	13 Å²	13	41.4 Å²	41.4	8%	0.079	22%	0.22	C	C	.	.	H	α-helix	trans	-76.7	-40.4	-177	176.1	0	0	0	0	111.9	R597 K598 A618 D619 R625	R597-V621 WeakPolarHBondContact O-CG1 3.49Å; K598-V621 HydrophobicContact CB-CG2 4Å; K598-V621 HydrophobicContact CD-CG2 3.89Å; K598-V621 HydrophobicContact CG-CG2 4.46Å; A618-V621 HydrophobicContact CB-CG2 4.47Å; A618-V621 PolarHBondContact O-N 3.32Å; D619-V621 VanDerWaalsContact C-N 3.31Å; D619-V621 PolarHBondContact O-N 3.16Å; V621-R625 PolarHBondContact O-NH1 3.15Å
622	I	91.8	Very high	90.5	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-68.8	-42.1	179.8	-67.4	-52.5	0	0	0	110.4	R599 C615 A618 D619 E624 R625 L626 C652 C654 L695	R599-I622 HydrophobicContact CB-CD1 4.4Å; C615-I622 VanDerWaalsContact SG-CD1 3.58Å; A618-I622 WeakPolarHBondContact O-CG1 3.48Å; A618-I622 PolarHBondContact O-N 3.14Å; D619-I622 PolarHBondContact O-N 3.18Å; I622-E624 VanDerWaalsContact C-N 3.26Å; I622-E624 PolarHBondContact O-N 3.45Å; I622-R625 PolarHBondContact O-N 2.97Å; I622-L626 HydrophobicContact CG2-CD2 3.95Å; I622-L626 HydrophobicContact CG2-CG 4.27Å; I622-L626 WeakPolarHBondContact O-CG 3.3Å; I622-L626 PolarHBondContact O-N 2.88Å; I622-C652 HydrophobicContact CB-CB 3.85Å; I622-C652 HydrophobicContact CG1-CB 3.97Å; I622-C652 HydrophobicContact CG2-CB 3.75Å; I622-C654 WeakPolarHBondContact CG2-SG 3.39Å; I622-L695 HydrophobicContact CD1-CD1 4.42Å
623	Y	90.1	Very high	90.1	Very high	32 Å²	32	47.7 Å²	47.7	13%	0.125	25%	0.248	C	C	.	.	H	α-helix	trans	-62	-29	-175.3	-93.3	-114.6	0	0	0	114.4	D619 R625 L626 K633 Q637 L640	D619-Y623 WeakPolarHBondContact O-CB 3.3Å; D619-Y623 WeakPolarHBondContact O-CD2 3.44Å; D619-Y623 PolarHBondContact O-N 3.33Å; Y623-R625 VanDerWaalsContact C-N 3.3Å; Y623-L626 HydrophobicContact CD1-CD1 4.38Å; Y623-L626 HydrophobicContact CD2-CD1 4.25Å; Y623-L626 HydrophobicContact CG-CD1 4.18Å; Y623-K633 HydrophobicContact CD1-CD 4.41Å; Y623-K633 HydrophobicContact CD1-CG 4.12Å; Y623-K633 HydrophobicContact CE1-CD 4.34Å; Y623-K633 HydrophobicContact CE1-CG 3.57Å; Y623-K633 PolarHBondContact OH-O 2.87Å; Y623-Q637 HydrophobicContact CE1-CB 4.13Å; Y623-Q637 VanDerWaalsContact CZ-OE1 3.28Å; Y623-Q637 WeakPolarHBondContact OH-CA 3.39Å; Y623-Q637 PolarHBondContact OH-N 3.36Å; Y623-Q637 VanDerWaalsContact OH-N 3.11Å; Y623-L640 HydrophobicContact CE2-CD1 3.79Å
624	E	90.8	Very high	89.8	Confident	147 Å²	147	55.6 Å²	55.6	69%	0.687	29%	0.285	S	S	*	.	H	α-helix	trans	-69.6	-26.4	173.1	-68.6	171.8	171.9	0	0	113.2	T620 I622	T620-E624 WeakPolarHBondContact O-CG 3.34Å; I622-E624 VanDerWaalsContact C-N 3.26Å; I622-E624 PolarHBondContact O-N 3.45Å
625	R	92.9	Very high	89.5	Confident	34 Å²	34	58.9 Å²	58.9	13%	0.128	31%	0.305	C	S	.	.	H	α-helix	trans	-103.1	-2.4	-173	-69.7	167.2	-174.4	68.9	2.2	113.1	V621 I622 Y623 E689 N694 L695	V621-R625 PolarHBondContact O-NH1 3.15Å; I622-R625 PolarHBondContact O-N 2.97Å; Y623-R625 VanDerWaalsContact C-N 3.3Å; R625-E689 IonicContact CZ-OE1 2.86Å; R625-E689 IonicContact NE-OE1 3.99Å; R625-E689 PolarHBondContact NE-OE1 3.44Å; R625-E689 IonicContact NH2-OE1 2.9Å; R625-E689 PolarHBondContact NH2-OE1 3.07Å; R625-E689 IonicContact NH2-OE2 4Å; R625-N694 WeakPolarHBondContact O-CA 3.24Å; R625-N694 PolarHBondContact O-N 3.38Å; R625-L695 HydrophobicContact CB-CD1 4.22Å; R625-L695 PolarHBondContact O-N 3.29Å
626	L	93.5	Very high	89.4	Confident	14 Å²	14	58.9 Å²	58.9	7%	0.073	31%	0.306	C	S	.	.	B	Isolated β-bridge	trans	-66.7	140.7	177.3	-69.6	179.2	0	0	0	111.7	I622 Y623 T630 K633 L695 L697	I622-L626 HydrophobicContact CG2-CD2 3.95Å; I622-L626 HydrophobicContact CG2-CG 4.27Å; I622-L626 WeakPolarHBondContact O-CG 3.3Å; I622-L626 PolarHBondContact O-N 2.88Å; Y623-L626 HydrophobicContact CD1-CD1 4.38Å; Y623-L626 HydrophobicContact CD2-CD1 4.25Å; Y623-L626 HydrophobicContact CG-CD1 4.18Å; L626-T630 HydrophobicContact CD1-CG2 4.38Å; L626-T630 HydrophobicContact CD2-CG2 4.47Å; L626-K633 HydrophobicContact CD1-CD 4.36Å; L626-K633 HydrophobicContact CD1-CG 4.37Å; L626-L695 CarbonylContact C-O 3.53Å; L626-L695 WeakPolarHBondContact CA-O 3.32Å; L626-L695 HydrophobicContact CD2-CB 4.32Å; L626-L695 WeakPolarHBondContact CD2-O 3.36Å; L626-L697 HydrophobicContact CD1-CB 4.24Å; L626-L697 HydrophobicContact CD1-CD2 4.33Å; L626-L697 HydrophobicContact CD2-CB 3.83Å; L626-L697 HydrophobicContact CD2-CD1 4.45Å
627	S	92.5	Very high	89.1	Confident	19 Å²	19	61.1 Å²	61.1	13%	0.133	32%	0.316	C	S	.	.			trans	-62.4	141.9	170.1	175.8	0	0	0	0	110.3	N629 T630 L695	S627-N629 PolarHBondContact O-N 3.2Å; S627-N629 VanDerWaalsContact O-N 3.08Å; S627-N629 PolarHBondContact OG-N 3.44Å; S627-T630 VanDerWaalsContact O-CB 3.23Å; S627-T630 WeakPolarHBondContact O-CB 3.27Å; S627-T630 PolarHBondContact O-N 3.13Å; S627-T630 PolarHBondContact O-OG1 3.14Å; S627-L695 PolarHBondContact N-O 3.27Å
628	P	87.3	Confident	88.9	Confident	116 Å²	116	64.9 Å²	64.9	75%	0.753	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-24.2	172.2	-24.9	34	0	0	0	113.9	T630	P628-T630 VanDerWaalsContact C-N 3.27Å; P628-T630 PolarHBondContact O-N 3.33Å
629	N	87.2	Confident	89	Confident	130 Å²	130	64.1 Å²	64.1	70%	0.695	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.5	5.8	-179.4	-65.5	-14.7	0	0	0	113.7	S627 Q631	S627-N629 PolarHBondContact O-N 3.2Å; S627-N629 VanDerWaalsContact O-N 3.08Å; S627-N629 PolarHBondContact OG-N 3.44Å; N629-Q631 PolarHBondContact O-N 3.45Å
630	T	85.3	Confident	89	Confident	16 Å²	16	62.1 Å²	62.1	10%	0.098	32%	0.322	C	S	.	.			trans	-67.8	126.3	-179.2	-62.1	0	0	0	0	111.1	L626 S627 P628 L695 L697	L626-T630 HydrophobicContact CD1-CG2 4.38Å; L626-T630 HydrophobicContact CD2-CG2 4.47Å; S627-T630 VanDerWaalsContact O-CB 3.23Å; S627-T630 WeakPolarHBondContact O-CB 3.27Å; S627-T630 PolarHBondContact O-N 3.13Å; S627-T630 PolarHBondContact O-OG1 3.14Å; P628-T630 VanDerWaalsContact C-N 3.27Å; P628-T630 PolarHBondContact O-N 3.33Å; T630-L695 PolarHBondContact OG1-O 3.13Å; T630-L697 HydrophobicContact CG2-CB 3.29Å; T630-L697 HydrophobicContact CG2-CD2 4.48Å
631	Q	84.9	Confident	89	Confident	141 Å²	141	61.8 Å²	61.8	66%	0.659	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.7	158.3	177.1	-59.9	-177	11	0	0	111	N629 K633	N629-Q631 PolarHBondContact O-N 3.45Å; Q631-K633 PolarHBondContact O-N 3.16Å; Q631-K633 VanDerWaalsContact O-N 3.13Å
632	H	86.8	Confident	88.8	Confident	87 Å²	87	65.1 Å²	65.1	40%	0.403	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.2	21.8	173.5	-49.8	-63.6	0	0	0	116.4	E634 T635 T636	H632-E634 PolarHBondContact O-N 3.03Å; H632-T635 PolarHBondContact O-OG1 3.33Å; H632-T636 VanDerWaalsContact O-CB 3.28Å; H632-T636 WeakPolarHBondContact O-CB 3.23Å; H632-T636 PolarHBondContact O-N 2.91Å; H632-T636 PolarHBondContact O-OG1 3.4Å
633	K	88	Confident	88.5	Confident	89 Å²	89	65.4 Å²	65.4	39%	0.387	34%	0.335	S	S	.	.	H	α-helix	trans	-59.9	-46.3	179.9	-173.6	176.5	-178.4	173.7	0	112.8	Y623 L626 Q631 Q637	Y623-K633 HydrophobicContact CD1-CD 4.41Å; Y623-K633 HydrophobicContact CD1-CG 4.12Å; Y623-K633 HydrophobicContact CE1-CD 4.34Å; Y623-K633 HydrophobicContact CE1-CG 3.57Å; Y623-K633 PolarHBondContact OH-O 2.87Å; L626-K633 HydrophobicContact CD1-CD 4.36Å; L626-K633 HydrophobicContact CD1-CG 4.37Å; Q631-K633 PolarHBondContact O-N 3.16Å; Q631-K633 VanDerWaalsContact O-N 3.13Å; K633-Q637 PolarHBondContact O-N 3.22Å; K633-Q637 VanDerWaalsContact O-N 3.08Å
634	E	88.6	Confident	87.7	Confident	166 Å²	166	65.4 Å²	65.4	78%	0.776	34%	0.341	S	S	*	.	H	α-helix	trans	-70.3	-47	-177.9	-67.2	-179.5	177.5	0	0	112.3	H632 T636 Q637 T638	H632-E634 PolarHBondContact O-N 3.03Å; E634-T636 VanDerWaalsContact C-N 3.29Å; E634-T636 PolarHBondContact O-N 3.31Å; E634-Q637 WeakPolarHBondContact O-CB 3.39Å; E634-Q637 PolarHBondContact O-N 2.99Å; E634-Q637 VanDerWaalsContact O-N 3.11Å; E634-T638 PolarHBondContact O-N 2.94Å; E634-T638 PolarHBondContact O-OG1 3.47Å
635	T	92.2	Very high	86.9	Confident	69 Å²	69	65 Å²	65	42%	0.423	34%	0.344	S	S	.	.	H	α-helix	trans	-63.9	-36.5	179.3	50.7	0	0	0	0	112.1	G469 H632 A639	G469-T635 WeakPolarHBondContact CA-OG1 3.37Å; H632-T635 PolarHBondContact O-OG1 3.33Å; T635-A639 PolarHBondContact O-N 3.4Å; T635-A639 VanDerWaalsContact O-N 3.14Å
636	T	91.6	Very high	86.2	Confident	1 Å²	1	67.1 Å²	67.1	1%	0.006	36%	0.355	C	S	.	.	H	α-helix	trans	-67.8	-37.5	174	-55.6	0	0	0	0	111.6	T466 H632 E634 A639 L640 L697 A700	T466-T636 HydrophobicContact CG2-CG2 3.71Å; H632-T636 VanDerWaalsContact O-CB 3.28Å; H632-T636 WeakPolarHBondContact O-CB 3.23Å; H632-T636 PolarHBondContact O-N 2.91Å; H632-T636 PolarHBondContact O-OG1 3.4Å; E634-T636 VanDerWaalsContact C-N 3.29Å; E634-T636 PolarHBondContact O-N 3.31Å; T636-A639 PolarHBondContact O-N 3.3Å; T636-L640 HydrophobicContact CG2-CD1 4.25Å; T636-L640 VanDerWaalsContact O-CG 3.31Å; T636-L640 WeakPolarHBondContact O-CG 3.35Å; T636-L640 PolarHBondContact O-N 3.4Å; T636-L697 HydrophobicContact CG2-CD2 3.85Å; T636-A700 HydrophobicContact CG2-CB 4.24Å
637	Q	88.9	Confident	85.3	Confident	59 Å²	59	68.3 Å²	68.3	28%	0.276	36%	0.363	S	S	.	.	H	α-helix	trans	-62.4	-47	175.5	-175	63.5	50	0	0	111.1	Y623 K633 E634 A639 L640 D641	Y623-Q637 HydrophobicContact CE1-CB 4.13Å; Y623-Q637 VanDerWaalsContact CZ-OE1 3.28Å; Y623-Q637 WeakPolarHBondContact OH-CA 3.39Å; Y623-Q637 PolarHBondContact OH-N 3.36Å; Y623-Q637 VanDerWaalsContact OH-N 3.11Å; K633-Q637 PolarHBondContact O-N 3.22Å; K633-Q637 VanDerWaalsContact O-N 3.08Å; E634-Q637 WeakPolarHBondContact O-CB 3.39Å; E634-Q637 PolarHBondContact O-N 2.99Å; E634-Q637 VanDerWaalsContact O-N 3.11Å; Q637-A639 VanDerWaalsContact C-N 3.26Å; Q637-A639 PolarHBondContact O-N 3.33Å; Q637-L640 WeakPolarHBondContact O-CB 3.28Å; Q637-L640 PolarHBondContact O-N 2.74Å; Q637-L640 VanDerWaalsContact O-N 3.12Å; Q637-D641 PolarHBondContact NE2-OD1 3.21Å; Q637-D641 VanDerWaalsContact O-CG 3.25Å; Q637-D641 PolarHBondContact O-N 3.49Å
638	T	89.4	Confident	84.8	Confident	81 Å²	81	67.9 Å²	67.9	50%	0.497	36%	0.359	S	S	.	.	H	α-helix	trans	-59.9	-38.2	176.8	-51.3	0	0	0	0	112	E634 D641 I642	E634-T638 PolarHBondContact O-N 2.94Å; E634-T638 PolarHBondContact O-OG1 3.47Å; T638-D641 PolarHBondContact O-N 3.43Å; T638-I642 HydrophobicContact CG2-CD1 4.35Å; T638-I642 VanDerWaalsContact O-CG1 3.31Å; T638-I642 WeakPolarHBondContact O-CG1 3.37Å; T638-I642 PolarHBondContact O-N 3.11Å; T638-I642 VanDerWaalsContact O-N 3.15Å
639	A	88.8	Confident	84.7	Confident	3 Å²	3	64.9 Å²	64.9	3%	0.025	33%	0.333	C	S	.	.	H	α-helix	trans	-66.7	-40.4	175.7	0	0	0	0	0	112.5	T466 S471 T635 T636 Q637 D641 I642 F643	T466-A639 HydrophobicContact CG2-CB 3.99Å; S471-A639 WeakPolarHBondContact OG-CB 3.33Å; T635-A639 PolarHBondContact O-N 3.4Å; T635-A639 VanDerWaalsContact O-N 3.14Å; T636-A639 PolarHBondContact O-N 3.3Å; Q637-A639 VanDerWaalsContact C-N 3.26Å; Q637-A639 PolarHBondContact O-N 3.33Å; A639-D641 VanDerWaalsContact C-N 3.34Å; A639-I642 PolarHBondContact O-N 3.42Å; A639-F643 HydrophobicContact CB-CE2 4.26Å; A639-F643 HydrophobicContact CB-CZ 4.35Å; A639-F643 VanDerWaalsContact O-CD2 3.3Å; A639-F643 WeakPolarHBondContact O-CD2 3.36Å; A639-F643 WeakPolarHBondContact O-CG 3.45Å; A639-F643 PolarHBondContact O-N 3.02Å
640	L	86.3	Confident	84.7	Confident	1 Å²	1	59.8 Å²	59.8	1%	0.005	31%	0.307	C	S	.	.	H	α-helix	trans	-59.4	-44.2	174.8	-73.7	165.4	0	0	0	111.5	D619 Y623 T636 Q637 I642 F643 A644 T650 A700	D619-L640 HydrophobicContact CB-CD1 3.95Å; D619-L640 HydrophobicContact CB-CD2 4.49Å; Y623-L640 HydrophobicContact CE2-CD1 3.79Å; T636-L640 HydrophobicContact CG2-CD1 4.25Å; T636-L640 VanDerWaalsContact O-CG 3.31Å; T636-L640 WeakPolarHBondContact O-CG 3.35Å; T636-L640 PolarHBondContact O-N 3.4Å; Q637-L640 WeakPolarHBondContact O-CB 3.28Å; Q637-L640 PolarHBondContact O-N 2.74Å; Q637-L640 VanDerWaalsContact O-N 3.12Å; L640-I642 VanDerWaalsContact C-N 3.33Å; L640-I642 PolarHBondContact O-N 3.33Å; L640-F643 PolarHBondContact O-N 3.33Å; L640-A644 WeakPolarHBondContact O-CB 3.33Å; L640-A644 PolarHBondContact O-N 3.29Å; L640-T650 VanDerWaalsContact CD2-CB 3.47Å; L640-T650 HydrophobicContact CD2-CG2 3.73Å; L640-A700 HydrophobicContact CD2-CB 3.56Å; L640-A700 HydrophobicContact CG-CB 4.18Å
641	D	82.6	Confident	85	Confident	80 Å²	80	60.9 Å²	60.9	43%	0.428	31%	0.312	S	S	.	.	H	α-helix	trans	-62.9	-40.2	178.1	-58.7	-23.6	0	0	0	111.4	Q637 T638 A639 A644 N645	Q637-D641 PolarHBondContact NE2-OD1 3.21Å; Q637-D641 VanDerWaalsContact O-CG 3.25Å; Q637-D641 PolarHBondContact O-N 3.49Å; T638-D641 PolarHBondContact O-N 3.43Å; A639-D641 VanDerWaalsContact C-N 3.34Å; D641-A644 PolarHBondContact O-N 3.25Å; D641-N645 VanDerWaalsContact O-CG 3.24Å; D641-N645 PolarHBondContact O-N 2.89Å; D641-N645 PolarHBondContact O-ND2 3.13Å
642	I	85.1	Confident	85.4	Confident	83 Å²	83	54.2 Å²	54.2	43%	0.426	28%	0.28	S	S	.	.	H	α-helix	trans	-63.9	-45.8	174.8	-67	164.6	0	0	0	110.9	T638 A639 L640 A644 N645 E646	T638-I642 HydrophobicContact CG2-CD1 4.35Å; T638-I642 VanDerWaalsContact O-CG1 3.31Å; T638-I642 WeakPolarHBondContact O-CG1 3.37Å; T638-I642 PolarHBondContact O-N 3.11Å; T638-I642 VanDerWaalsContact O-N 3.15Å; A639-I642 PolarHBondContact O-N 3.42Å; L640-I642 VanDerWaalsContact C-N 3.33Å; L640-I642 PolarHBondContact O-N 3.33Å; I642-A644 VanDerWaalsContact C-N 3.31Å; I642-A644 PolarHBondContact O-N 3.49Å; I642-N645 PolarHBondContact O-N 3.43Å; I642-E646 PolarHBondContact O-N 2.88Å; I642-E646 VanDerWaalsContact O-N 3.1Å
643	F	85.9	Confident	85.9	Confident	5 Å²	5	50 Å²	50	2%	0.022	26%	0.261	C	S	.	.	H	α-helix	trans	-64	-38.3	179	-61.6	-24	0	0	0	111.9	K464 T466 A639 L640 E646 T647 L648 T650 A702	K464-F643 HydrophobicContact CB-CD1 4.22Å; K464-F643 HydrophobicContact CB-CE1 3.73Å; K464-F643 HydrophobicContact CB-CZ 3.96Å; K464-F643 HydrophobicContact CD-CD1 4Å; K464-F643 HydrophobicContact CD-CE1 3.76Å; K464-F643 HydrophobicContact CG-CE1 4.38Å; T466-F643 HydrophobicContact CG2-CE2 4.18Å; A639-F643 HydrophobicContact CB-CE2 4.26Å; A639-F643 HydrophobicContact CB-CZ 4.35Å; A639-F643 VanDerWaalsContact O-CD2 3.3Å; A639-F643 WeakPolarHBondContact O-CD2 3.36Å; A639-F643 WeakPolarHBondContact O-CG 3.45Å; A639-F643 PolarHBondContact O-N 3.02Å; L640-F643 PolarHBondContact O-N 3.33Å; F643-E646 CarbonylContact O-C 3.58Å; F643-E646 PolarHBondContact O-N 3.39Å; F643-T647 PolarHBondContact O-N 3.24Å; F643-L648 HydrophobicContact CB-CB 4.38Å; F643-L648 HydrophobicContact CB-CD1 4.44Å; F643-L648 WeakPolarHBondContact O-CB 3.29Å; F643-L648 PolarHBondContact O-N 3.26Å; F643-T650 HydrophobicContact CB-CG2 3.69Å; F643-T650 HydrophobicContact CD2-CG2 4.32Å; F643-A702 HydrophobicContact CB-CB 4Å; F643-A702 HydrophobicContact CD1-CB 4.37Å; F643-A702 HydrophobicContact CD2-CB 3.69Å; F643-A702 HydrophobicContact CE2-CB 4.22Å; F643-A702 HydrophobicContact CG-CB 3.77Å
644	A	74.2	Confident	86.2	Confident	32 Å²	32	45.8 Å²	45.8	26%	0.264	24%	0.243	S	C	.	.	H	α-helix	trans	-63.2	-42.7	174.6	0	0	0	0	0	111.7	L640 D641 I642 E646 T647	L640-A644 WeakPolarHBondContact O-CB 3.33Å; L640-A644 PolarHBondContact O-N 3.29Å; D641-A644 PolarHBondContact O-N 3.25Å; I642-A644 VanDerWaalsContact C-N 3.31Å; I642-A644 PolarHBondContact O-N 3.49Å; A644-E646 PolarHBondContact O-N 3.44Å; A644-T647 WeakPolarHBondContact O-CA 3.41Å; A644-T647 PolarHBondContact O-N 3.48Å
645	N	74.1	Confident	86.5	Confident	138 Å²	138	40.6 Å²	40.6	74%	0.738	22%	0.216	S	C	*	.	H	α-helix	trans	-63.1	-28.9	175.4	-71.9	-26.3	0	0	0	113.1	D641 I642 T647	D641-N645 VanDerWaalsContact O-CG 3.24Å; D641-N645 PolarHBondContact O-N 2.89Å; D641-N645 PolarHBondContact O-ND2 3.13Å; I642-N645 PolarHBondContact O-N 3.43Å; N645-T647 PolarHBondContact O-N 3.44Å
646	E	77	Confident	86.7	Confident	80 Å²	80	38.7 Å²	38.7	37%	0.374	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.2	9.6	172.2	-67.1	179.5	174.9	0	0	113.1	K464 I642 F643 A644 L648	K464-E646 VanDerWaalsContact CE-OE2 3.23Å; K464-E646 WeakPolarHBondContact CE-OE2 3.23Å; K464-E646 IonicContact NZ-OE1 3.19Å; K464-E646 PolarHBondContact NZ-OE1 2.9Å; K464-E646 IonicContact NZ-OE2 3.71Å; K464-E646 PolarHBondContact NZ-OE2 3.47Å; I642-E646 PolarHBondContact O-N 2.88Å; I642-E646 VanDerWaalsContact O-N 3.1Å; F643-E646 CarbonylContact O-C 3.58Å; F643-E646 PolarHBondContact O-N 3.39Å; A644-E646 PolarHBondContact O-N 3.44Å; E646-L648 VanDerWaalsContact C-N 3.27Å; E646-L648 HydrophobicContact CB-CD1 4.35Å; E646-L648 HydrophobicContact CB-CG 4.2Å; E646-L648 PolarHBondContact O-N 2.91Å
647	T	74.3	Confident	86.8	Confident	39 Å²	39	42.6 Å²	42.6	24%	0.239	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	64.9	24.3	179.3	65.8	0	0	0	0	114.6	F643 A644 N645 N738 F741 S742	F643-T647 PolarHBondContact O-N 3.24Å; A644-T647 WeakPolarHBondContact O-CA 3.41Å; A644-T647 PolarHBondContact O-N 3.48Å; N645-T647 PolarHBondContact O-N 3.44Å; T647-N738 HydrophobicContact CG2-CB 4.06Å; T647-N738 WeakPolarHBondContact CG2-O 3.4Å; T647-F741 HydrophobicContact CG2-CB 4.42Å; T647-S742 VanDerWaalsContact CB-OG 3.23Å; T647-S742 WeakPolarHBondContact CB-OG 3.31Å; T647-S742 WeakPolarHBondContact CG2-OG 3.04Å; T647-S742 PolarHBondContact OG1-OG 2.95Å
648	L	82.4	Confident	87	Confident	9 Å²	9	40.3 Å²	40.3	5%	0.047	21%	0.212	C	C	.	.			trans	-88.5	140.1	176.5	-54.8	175.6	0	0	0	111.1	K463 K464 F643 E646 A702 E704	K463-L648 HydrophobicContact CB-CD1 4.47Å; K463-L648 HydrophobicContact CB-CD2 4.41Å; K463-L648 HydrophobicContact CG-CD2 4.38Å; K464-L648 HydrophobicContact CB-CD1 4.44Å; K464-L648 HydrophobicContact CD-CD1 4.08Å; K464-L648 HydrophobicContact CG-CD1 4.24Å; F643-L648 HydrophobicContact CB-CB 4.38Å; F643-L648 HydrophobicContact CB-CD1 4.44Å; F643-L648 WeakPolarHBondContact O-CB 3.29Å; F643-L648 PolarHBondContact O-N 3.26Å; E646-L648 VanDerWaalsContact C-N 3.27Å; E646-L648 HydrophobicContact CB-CD1 4.35Å; E646-L648 HydrophobicContact CB-CG 4.2Å; E646-L648 PolarHBondContact O-N 2.91Å; L648-A702 HydrophobicContact CB-CB 3.92Å; L648-A702 HydrophobicContact CD1-CB 3.75Å; L648-A702 HydrophobicContact CG-CB 4.46Å; L648-E704 HydrophobicContact CD2-CB 3.66Å; L648-E704 HydrophobicContact CD2-CG 4.17Å
649	R	84.3	Confident	87.2	Confident	53 Å²	53	39.2 Å²	39.2	20%	0.2	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	127	171.4	-63.1	-176.4	-177.1	-164.3	1.1	109.8	D551 A702 I703 D705 D731	D551-R649 IonicContact OD1-NH1 3.86Å; D551-R649 PolarHBondContact OD1-NH1 3.42Å; D551-R649 IonicContact OD2-NH1 2.87Å; D551-R649 PolarHBondContact OD2-NH1 2.84Å; R649-A702 CarbonylContact O-C 3.54Å; R649-A702 VanDerWaalsContact O-CA 3.31Å; R649-A702 WeakPolarHBondContact O-CA 3.35Å; R649-I703 HydrophobicContact CB-CB 4.44Å; R649-I703 PolarHBondContact N-O 3.42Å; R649-I703 PolarHBondContact O-N 3.15Å; R649-D705 IonicContact CZ-OD2 3.59Å; R649-D705 IonicContact NE-OD2 3.67Å; R649-D705 IonicContact NH2-OD2 3.46Å; R649-D705 PolarHBondContact NH2-OD2 3.27Å; R649-D731 IonicContact NH2-OD2 3.75Å
650	T	87.5	Confident	87.3	Confident	24 Å²	24	42.2 Å²	42.2	15%	0.147	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	141.4	-176.6	53.9	0	0	0	0	112.3	L640 F643 T701	L640-T650 VanDerWaalsContact CD2-CB 3.47Å; L640-T650 HydrophobicContact CD2-CG2 3.73Å; F643-T650 HydrophobicContact CB-CG2 3.69Å; F643-T650 HydrophobicContact CD2-CG2 4.32Å; T650-T701 VanDerWaalsContact CA-O 3.28Å; T650-T701 WeakPolarHBondContact CA-O 2.98Å
651	L	92.3	Very high	87.5	Confident	39 Å²	39	46.4 Å²	46.4	20%	0.204	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	133.4	170.3	-68	170.2	0	0	0	109.8	L555 G617 A700 T701	L555-L651 HydrophobicContact CD1-CD1 4.03Å; G617-L651 CarbonylContact O-C 3.53Å; G617-L651 WeakPolarHBondContact O-CA 3.38Å; L651-A700 CarbonylContact O-C 3.49Å; L651-A700 WeakPolarHBondContact O-CA 3.31Å; L651-A700 WeakPolarHBondContact O-CB 3.44Å; L651-T701 PolarHBondContact N-O 3.46Å; L651-T701 VanDerWaalsContact N-O 3.08Å; L651-T701 PolarHBondContact O-N 3.25Å; L651-T701 PolarHBondContact O-OG1 3.21Å
652	C	94.3	Very high	88	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	142.5	173.4	-69.1	0	0	0	0	110.6	K616 G617 I622 L697	K616-C652 WeakPolarHBondContact CA-O 3.13Å; G617-C652 PolarHBondContact N-O 3Å; G617-C652 VanDerWaalsContact N-O 3.09Å; G617-C652 PolarHBondContact O-N 2.82Å; I622-C652 HydrophobicContact CB-CB 3.85Å; I622-C652 HydrophobicContact CG1-CB 3.97Å; I622-C652 HydrophobicContact CG2-CB 3.75Å; C652-L697 HydrophobicContact CB-CD1 4.18Å
653	L	95.7	Very high	88.3	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	131.3	179.6	-56.3	-175.8	0	0	0	110	F523 L526 L527 K616 I698 G699 T701	F523-L653 HydrophobicContact CD1-CD1 4.36Å; F523-L653 HydrophobicContact CD2-CD1 3.61Å; F523-L653 HydrophobicContact CE1-CD1 4.13Å; F523-L653 HydrophobicContact CE2-CD1 3.36Å; F523-L653 HydrophobicContact CE2-CG 4.24Å; F523-L653 HydrophobicContact CG-CD1 4.12Å; F523-L653 HydrophobicContact CZ-CD1 3.64Å; L526-L653 HydrophobicContact CD1-CB 4.09Å; L526-L653 HydrophobicContact CD2-CB 4.36Å; L526-L653 HydrophobicContact CD2-CD1 4.31Å; L526-L653 HydrophobicContact CD2-CD2 3.79Å; L526-L653 HydrophobicContact CD2-CG 4.38Å; L527-L653 HydrophobicContact CD2-CD1 3.59Å; L527-L653 HydrophobicContact CD2-CD2 3.88Å; L527-L653 HydrophobicContact CD2-CG 4.39Å; L527-L653 HydrophobicContact CG-CD1 3.94Å; K616-L653 HydrophobicContact CB-CD2 3.58Å; L653-I698 PolarHBondContact O-N 2.79Å; L653-G699 PolarHBondContact N-O 2.82Å; L653-G699 PolarHBondContact O-N 2.91Å; L653-T701 HydrophobicContact CD1-CG2 3.84Å; L653-T701 HydrophobicContact CD2-CG2 4.48Å; L653-T701 HydrophobicContact CG-CG2 4.21Å
654	C	95.4	Very high	88.6	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	158.4	-172.9	15.4	0	0	0	0	111.8	L526 C615 I622 L695 M696	L526-C654 WeakPolarHBondContact CD1-O 3.34Å; C615-C654 PolarHBondContact N-O 2.82Å; C615-C654 PolarHBondContact O-N 3.16Å; C615-C654 VanDerWaalsContact O-O 3.14Å; C615-C654 PolarHBondContact O-SG 2.93Å; I622-C654 WeakPolarHBondContact CG2-SG 3.39Å; C654-L695 HydrophobicContact CB-CB 3.92Å; C654-L695 HydrophobicContact CB-CD1 4.35Å; C654-M696 CarbonylContact C-O 3.56Å; C654-M696 WeakPolarHBondContact CA-O 3.36Å; C654-M696 VanDerWaalsContact CB-O 3.28Å; C654-M696 WeakPolarHBondContact CB-O 3.44Å
655	Y	95.3	Very high	89.4	Confident	57 Å²	57	49.7 Å²	49.7	22%	0.224	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	163	173.8	74.5	-77.2	0	0	0	111.9	R612 L613 M696 I698	R612-Y655 HydrophobicContact CG-CD2 4.47Å; L613-Y655 CarbonylContact O-C 3.59Å; L613-Y655 WeakPolarHBondContact O-CA 3.47Å; Y655-M696 HydrophobicContact CD1-CB 4.12Å; Y655-M696 HydrophobicContact CE1-CB 3.81Å; Y655-M696 PolarHBondContact N-O 2.89Å; Y655-M696 PolarHBondContact O-N 2.99Å; Y655-I698 HydrophobicContact CD1-CD1 3.61Å; Y655-I698 HydrophobicContact CD1-CG1 3.45Å; Y655-I698 VanDerWaalsContact CD1-CG1 3.45Å; Y655-I698 HydrophobicContact CE1-CD1 4.33Å; Y655-I698 HydrophobicContact CE1-CG1 3.83Å; Y655-I698 HydrophobicContact CG-CD1 4.37Å
656	K	94.7	Very high	90.4	Very high	28 Å²	28	43.4 Å²	43.4	12%	0.122	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	129	170	176.7	-178.6	170.6	-166.7	0	109.2	L613 I658 E662 I691 K693 L695	L613-K656 HydrophobicContact CD2-CB 4.44Å; L613-K656 PolarHBondContact N-O 3.12Å; L613-K656 PolarHBondContact O-N 3.27Å; K656-I658 HydrophobicContact CG-CG1 4.29Å; K656-E662 IonicContact NZ-OE1 3.65Å; K656-E662 PolarHBondContact NZ-OE1 3.22Å; K656-I691 PolarHBondContact NZ-O 2.96Å; K656-K693 WeakPolarHBondContact CD-O 3.29Å; K656-L695 HydrophobicContact CB-CD2 3.95Å
657	D	93.8	Very high	91	Very high	84 Å²	84	40.9 Å²	40.9	45%	0.449	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	132.7	168.8	-73.9	-37.9	0	0	0	109.9	R612	R612-D657 IonicContact CZ-OD1 3.53Å; R612-D657 IonicContact CZ-OD2 2.69Å; R612-D657 IonicContact NE-OD1 3.5Å; R612-D657 PolarHBondContact NE-OD1 3.48Å; R612-D657 IonicContact NE-OD2 2.71Å; R612-D657 IonicContact NH2-OD1 3.34Å; R612-D657 PolarHBondContact NH2-OD1 3.01Å; R612-D657 IonicContact NH2-OD2 3.48Å; R612-D657 PolarHBondContact NH2-OD2 2.89Å
658	I	94.1	Very high	91.7	Very high	10 Å²	10	46.7 Å²	46.7	5%	0.051	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	134.1	-174.8	-55.3	-175.1	0	0	0	108.7	I611 L613 K656 E662 F663 I691	I611-I658 HydrophobicContact CG2-CB 4.24Å; I611-I658 PolarHBondContact O-N 3.23Å; L613-I658 HydrophobicContact CB-CD1 3.59Å; L613-I658 HydrophobicContact CB-CG1 4.28Å; L613-I658 HydrophobicContact CD1-CD1 4.15Å; K656-I658 HydrophobicContact CG-CG1 4.29Å; I658-E662 HydrophobicContact CG2-CB 3.89Å; I658-E662 HydrophobicContact CG2-CG 3.95Å; I658-F663 HydrophobicContact CG2-CB 4.04Å; I658-I691 HydrophobicContact CD1-CD1 3.78Å; I658-I691 HydrophobicContact CD1-CG1 3.76Å
659	S	93.8	Very high	92.1	Very high	58 Å²	58	51.2 Å²	51.2	41%	0.406	27%	0.266	S	S	.	.			trans	-74	149	173.8	68.4	0	0	0	0	111.2	S661 E662 F663	S659-S661 PolarHBondContact O-N 3.41Å; S659-S661 PolarHBondContact OG-OG 2.93Å; S659-E662 PolarHBondContact O-N 3.11Å; S659-E662 VanDerWaalsContact OG-CB 3.23Å; S659-E662 WeakPolarHBondContact OG-CB 3.27Å; S659-E662 PolarHBondContact OG-N 3.19Å; S659-F663 PolarHBondContact O-N 3.36Å
660	A	90.3	Very high	92.2	Very high	67 Å²	67	49.8 Å²	49.8	55%	0.554	26%	0.262	S	S	*	.	H	α-helix	trans	-55	-38	178	0	0	0	0	0	112.6	I611 F663 E664	I611-A660 HydrophobicContact CD1-CB 4.44Å; A660-F663 PolarHBondContact O-N 3.46Å; A660-E664 WeakPolarHBondContact O-CB 3.46Å; A660-E664 PolarHBondContact O-N 3.35Å
661	S	91.4	Very high	92	Very high	88 Å²	88	54.7 Å²	54.7	62%	0.615	28%	0.281	S	S	*	.	H	α-helix	trans	-66.5	-38.2	176	48.9	0	0	0	0	113.8	S659 A665	S659-S661 PolarHBondContact O-N 3.41Å; S659-S661 PolarHBondContact OG-OG 2.93Å; S661-A665 WeakPolarHBondContact O-CB 3.23Å; S661-A665 PolarHBondContact O-N 3.38Å; S661-A665 VanDerWaalsContact O-N 3.15Å
662	E	91.9	Very high	91.6	Very high	74 Å²	74	59.3 Å²	59.3	35%	0.346	30%	0.301	S	S	.	.	H	α-helix	trans	-68.1	-42.7	177	-177.8	-177.8	176.4	0	0	110.4	K656 I658 S659 A665 W666	K656-E662 IonicContact NZ-OE1 3.65Å; K656-E662 PolarHBondContact NZ-OE1 3.22Å; I658-E662 HydrophobicContact CG2-CB 3.89Å; I658-E662 HydrophobicContact CG2-CG 3.95Å; S659-E662 PolarHBondContact O-N 3.11Å; S659-E662 VanDerWaalsContact OG-CB 3.23Å; S659-E662 WeakPolarHBondContact OG-CB 3.27Å; S659-E662 PolarHBondContact OG-N 3.19Å; E662-A665 PolarHBondContact O-N 3.25Å; E662-W666 WeakPolarHBondContact O-CB 3.36Å; E662-W666 PolarHBondContact O-N 3.06Å
663	F	92.2	Very high	91	Very high	27 Å²	27	59.7 Å²	59.7	12%	0.118	31%	0.305	C	S	.	.	H	α-helix	trans	-63.8	-44.7	176.9	178.4	-101.9	0	0	0	112.1	L588 I603 I611 I658 S659 A660 A665 W666 S667	L588-F663 HydrophobicContact CB-CE1 4.21Å; L588-F663 HydrophobicContact CB-CE2 3.92Å; L588-F663 HydrophobicContact CB-CZ 3.54Å; L588-F663 HydrophobicContact CD1-CD1 4.08Å; L588-F663 HydrophobicContact CD1-CD2 4.41Å; L588-F663 HydrophobicContact CD1-CE1 3.79Å; L588-F663 HydrophobicContact CD1-CE2 4.15Å; L588-F663 HydrophobicContact CD1-CG 4.4Å; L588-F663 HydrophobicContact CD1-CZ 3.85Å; L588-F663 HydrophobicContact CD2-CE1 4.49Å; L588-F663 HydrophobicContact CG-CE1 4.41Å; L588-F663 HydrophobicContact CG-CZ 4.21Å; I603-F663 HydrophobicContact CD1-CD2 4.31Å; I603-F663 HydrophobicContact CD1-CE2 4.12Å; I603-F663 HydrophobicContact CG2-CD2 4Å; I603-F663 HydrophobicContact CG2-CE2 3.94Å; I611-F663 HydrophobicContact CD1-CB 4.22Å; I611-F663 HydrophobicContact CD1-CD1 4.38Å; I611-F663 HydrophobicContact CD1-CG 4.38Å; I658-F663 HydrophobicContact CG2-CB 4.04Å; S659-F663 PolarHBondContact O-N 3.36Å; A660-F663 PolarHBondContact O-N 3.46Å; F663-A665 VanDerWaalsContact C-N 3.33Å; F663-A665 PolarHBondContact O-N 2.93Å; F663-W666 HydrophobicContact CD2-CE3 4.16Å; F663-W666 AromaticContact CE2-CE3 3.87Å; F663-W666 HydrophobicContact CE2-CE3 3.87Å; F663-W666 AromaticContact CE2-CZ3 3.91Å; F663-W666 HydrophobicContact CE2-CZ3 3.91Å; F663-W666 PolarHBondContact O-N 3.27Å; F663-S667 WeakPolarHBondContact O-CB 3.38Å; F663-S667 PolarHBondContact O-N 3.45Å
664	E	91.6	Very high	90	Very high	128 Å²	128	64.5 Å²	64.5	60%	0.598	33%	0.327	S	S	*	.	H	α-helix	trans	-66.3	-35.5	-179.3	-168.1	171.6	-158.6	0	0	112.4	A660 R668	A660-E664 WeakPolarHBondContact O-CB 3.46Å; A660-E664 PolarHBondContact O-N 3.35Å; E664-R668 PolarHBondContact O-N 3.24Å
665	A	92.2	Very high	89	Confident	41 Å²	41	71.4 Å²	71.4	34%	0.339	36%	0.363	S	S	.	.	H	α-helix	trans	-66.5	-40.5	171.6	0	0	0	0	0	112.2	S661 E662 F663 R669	S661-A665 WeakPolarHBondContact O-CB 3.23Å; S661-A665 PolarHBondContact O-N 3.38Å; S661-A665 VanDerWaalsContact O-N 3.15Å; E662-A665 PolarHBondContact O-N 3.25Å; F663-A665 VanDerWaalsContact C-N 3.33Å; F663-A665 PolarHBondContact O-N 2.93Å; A665-R669 PolarHBondContact O-N 3.27Å
666	W	93.6	Very high	88	Confident	5 Å²	5	71.9 Å²	71.9	2%	0.019	37%	0.37	C	S	.	.	H	α-helix	trans	-68.5	-43.1	176.1	178.1	87.1	0	0	0	112.5	A589 L591 I603 E662 F663 R668 R669 H670 V687 Y688 I691	A589-W666 HydrophobicContact CB-CH2 3.78Å; A589-W666 HydrophobicContact CB-CZ3 3.81Å; L591-W666 HydrophobicContact CD1-CH2 4.11Å; L591-W666 HydrophobicContact CD1-CZ2 4.31Å; L591-W666 HydrophobicContact CD2-CZ2 4.37Å; I603-W666 HydrophobicContact CD1-CE3 4.29Å; I603-W666 HydrophobicContact CD1-CH2 4.03Å; I603-W666 HydrophobicContact CD1-CZ3 3.91Å; E662-W666 WeakPolarHBondContact O-CB 3.36Å; E662-W666 PolarHBondContact O-N 3.06Å; F663-W666 HydrophobicContact CD2-CE3 4.16Å; F663-W666 AromaticContact CE2-CE3 3.87Å; F663-W666 HydrophobicContact CE2-CE3 3.87Å; F663-W666 AromaticContact CE2-CZ3 3.91Å; F663-W666 HydrophobicContact CE2-CZ3 3.91Å; F663-W666 PolarHBondContact O-N 3.27Å; W666-R668 VanDerWaalsContact C-N 3.27Å; W666-R668 PolarHBondContact O-N 2.98Å; W666-R669 PolarHBondContact O-N 3.48Å; W666-R669 VanDerWaalsContact O-N 3.09Å; W666-H670 HydrophobicContact CE3-CB 4.47Å; W666-H670 HydrophobicContact CH2-CB 4.27Å; W666-H670 HydrophobicContact CZ2-CB 4.35Å; W666-H670 HydrophobicContact CZ3-CB 4.33Å; W666-H670 WeakPolarHBondContact O-CB 3.49Å; W666-H670 PolarHBondContact O-N 3.33Å; W666-V687 HydrophobicContact CZ2-CG1 4.35Å; W666-V687 VanDerWaalsContact NE1-CG1 3.31Å; W666-V687 PolarHBondContact NE1-O 3.04Å; W666-Y688 HydrophobicContact CZ2-CD1 4.01Å; W666-Y688 HydrophobicContact CZ2-CE1 4.18Å; W666-I691 HydrophobicContact CB-CD1 4.03Å; W666-I691 HydrophobicContact CD2-CD1 3.48Å; W666-I691 VanDerWaalsContact CD2-CD1 3.48Å; W666-I691 HydrophobicContact CE3-CD1 4Å; W666-I691 HydrophobicContact CG-CB 4.31Å; W666-I691 HydrophobicContact CG-CD1 3.47Å; W666-I691 VanDerWaalsContact CG-CD1 3.47Å; W666-I691 HydrophobicContact CG-CG1 4.43Å; W666-I691 HydrophobicContact CZ2-CD1 4.49Å; W666-I691 HydrophobicContact CZ2-CG2 4.13Å
667	S	90.1	Very high	86.5	Confident	28 Å²	28	79.5 Å²	79.5	20%	0.196	41%	0.408	C	S	.	.	H	α-helix	trans	-59.3	-36.4	179.7	-177	0	0	0	0	112.3	F663 K671	F663-S667 WeakPolarHBondContact O-CB 3.38Å; F663-S667 PolarHBondContact O-N 3.45Å; S667-K671 WeakPolarHBondContact O-CG 3.3Å; S667-K671 PolarHBondContact O-N 3.46Å
668	R	89.6	Confident	85.3	Confident	161 Å²	161	80.9 Å²	80.9	61%	0.608	42%	0.419	S	S	*	.	H	α-helix	trans	-63	-49.9	172.4	-79.9	-174.7	-76.3	163.7	-6.7	112.4	E664 W666 H670 K671 E672	E664-R668 PolarHBondContact O-N 3.24Å; W666-R668 VanDerWaalsContact C-N 3.27Å; W666-R668 PolarHBondContact O-N 2.98Å; R668-H670 VanDerWaalsContact C-N 3.29Å; R668-H670 PolarHBondContact O-N 3.49Å; R668-K671 PolarHBondContact O-N 3.46Å; R668-E672 WeakPolarHBondContact O-CG 3.24Å; R668-E672 PolarHBondContact O-N 3.15Å
669	R	89.3	Confident	84.3	Confident	104 Å²	104	85 Å²	85	39%	0.392	44%	0.441	S	S	.	.	H	α-helix	trans	-62.9	-36.2	177.9	-67.7	-169.5	-68.8	148.1	-2.5	112.4	A665 W666 E672 A673 V687 D690	A665-R669 PolarHBondContact O-N 3.27Å; W666-R669 PolarHBondContact O-N 3.48Å; W666-R669 VanDerWaalsContact O-N 3.09Å; R669-E672 PolarHBondContact O-N 3.42Å; R669-A673 PolarHBondContact O-N 3.07Å; R669-V687 HydrophobicContact CB-CG1 4.47Å; R669-V687 HydrophobicContact CB-CG2 4.45Å; R669-D690 IonicContact CZ-OD2 3.44Å; R669-D690 IonicContact NH1-OD2 3.8Å; R669-D690 PolarHBondContact NH1-OD2 3.34Å; R669-D690 IonicContact NH2-OD2 2.66Å
670	H	86.9	Confident	83.4	Confident	23 Å²	23	87.5 Å²	87.5	11%	0.106	44%	0.442	C	S	.	.	H	α-helix	trans	-64.4	-46.6	176	-179.5	-104.2	0	0	0	111.9	W666 R668 E672 A673 Q674 V687 Y688	W666-H670 HydrophobicContact CE3-CB 4.47Å; W666-H670 HydrophobicContact CH2-CB 4.27Å; W666-H670 HydrophobicContact CZ2-CB 4.35Å; W666-H670 HydrophobicContact CZ3-CB 4.33Å; W666-H670 WeakPolarHBondContact O-CB 3.49Å; W666-H670 PolarHBondContact O-N 3.33Å; R668-H670 VanDerWaalsContact C-N 3.29Å; R668-H670 PolarHBondContact O-N 3.49Å; H670-E672 VanDerWaalsContact C-N 3.32Å; H670-E672 PolarHBondContact O-N 3.03Å; H670-A673 PolarHBondContact O-N 3.42Å; H670-Q674 PolarHBondContact CE1-NE2 2.86Å; H670-Q674 VanDerWaalsContact CE1-NE2 3.26Å; H670-Q674 WeakPolarHBondContact O-CG 3.42Å; H670-Q674 PolarHBondContact O-N 2.8Å; H670-V687 HydrophobicContact CB-CG1 4.05Å; H670-Y688 AromaticContact CD2-CE1 3.43Å; H670-Y688 VanDerWaalsContact CD2-CE1 3.43Å; H670-Y688 WeakPolarHBondContact CD2-CE1 3.48Å; H670-Y688 AromaticContact NE2-CE1 3.44Å; H670-Y688 WeakPolarHBondContact NE2-CE1 3.42Å; H670-Y688 AromaticContact NE2-CZ 3.76Å; H670-Y688 PolarHBondContact NE2-OH 3.19Å
671	K	83.5	Confident	82.5	Confident	127 Å²	127	91.1 Å²	91.1	55%	0.552	45%	0.447	S	S	*	.	H	α-helix	trans	-60	-40.6	174.1	-76.3	178.8	-179.2	176.9	0	112.5	S667 R668 Q674 L675	S667-K671 WeakPolarHBondContact O-CG 3.3Å; S667-K671 PolarHBondContact O-N 3.46Å; R668-K671 PolarHBondContact O-N 3.46Å; K671-Q674 PolarHBondContact O-N 2.87Å; K671-L675 WeakPolarHBondContact O-CG 3.5Å; K671-L675 PolarHBondContact O-N 3.25Å
672	E	84.5	Confident	82	Confident	135 Å²	135	88.5 Å²	88.5	63%	0.631	43%	0.431	S	S	*	.	H	α-helix	trans	-62.1	-43.9	175.3	-73.3	171.7	-176.2	0	0	111.9	R668 R669 H670 Q674 L675	R668-E672 WeakPolarHBondContact O-CG 3.24Å; R668-E672 PolarHBondContact O-N 3.15Å; R669-E672 PolarHBondContact O-N 3.42Å; H670-E672 VanDerWaalsContact C-N 3.32Å; H670-E672 PolarHBondContact O-N 3.03Å; E672-Q674 PolarHBondContact O-N 2.79Å; E672-L675 PolarHBondContact O-N 2.88Å
673	A	82.1	Confident	81.6	Confident	9 Å²	9	85.6 Å²	85.6	7%	0.074	42%	0.42	C	S	.	.	H	α-helix	trans	-65.2	-35.7	177	0	0	0	0	0	112.9	R669 H670 L675 N676 A683 L684 V687	R669-A673 PolarHBondContact O-N 3.07Å; H670-A673 PolarHBondContact O-N 3.42Å; A673-L675 VanDerWaalsContact C-N 3.29Å; A673-L675 PolarHBondContact O-N 3.33Å; A673-N676 WeakPolarHBondContact O-CB 3.48Å; A673-N676 PolarHBondContact O-N 2.96Å; A673-A683 HydrophobicContact CB-CB 4.2Å; A673-L684 HydrophobicContact CB-CD2 3.82Å; A673-L684 HydrophobicContact CB-CG 4.27Å; A673-V687 HydrophobicContact CB-CG2 4.04Å
674	Q	72.9	Confident	81.1	Confident	100 Å²	100	85.3 Å²	85.3	47%	0.467	42%	0.419	S	S	.	.	H	α-helix	trans	-64.8	-31.6	175.7	-75	-173.6	-36.2	0	0	113.4	H670 K671 E672 N676 L684	H670-Q674 PolarHBondContact CE1-NE2 2.86Å; H670-Q674 VanDerWaalsContact CE1-NE2 3.26Å; H670-Q674 WeakPolarHBondContact O-CG 3.42Å; H670-Q674 PolarHBondContact O-N 2.8Å; K671-Q674 PolarHBondContact O-N 2.87Å; E672-Q674 PolarHBondContact O-N 2.79Å; Q674-N676 VanDerWaalsContact C-N 3.29Å; Q674-L684 HydrophobicContact CG-CD2 3.73Å
675	L	75.9	Confident	80.8	Confident	146 Å²	146	81.2 Å²	81.2	76%	0.764	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84	-3.2	-179	-67.1	171	0	0	0	113.3	K671 E672 A673 M677	K671-L675 WeakPolarHBondContact O-CG 3.5Å; K671-L675 PolarHBondContact O-N 3.25Å; E672-L675 PolarHBondContact O-N 2.88Å; A673-L675 VanDerWaalsContact C-N 3.29Å; A673-L675 PolarHBondContact O-N 3.33Å; L675-M677 PolarHBondContact O-N 3.48Å
676	N	74.6	Confident	80.6	Confident	66 Å²	66	86.6 Å²	86.6	35%	0.353	41%	0.413	S	S	.	.			trans	-73.8	126.8	-178.9	-167.5	6.9	0	0	0	111.2	A673 Q674 V678 R680	A673-N676 WeakPolarHBondContact O-CB 3.48Å; A673-N676 PolarHBondContact O-N 2.96Å; Q674-N676 VanDerWaalsContact C-N 3.29Å; N676-V678 VanDerWaalsContact CG-O 3.24Å; N676-V678 PolarHBondContact ND2-O 2.95Å; N676-V678 PolarHBondContact OD1-N 3.44Å; N676-V678 PolarHBondContact OD1-O 3.02Å; N676-R680 WeakPolarHBondContact O-CB 3.5Å
677	M	61.8	Low	80.5	Confident	189 Å²	189	87.1 Å²	87.1	93%	0.931	42%	0.416	S	S	*	.	S	Bend	trans	-84.7	-22.9	-178.5	-66.7	-118.5	-158.1	0	0	113.2	L675	L675-M677 PolarHBondContact O-N 3.48Å
678	V	69.4	Low	80.6	Confident	112 Å²	112	87.1 Å²	87.1	68%	0.679	41%	0.412	S	S	*	.	S	Bend	trans	-114.8	121.4	-179	-176.5	0	0	0	0	108.1	N676	N676-V678 VanDerWaalsContact CG-O 3.24Å; N676-V678 PolarHBondContact ND2-O 2.95Å; N676-V678 PolarHBondContact OD1-N 3.44Å; N676-V678 PolarHBondContact OD1-O 3.02Å
679	D	72.1	Confident	80.6	Confident	97 Å²	97	82.3 Å²	82.3	52%	0.519	40%	0.397	S	S	.	.	S	Bend	trans	60.6	45.8	176.4	-164.6	25.9	0	0	0	113.8	E681 A682 A683 R686	D679-E681 VanDerWaalsContact C-N 3.32Å; D679-E681 PolarHBondContact O-N 2.93Å; D679-A682 VanDerWaalsContact OD1-CB 3.22Å; D679-A682 WeakPolarHBondContact OD1-CB 3.37Å; D679-A682 WeakPolarHBondContact OD2-CB 3.26Å; D679-A683 WeakPolarHBondContact O-CB 3.48Å; D679-A683 PolarHBondContact O-N 2.95Å; D679-A683 VanDerWaalsContact O-N 3.15Å; D679-R686 IonicContact OD2-NH2 3.52Å
680	R	74.6	Confident	80.6	Confident	111 Å²	111	80.4 Å²	80.4	42%	0.419	39%	0.394	S	S	.	.	H	α-helix	trans	-55.4	-44.2	-179.5	-173.9	-180	67.3	-179.6	-4.1	112.4	N676 A683 L684	N676-R680 WeakPolarHBondContact O-CB 3.5Å; R680-A683 PolarHBondContact O-N 3.12Å; R680-L684 HydrophobicContact CG-CD1 4.05Å; R680-L684 WeakPolarHBondContact O-CG 3.46Å; R680-L684 PolarHBondContact O-N 3.49Å
681	E	72.7	Confident	80.9	Confident	142 Å²	142	79.5 Å²	79.5	66%	0.664	39%	0.39	S	S	*	.	H	α-helix	trans	-64.9	-50.6	-175.5	-70.4	179.6	170.9	0	0	111.7	D679 A683 L684 D685	D679-E681 VanDerWaalsContact C-N 3.32Å; D679-E681 PolarHBondContact O-N 2.93Å; E681-A683 VanDerWaalsContact C-N 3.28Å; E681-A683 PolarHBondContact O-N 3.47Å; E681-L684 PolarHBondContact O-N 2.85Å; E681-L684 VanDerWaalsContact O-N 3.14Å; E681-D685 PolarHBondContact O-N 3.26Å
682	A	80.4	Confident	81.4	Confident	34 Å²	34	73.4 Å²	73.4	28%	0.281	36%	0.364	S	S	.	.	H	α-helix	trans	-67.7	-28.7	178.3	0	0	0	0	0	112.9	D679 R686	D679-A682 VanDerWaalsContact OD1-CB 3.22Å; D679-A682 WeakPolarHBondContact OD1-CB 3.37Å; D679-A682 WeakPolarHBondContact OD2-CB 3.26Å; A682-R686 WeakPolarHBondContact O-CG 3.33Å; A682-R686 PolarHBondContact O-N 3.41Å; A682-R686 PolarHBondContact O-NE 3.46Å; A682-R686 VanDerWaalsContact O-NE 3.12Å
683	A	83.1	Confident	81.8	Confident	12 Å²	12	71.4 Å²	71.4	10%	0.099	35%	0.353	C	S	.	.	H	α-helix	trans	-65.4	-43.9	171.4	0	0	0	0	0	111.9	A673 D679 R680 E681 V687	A673-A683 HydrophobicContact CB-CB 4.2Å; D679-A683 WeakPolarHBondContact O-CB 3.48Å; D679-A683 PolarHBondContact O-N 2.95Å; D679-A683 VanDerWaalsContact O-N 3.15Å; R680-A683 PolarHBondContact O-N 3.12Å; E681-A683 VanDerWaalsContact C-N 3.28Å; E681-A683 PolarHBondContact O-N 3.47Å; A683-V687 PolarHBondContact O-N 2.99Å
684	L	83.3	Confident	82.3	Confident	22 Å²	22	75.6 Å²	75.6	12%	0.115	37%	0.374	C	S	.	.	H	α-helix	trans	-64.9	-43.9	176.2	-73.7	169.5	0	0	0	111.9	A673 Q674 R680 E681 R686 V687 Y688	A673-L684 HydrophobicContact CB-CD2 3.82Å; A673-L684 HydrophobicContact CB-CG 4.27Å; Q674-L684 HydrophobicContact CG-CD2 3.73Å; R680-L684 HydrophobicContact CG-CD1 4.05Å; R680-L684 WeakPolarHBondContact O-CG 3.46Å; R680-L684 PolarHBondContact O-N 3.49Å; E681-L684 PolarHBondContact O-N 2.85Å; E681-L684 VanDerWaalsContact O-N 3.14Å; L684-R686 VanDerWaalsContact C-N 3.31Å; L684-R686 PolarHBondContact O-N 2.85Å; L684-V687 PolarHBondContact O-N 3.32Å; L684-Y688 HydrophobicContact CB-CE2 4.09Å; L684-Y688 VanDerWaalsContact O-CG 3.25Å; L684-Y688 PolarHBondContact O-N 2.98Å
685	D	85	Confident	83.3	Confident	41 Å²	41	70.8 Å²	70.8	22%	0.219	35%	0.352	C	S	.	.	H	α-helix	trans	-61.4	-38.5	-179.4	-80.5	-12	0	0	0	112.4	R597 E681 V687 Y688 E689	R597-D685 WeakPolarHBondContact CD-OD1 3.39Å; E681-D685 PolarHBondContact O-N 3.26Å; D685-V687 VanDerWaalsContact C-N 3.34Å; D685-V687 PolarHBondContact O-N 2.87Å; D685-Y688 WeakPolarHBondContact O-CB 3.31Å; D685-Y688 PolarHBondContact O-N 3.34Å; D685-E689 WeakPolarHBondContact O-CB 3.36Å; D685-E689 PolarHBondContact O-N 3.28Å
686	R	87.8	Confident	84.2	Confident	155 Å²	155	66.4 Å²	66.4	59%	0.585	33%	0.328	S	S	*	.	H	α-helix	trans	-60.7	-40.6	172.5	-76.8	179.3	-77.2	-146.3	-4	112.8	D679 A682 L684 Y688 E689 D690	D679-R686 IonicContact OD2-NH2 3.52Å; A682-R686 WeakPolarHBondContact O-CG 3.33Å; A682-R686 PolarHBondContact O-N 3.41Å; A682-R686 PolarHBondContact O-NE 3.46Å; A682-R686 VanDerWaalsContact O-NE 3.12Å; L684-R686 VanDerWaalsContact C-N 3.31Å; L684-R686 PolarHBondContact O-N 2.85Å; R686-Y688 VanDerWaalsContact C-N 3.34Å; R686-E689 WeakPolarHBondContact O-CB 3.48Å; R686-E689 PolarHBondContact O-N 2.94Å; R686-D690 PolarHBondContact O-N 3.46Å
687	V	91.3	Very high	85.1	Confident	15 Å²	15	64.2 Å²	64.2	9%	0.091	32%	0.316	C	S	.	.	H	α-helix	trans	-70.1	-34.4	178.3	175	0	0	0	0	111.2	W666 R669 H670 A673 A683 L684 D685	W666-V687 HydrophobicContact CZ2-CG1 4.35Å; W666-V687 VanDerWaalsContact NE1-CG1 3.31Å; W666-V687 PolarHBondContact NE1-O 3.04Å; R669-V687 HydrophobicContact CB-CG1 4.47Å; R669-V687 HydrophobicContact CB-CG2 4.45Å; H670-V687 HydrophobicContact CB-CG1 4.05Å; A673-V687 HydrophobicContact CB-CG2 4.04Å; A683-V687 PolarHBondContact O-N 2.99Å; L684-V687 PolarHBondContact O-N 3.32Å; D685-V687 VanDerWaalsContact C-N 3.34Å; D685-V687 PolarHBondContact O-N 2.87Å
688	Y	91.8	Very high	86.7	Confident	28 Å²	28	55.6 Å²	55.6	11%	0.11	27%	0.274	C	S	.	.	H	α-helix	trans	-67.1	-45.1	173.4	-63.6	-18.8	0	0	0	112	L591 W666 H670 L684 D685 R686 D690 I691 E692	L591-Y688 HydrophobicContact CD2-CD1 3.38Å; L591-Y688 HydrophobicContact CD2-CD2 4.47Å; L591-Y688 HydrophobicContact CD2-CE1 4.05Å; L591-Y688 HydrophobicContact CD2-CG 3.62Å; L591-Y688 HydrophobicContact CG-CD1 3.62Å; L591-Y688 HydrophobicContact CG-CE1 3.75Å; L591-Y688 HydrophobicContact CG-CG 4.06Å; W666-Y688 HydrophobicContact CZ2-CD1 4.01Å; W666-Y688 HydrophobicContact CZ2-CE1 4.18Å; H670-Y688 AromaticContact CD2-CE1 3.43Å; H670-Y688 VanDerWaalsContact CD2-CE1 3.43Å; H670-Y688 WeakPolarHBondContact CD2-CE1 3.48Å; H670-Y688 AromaticContact NE2-CE1 3.44Å; H670-Y688 WeakPolarHBondContact NE2-CE1 3.42Å; H670-Y688 AromaticContact NE2-CZ 3.76Å; H670-Y688 PolarHBondContact NE2-OH 3.19Å; L684-Y688 HydrophobicContact CB-CE2 4.09Å; L684-Y688 VanDerWaalsContact O-CG 3.25Å; L684-Y688 PolarHBondContact O-N 2.98Å; D685-Y688 WeakPolarHBondContact O-CB 3.31Å; D685-Y688 PolarHBondContact O-N 3.34Å; R686-Y688 VanDerWaalsContact C-N 3.34Å; Y688-D690 PolarHBondContact O-N 3.24Å; Y688-I691 WeakPolarHBondContact O-CG2 3.28Å; Y688-I691 PolarHBondContact O-N 2.63Å; Y688-E692 VanDerWaalsContact O-CG 3.27Å; Y688-E692 WeakPolarHBondContact O-CG 3.33Å; Y688-E692 PolarHBondContact O-N 2.87Å
689	E	89.6	Confident	87.9	Confident	60 Å²	60	50.3 Å²	50.3	28%	0.28	24%	0.242	S	C	.	.	H	α-helix	trans	-53.5	-37.7	176.5	-158.5	75.2	-160.3	0	0	112.5	R599 R625 D685 R686 K693	R599-E689 IonicContact CZ-OE2 2.86Å; R599-E689 IonicContact NH1-OE2 2.86Å; R599-E689 IonicContact NH2-OE1 2.78Å; R599-E689 IonicContact NH2-OE2 3.29Å; R599-E689 PolarHBondContact NH2-OE2 3.24Å; R625-E689 IonicContact CZ-OE1 2.86Å; R625-E689 IonicContact NE-OE1 3.99Å; R625-E689 PolarHBondContact NE-OE1 3.44Å; R625-E689 IonicContact NH2-OE1 2.9Å; R625-E689 PolarHBondContact NH2-OE1 3.07Å; R625-E689 IonicContact NH2-OE2 4Å; D685-E689 WeakPolarHBondContact O-CB 3.36Å; D685-E689 PolarHBondContact O-N 3.28Å; R686-E689 WeakPolarHBondContact O-CB 3.48Å; R686-E689 PolarHBondContact O-N 2.94Å; E689-K693 WeakPolarHBondContact O-CE 3.35Å; E689-K693 WeakPolarHBondContact O-CG 3.36Å
690	D	90.4	Very high	88.9	Confident	64 Å²	64	45.7 Å²	45.7	34%	0.342	22%	0.217	S	C	.	.	H	α-helix	trans	-70.5	-39.7	-176	-85	-11.2	0	0	0	114.1	R669 R686 Y688 K693	R669-D690 IonicContact CZ-OD2 3.44Å; R669-D690 IonicContact NH1-OD2 3.8Å; R669-D690 PolarHBondContact NH1-OD2 3.34Å; R669-D690 IonicContact NH2-OD2 2.66Å; R686-D690 PolarHBondContact O-N 3.46Å; Y688-D690 PolarHBondContact O-N 3.24Å; D690-K693 IonicContact OD1-NZ 3.36Å; D690-K693 PolarHBondContact OD1-NZ 2.61Å
691	I	93.2	Very high	89.9	Confident	4 Å²	4	40.4 Å²	40.4	2%	0.021	20%	0.197	C	C	.	.	H	α-helix	trans	-79.5	-24.7	-177.8	-164.5	155.7	0	0	0	112.2	L591 I603 L613 K656 I658 W666 Y688 K693	L591-I691 HydrophobicContact CD2-CG2 4.09Å; I603-I691 HydrophobicContact CD1-CD1 3.6Å; L613-I691 HydrophobicContact CD1-CG1 4.02Å; L613-I691 HydrophobicContact CD1-CG2 4.12Å; K656-I691 PolarHBondContact NZ-O 2.96Å; I658-I691 HydrophobicContact CD1-CD1 3.78Å; I658-I691 HydrophobicContact CD1-CG1 3.76Å; W666-I691 HydrophobicContact CB-CD1 4.03Å; W666-I691 HydrophobicContact CD2-CD1 3.48Å; W666-I691 VanDerWaalsContact CD2-CD1 3.48Å; W666-I691 HydrophobicContact CE3-CD1 4Å; W666-I691 HydrophobicContact CG-CB 4.31Å; W666-I691 HydrophobicContact CG-CD1 3.47Å; W666-I691 VanDerWaalsContact CG-CD1 3.47Å; W666-I691 HydrophobicContact CG-CG1 4.43Å; W666-I691 HydrophobicContact CZ2-CD1 4.49Å; W666-I691 HydrophobicContact CZ2-CG2 4.13Å; Y688-I691 WeakPolarHBondContact O-CG2 3.28Å; Y688-I691 PolarHBondContact O-N 2.63Å; I691-K693 VanDerWaalsContact C-N 3.3Å; I691-K693 PolarHBondContact O-N 3.28Å
692	E	93.5	Very high	90.8	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.5	14	-176.6	-64.2	174.2	141.4	0	0	114.1	L591 R597 R599 S601 Y688 L695	L591-E692 HydrophobicContact CD2-CG 4.42Å; R597-E692 IonicContact CZ-OE1 3.74Å; R597-E692 IonicContact NE-OE2 3.92Å; R597-E692 IonicContact NH2-OE1 3.8Å; R597-E692 PolarHBondContact NH2-OE1 3.4Å; R597-E692 IonicContact NH2-OE2 2.69Å; R597-E692 PolarHBondContact NH2-OE2 3.32Å; R599-E692 IonicContact CZ-OE2 2.74Å; R599-E692 IonicContact NE-OE1 3.74Å; R599-E692 IonicContact NE-OE2 3.76Å; R599-E692 PolarHBondContact NE-OE2 3.07Å; R599-E692 IonicContact NH2-OE2 2.61Å; R599-E692 PolarHBondContact NH2-OE2 2.95Å; S601-E692 WeakPolarHBondContact CB-OE1 3.44Å; S601-E692 PolarHBondContact OG-OE1 3.49Å; Y688-E692 VanDerWaalsContact O-CG 3.27Å; Y688-E692 WeakPolarHBondContact O-CG 3.33Å; Y688-E692 PolarHBondContact O-N 2.87Å; E692-L695 WeakPolarHBondContact O-CD1 3.37Å; E692-L695 WeakPolarHBondContact O-CG 3.21Å
693	K	91.6	Very high	91.2	Very high	92 Å²	92	32 Å²	32	40%	0.4	15%	0.152	S	C	.	.	S	Bend	trans	-89.2	150	173.9	-70.6	164.6	-173.4	163.7	0	111.8	K656 E689 D690 I691	K656-K693 WeakPolarHBondContact CD-O 3.29Å; E689-K693 WeakPolarHBondContact O-CE 3.35Å; E689-K693 WeakPolarHBondContact O-CG 3.36Å; D690-K693 IonicContact OD1-NZ 3.36Å; D690-K693 PolarHBondContact OD1-NZ 2.61Å; I691-K693 VanDerWaalsContact C-N 3.3Å; I691-K693 PolarHBondContact O-N 3.28Å
694	N	92.9	Very high	91.3	Very high	97 Å²	97	34.5 Å²	34.5	52%	0.519	16%	0.162	S	C	.	.	S	Bend	trans	63.5	46.2	178.1	-56.3	-48.7	0	0	0	113.8	R625	R625-N694 WeakPolarHBondContact O-CA 3.24Å; R625-N694 PolarHBondContact O-N 3.38Å
695	L	94.3	Very high	91.3	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	16%	0.159	C	C	.	.	B	Isolated β-bridge	trans	-74.2	147.5	178.1	-61.8	174.4	0	0	0	111.8	L613 C615 I622 R625 L626 S627 T630 C654 K656 E692	L613-L695 HydrophobicContact CD2-CD2 3.64Å; C615-L695 HydrophobicContact CB-CD1 4.11Å; C615-L695 HydrophobicContact CB-CD2 4.49Å; I622-L695 HydrophobicContact CD1-CD1 4.42Å; R625-L695 HydrophobicContact CB-CD1 4.22Å; R625-L695 PolarHBondContact O-N 3.29Å; L626-L695 CarbonylContact C-O 3.53Å; L626-L695 WeakPolarHBondContact CA-O 3.32Å; L626-L695 HydrophobicContact CD2-CB 4.32Å; L626-L695 WeakPolarHBondContact CD2-O 3.36Å; S627-L695 PolarHBondContact N-O 3.27Å; T630-L695 PolarHBondContact OG1-O 3.13Å; C654-L695 HydrophobicContact CB-CB 3.92Å; C654-L695 HydrophobicContact CB-CD1 4.35Å; K656-L695 HydrophobicContact CB-CD2 3.95Å; E692-L695 WeakPolarHBondContact O-CD1 3.37Å; E692-L695 WeakPolarHBondContact O-CG 3.21Å
696	M	94.5	Very high	91.2	Very high	54 Å²	54	35.2 Å²	35.2	27%	0.266	16%	0.162	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	124.1	172.9	-60.9	-61.5	-67.3	0	0	109.8	C654 Y655	C654-M696 CarbonylContact C-O 3.56Å; C654-M696 WeakPolarHBondContact CA-O 3.36Å; C654-M696 VanDerWaalsContact CB-O 3.28Å; C654-M696 WeakPolarHBondContact CB-O 3.44Å; Y655-M696 HydrophobicContact CD1-CB 4.12Å; Y655-M696 HydrophobicContact CE1-CB 3.81Å; Y655-M696 PolarHBondContact N-O 2.89Å; Y655-M696 PolarHBondContact O-N 2.99Å
697	L	94.8	Very high	91.2	Very high	20 Å²	20	29.3 Å²	29.3	11%	0.105	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	131.5	178.5	-173	68.3	0	0	0	110.9	L626 T630 T636 C652	L626-L697 HydrophobicContact CD1-CB 4.24Å; L626-L697 HydrophobicContact CD1-CD2 4.33Å; L626-L697 HydrophobicContact CD2-CB 3.83Å; L626-L697 HydrophobicContact CD2-CD1 4.45Å; T630-L697 HydrophobicContact CG2-CB 3.29Å; T630-L697 HydrophobicContact CG2-CD2 4.48Å; T636-L697 HydrophobicContact CG2-CD2 3.85Å; C652-L697 HydrophobicContact CB-CD1 4.18Å
698	I	94.3	Very high	91.1	Very high	8 Å²	8	29.4 Å²	29.4	4%	0.041	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	-43.4	170.6	-56.2	171.1	0	0	0	109.7	A468 E522 F523 L526 L653 Y655	A468-I698 PolarHBondContact N-O 3.39Å; E522-I698 HydrophobicContact CG-CD1 4.06Å; F523-I698 HydrophobicContact CB-CG2 3.89Å; F523-I698 HydrophobicContact CD2-CG2 4.02Å; F523-I698 HydrophobicContact CG-CG2 4.47Å; L526-I698 HydrophobicContact CD1-CD1 3.68Å; L653-I698 PolarHBondContact O-N 2.79Å; Y655-I698 HydrophobicContact CD1-CD1 3.61Å; Y655-I698 HydrophobicContact CD1-CG1 3.45Å; Y655-I698 VanDerWaalsContact CD1-CG1 3.45Å; Y655-I698 HydrophobicContact CE1-CD1 4.33Å; Y655-I698 HydrophobicContact CE1-CG1 3.83Å; Y655-I698 HydrophobicContact CG-CD1 4.37Å
699	G	94.6	Very high	90.9	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	169.8	-163.5	-174.2	0	0	0	0	0	112.6	T466 L653	T466-G699 CarbonylContact O-C 3.45Å; T466-G699 WeakPolarHBondContact O-CA 3.46Å; L653-G699 PolarHBondContact N-O 2.82Å; L653-G699 PolarHBondContact O-N 2.91Å
700	A	94.2	Very high	91	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142	152.3	175.2	0	0	0	0	0	112.6	C465 T466 T636 L640 L651	C465-A700 CarbonylContact C-O 3.51Å; C465-A700 VanDerWaalsContact CA-O 3.23Å; C465-A700 WeakPolarHBondContact CA-O 3.26Å; C465-A700 WeakPolarHBondContact CB-O 3.11Å; T466-A700 HydrophobicContact CG2-CB 3.76Å; T466-A700 PolarHBondContact N-O 2.96Å; T466-A700 PolarHBondContact O-N 2.89Å; T636-A700 HydrophobicContact CG2-CB 4.24Å; L640-A700 HydrophobicContact CD2-CB 3.56Å; L640-A700 HydrophobicContact CG-CB 4.18Å; L651-A700 CarbonylContact O-C 3.49Å; L651-A700 WeakPolarHBondContact O-CA 3.31Å; L651-A700 WeakPolarHBondContact O-CB 3.44Å
701	T	94.4	Very high	91.1	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	152.4	176.9	63.3	0	0	0	0	110.3	F462 F523 L527 L555 T650 L651 L653	F462-T701 HydrophobicContact CE2-CG2 3.92Å; F523-T701 HydrophobicContact CE1-CG2 4.21Å; F523-T701 HydrophobicContact CE2-CG2 4.36Å; F523-T701 HydrophobicContact CZ-CG2 3.56Å; L527-T701 HydrophobicContact CD1-CG2 4.23Å; L527-T701 HydrophobicContact CD2-CG2 4.14Å; L555-T701 HydrophobicContact CD2-CG2 3.74Å; T650-T701 VanDerWaalsContact CA-O 3.28Å; T650-T701 WeakPolarHBondContact CA-O 2.98Å; L651-T701 PolarHBondContact N-O 3.46Å; L651-T701 VanDerWaalsContact N-O 3.08Å; L651-T701 PolarHBondContact O-N 3.25Å; L651-T701 PolarHBondContact O-OG1 3.21Å; L653-T701 HydrophobicContact CD1-CG2 3.84Å; L653-T701 HydrophobicContact CD2-CG2 4.48Å; L653-T701 HydrophobicContact CG-CG2 4.21Å
702	A	90.9	Very high	91.1	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	119.7	172.9	0	0	0	0	0	110.5	K463 K464 F643 L648 R649	K463-A702 PolarHBondContact N-O 2.86Å; K464-A702 HydrophobicContact CB-CB 3.99Å; K464-A702 PolarHBondContact N-O 2.55Å; K464-A702 WeakPolarHBondContact O-CA 3.02Å; K464-A702 WeakPolarHBondContact O-CB 3.43Å; K464-A702 PolarHBondContact O-N 3.05Å; F643-A702 HydrophobicContact CB-CB 4Å; F643-A702 HydrophobicContact CD1-CB 4.37Å; F643-A702 HydrophobicContact CD2-CB 3.69Å; F643-A702 HydrophobicContact CE2-CB 4.22Å; F643-A702 HydrophobicContact CG-CB 3.77Å; L648-A702 HydrophobicContact CB-CB 3.92Å; L648-A702 HydrophobicContact CD1-CB 3.75Å; L648-A702 HydrophobicContact CG-CB 4.46Å; R649-A702 CarbonylContact O-C 3.54Å; R649-A702 VanDerWaalsContact O-CA 3.31Å; R649-A702 WeakPolarHBondContact O-CA 3.35Å
703	I	89.1	Confident	91.1	Very high	1 Å²	1	35.1 Å²	35.1	1%	0.005	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	130.6	-174.5	-54.7	173.6	0	0	0	108.8	M460 Q461 D551 A554 L555 R649	M460-I703 HydrophobicContact CB-CG2 3.8Å; M460-I703 HydrophobicContact SD-CG2 4.45Å; Q461-I703 CarbonylContact O-C 3.58Å; Q461-I703 WeakPolarHBondContact O-CA 3.3Å; D551-I703 HydrophobicContact CB-CD1 4.2Å; A554-I703 HydrophobicContact CB-CG2 4.48Å; L555-I703 HydrophobicContact CD1-CD1 4.25Å; L555-I703 HydrophobicContact CD2-CD1 3.84Å; L555-I703 HydrophobicContact CD2-CG1 4.28Å; L555-I703 HydrophobicContact CG-CD1 3.82Å; R649-I703 HydrophobicContact CB-CB 4.44Å; R649-I703 PolarHBondContact N-O 3.42Å; R649-I703 PolarHBondContact O-N 3.15Å
704	E	85.3	Confident	91.3	Very high	63 Å²	63	30.7 Å²	30.7	29%	0.294	16%	0.16	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	130.1	173.5	-174.5	-178.4	-136	0	0	110.3	M460 Q461 K463 L648	M460-E704 WeakPolarHBondContact CA-O 3.49Å; Q461-E704 PolarHBondContact N-O 3.45Å; Q461-E704 PolarHBondContact O-N 3.16Å; K463-E704 WeakPolarHBondContact CE-OE2 3.34Å; K463-E704 HydrophobicContact CG-CB 3.66Å; K463-E704 IonicContact NZ-OE2 2.74Å; K463-E704 PolarHBondContact NZ-OE2 3.19Å; L648-E704 HydrophobicContact CD2-CB 3.66Å; L648-E704 HydrophobicContact CD2-CG 4.17Å
705	D	83	Confident	91.4	Very high	10 Å²	10	26.3 Å²	26.3	5%	0.053	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	98	165.9	-172.6	-2.9	0	0	0	107.7	K451 T456 M460 R649 L707 I739	K451-D705 IonicContact NZ-OD2 3.75Å; K451-D705 PolarHBondContact NZ-OD2 3.45Å; K451-D705 VanDerWaalsContact NZ-OD2 3.11Å; T456-D705 WeakPolarHBondContact CB-OD1 3.45Å; T456-D705 WeakPolarHBondContact CG2-OD1 3.36Å; T456-D705 PolarHBondContact OG1-OD1 3.1Å; T456-D705 VanDerWaalsContact OG1-OD1 3.08Å; M460-D705 HydrophobicContact CE-CB 4.11Å; M460-D705 HydrophobicContact SD-CB 3.72Å; R649-D705 IonicContact CZ-OD2 3.59Å; R649-D705 IonicContact NE-OD2 3.67Å; R649-D705 IonicContact NH2-OD2 3.46Å; R649-D705 PolarHBondContact NH2-OD2 3.27Å; D705-L707 PolarHBondContact O-N 3.17Å; D705-I739 HydrophobicContact CB-CD1 4.43Å
706	K	83.3	Confident	91.3	Very high	69 Å²	69	27.7 Å²	27.7	30%	0.3	15%	0.148	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	128.7	-167.7	-170	-174.4	170.7	-158.9	0	111.4	T456 Q457 I459	T456-K706 CarbonylContact C-O 3.56Å; T456-K706 WeakPolarHBondContact CA-O 3.44Å; T456-K706 WeakPolarHBondContact CB-O 3.21Å; Q457-K706 PolarHBondContact N-O 3.27Å; I459-K706 PolarHBondContact O-N 2.96Å
707	L	88.2	Confident	91.2	Very high	31 Å²	31	26.8 Å²	26.8	16%	0.162	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65	152.7	172.1	-62.8	-177.7	0	0	0	112.2	L455 T456 Q457 D705 P712 I739 S742 C743	L455-L707 WeakPolarHBondContact O-CA 3.5Å; T456-L707 HydrophobicContact CG2-CD2 4.12Å; Q457-L707 PolarHBondContact NE2-O 2.78Å; D705-L707 PolarHBondContact O-N 3.17Å; L707-P712 HydrophobicContact CD1-CG 4.02Å; L707-I739 HydrophobicContact CD2-CD1 4.17Å; L707-I739 HydrophobicContact CD2-CG2 4.29Å; L707-S742 WeakPolarHBondContact CD1-O 3.32Å; L707-C743 VanDerWaalsContact CD2-SG 3.54Å
708	Q	88.9	Confident	91.2	Very high	17 Å²	17	25.8 Å²	25.8	8%	0.079	14%	0.139	C	C	.	.	P	Polyproline II helix	trans	-65	153.5	166.2	-57.3	-165.2	6	0	0	110.9	G453 T454 L455 Q457 G710 V711	G453-Q708 PolarHBondContact O-NE2 2.96Å; T454-Q708 PolarHBondContact O-NE2 3.42Å; T454-Q708 VanDerWaalsContact O-NE2 3.08Å; L455-Q708 PolarHBondContact O-N 3.06Å; Q457-Q708 HydrophobicContact CG-CB 4.28Å; Q457-Q708 HydrophobicContact CG-CG 3.88Å; Q708-G710 PolarHBondContact O-N 3.44Å; Q708-V711 HydrophobicContact CB-CG2 3.62Å; Q708-V711 WeakPolarHBondContact O-CG2 3.41Å; Q708-V711 PolarHBondContact O-N 2.99Å
709	D	88.9	Confident	91.1	Very high	85 Å²	85	28.2 Å²	28.2	46%	0.455	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	132.1	-177.7	-56.2	-35.1	0	0	0	110.3	Q457 V711 S924	Q457-D709 PolarHBondContact NE2-OD1 3.03Å; D709-V711 VanDerWaalsContact C-N 3.31Å; D709-V711 PolarHBondContact O-N 3.39Å; D709-S924 WeakPolarHBondContact O-CB 3.29Å
710	G	90.3	Very high	91	Very high	26 Å²	26	34.3 Å²	34.3	27%	0.268	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	73.9	9.5	177.7	0	0	0	0	0	116	Q708 T714	Q708-G710 PolarHBondContact O-N 3.44Å; G710-T714 VanDerWaalsContact O-CB 3.26Å; G710-T714 WeakPolarHBondContact O-CB 3.32Å; G710-T714 PolarHBondContact O-N 3.11Å; G710-T714 PolarHBondContact O-OG1 2.72Å
711	V	93.9	Very high	90.9	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-58.7	-51	177.6	167.1	0	0	0	0	113	L455 Q708 D709 E713 T714 I715 C743 F923	L455-V711 HydrophobicContact CB-CG1 4.48Å; L455-V711 HydrophobicContact CD2-CG1 3.81Å; Q708-V711 HydrophobicContact CB-CG2 3.62Å; Q708-V711 WeakPolarHBondContact O-CG2 3.41Å; Q708-V711 PolarHBondContact O-N 2.99Å; D709-V711 VanDerWaalsContact C-N 3.31Å; D709-V711 PolarHBondContact O-N 3.39Å; V711-E713 VanDerWaalsContact C-N 3.35Å; V711-E713 PolarHBondContact O-N 3.45Å; V711-T714 PolarHBondContact O-N 3.41Å; V711-I715 HydrophobicContact CG1-CD1 3.78Å; V711-I715 WeakPolarHBondContact O-CG1 3.45Å; V711-I715 PolarHBondContact O-N 3.25Å; V711-C743 HydrophobicContact CG1-CB 4.44Å; V711-F923 HydrophobicContact CB-CD1 4.43Å; V711-F923 HydrophobicContact CG1-CD1 4.42Å; V711-F923 HydrophobicContact CG2-CB 4Å; V711-F923 HydrophobicContact CG2-CD1 3.85Å; V711-F923 HydrophobicContact CG2-CG 4.16Å
712	P	92.3	Very high	90.8	Very high	28 Å²	28	36 Å²	36	18%	0.182	20%	0.204	C	C	.	.	H	α-helix	trans	-61.6	-42.4	-179	-22.6	33.9	0	0	0	112.7	L707 T714 I715 A716 Q744	L707-P712 HydrophobicContact CD1-CG 4.02Å; P712-T714 VanDerWaalsContact C-N 3.35Å; P712-T714 PolarHBondContact O-N 3.37Å; P712-I715 PolarHBondContact O-N 3.44Å; P712-A716 WeakPolarHBondContact O-CB 3.5Å; P712-A716 PolarHBondContact O-N 3.04Å; P712-Q744 HydrophobicContact CB-CG 4.22Å
713	E	93.6	Very high	90.9	Very high	136 Å²	136	36.2 Å²	36.2	64%	0.636	21%	0.205	S	C	*	.	H	α-helix	trans	-63.2	-41.7	177.9	-62.3	178.5	179.1	0	0	111.7	V711 A716 N717	V711-E713 VanDerWaalsContact C-N 3.35Å; V711-E713 PolarHBondContact O-N 3.45Å; E713-A716 PolarHBondContact O-N 3.24Å; E713-N717 WeakPolarHBondContact O-CB 3.33Å; E713-N717 VanDerWaalsContact O-CG 3.3Å; E713-N717 PolarHBondContact O-N 3.12Å; E713-N717 PolarHBondContact O-ND2 3.25Å
714	T	95.3	Very high	91.1	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-64.1	-47.5	178.3	-62.5	0	0	0	0	111.1	G710 V711 P712 A716 N717 L718 F923 S924 Q927	G710-T714 VanDerWaalsContact O-CB 3.26Å; G710-T714 WeakPolarHBondContact O-CB 3.32Å; G710-T714 PolarHBondContact O-N 3.11Å; G710-T714 PolarHBondContact O-OG1 2.72Å; V711-T714 PolarHBondContact O-N 3.41Å; P712-T714 VanDerWaalsContact C-N 3.35Å; P712-T714 PolarHBondContact O-N 3.37Å; T714-A716 VanDerWaalsContact C-N 3.34Å; T714-A716 PolarHBondContact O-N 3.2Å; T714-N717 PolarHBondContact O-N 2.74Å; T714-L718 HydrophobicContact CG2-CD1 3.86Å; T714-L718 HydrophobicContact CG2-CG 4.4Å; T714-L718 WeakPolarHBondContact O-CB 3.25Å; T714-L718 VanDerWaalsContact O-CG 3.23Å; T714-L718 WeakPolarHBondContact O-CG 3.45Å; T714-L718 PolarHBondContact O-N 3.17Å; T714-F923 HydrophobicContact CG2-CD1 3.91Å; T714-F923 HydrophobicContact CG2-CE1 3.63Å; T714-S924 WeakPolarHBondContact OG1-CA 3.35Å; T714-Q927 HydrophobicContact CG2-CB 3.96Å; T714-Q927 HydrophobicContact CG2-CG 3.91Å
715	I	94.8	Very high	91.5	Very high	4 Å²	4	36.1 Å²	36.1	2%	0.021	20%	0.204	C	C	.	.	H	α-helix	trans	-59.9	-45.8	176.8	-74.1	171.3	0	0	0	110.5	L455 V711 P712 N717 L718 A719 I725 C743 L745 F923	L455-I715 HydrophobicContact CD2-CD1 4.11Å; V711-I715 HydrophobicContact CG1-CD1 3.78Å; V711-I715 WeakPolarHBondContact O-CG1 3.45Å; V711-I715 PolarHBondContact O-N 3.25Å; P712-I715 PolarHBondContact O-N 3.44Å; I715-N717 PolarHBondContact O-N 3.41Å; I715-L718 PolarHBondContact O-N 3.25Å; I715-A719 WeakPolarHBondContact O-CB 3.43Å; I715-A719 PolarHBondContact O-N 3.09Å; I715-I725 HydrophobicContact CB-CD1 4.25Å; I715-I725 HydrophobicContact CG1-CD1 3.92Å; I715-I725 HydrophobicContact CG2-CD1 4.14Å; I715-C743 HydrophobicContact CD1-CB 3.71Å; I715-L745 HydrophobicContact CG2-CD1 4.4Å; I715-F923 HydrophobicContact CG1-CE1 4.01Å; I715-F923 HydrophobicContact CG1-CZ 4.28Å
716	A	92.4	Very high	92.1	Very high	29 Å²	29	35.7 Å²	35.7	24%	0.24	20%	0.202	C	C	.	.	H	α-helix	trans	-61.8	-40.9	177.9	0	0	0	0	0	112.6	P712 E713 T714 K720	P712-A716 WeakPolarHBondContact O-CB 3.5Å; P712-A716 PolarHBondContact O-N 3.04Å; E713-A716 PolarHBondContact O-N 3.24Å; T714-A716 VanDerWaalsContact C-N 3.34Å; T714-A716 PolarHBondContact O-N 3.2Å; A716-K720 VanDerWaalsContact O-CG 3.31Å; A716-K720 WeakPolarHBondContact O-CG 3.21Å; A716-K720 PolarHBondContact O-N 3.38Å
717	N	93.6	Very high	92.7	Very high	35 Å²	35	32.7 Å²	32.7	19%	0.187	19%	0.189	C	C	.	.	H	α-helix	trans	-68.8	-40.3	177.6	-74.5	-20.6	0	0	0	112.5	E713 T714 I715 K720 A721 Q927 L931 P1010	E713-N717 WeakPolarHBondContact O-CB 3.33Å; E713-N717 VanDerWaalsContact O-CG 3.3Å; E713-N717 PolarHBondContact O-N 3.12Å; E713-N717 PolarHBondContact O-ND2 3.25Å; T714-N717 PolarHBondContact O-N 2.74Å; I715-N717 PolarHBondContact O-N 3.41Å; N717-K720 PolarHBondContact O-N 3.32Å; N717-A721 PolarHBondContact O-N 3.42Å; N717-A721 VanDerWaalsContact O-N 3.11Å; N717-Q927 PolarHBondContact ND2-OE1 2.89Å; N717-L931 HydrophobicContact CB-CD1 4.49Å; N717-P1010 HydrophobicContact CB-CG 4.26Å; N717-P1010 VanDerWaalsContact O-CB 3.29Å; N717-P1010 WeakPolarHBondContact O-CB 3.39Å
718	L	94.7	Very high	92.9	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-66.6	-39.2	175.5	-67.9	172.4	0	0	0	111.7	I447 T714 I715 A721 G722 I723 I725 L926 L930	I447-L718 HydrophobicContact CD1-CD1 3.9Å; T714-L718 HydrophobicContact CG2-CD1 3.86Å; T714-L718 HydrophobicContact CG2-CG 4.4Å; T714-L718 WeakPolarHBondContact O-CB 3.25Å; T714-L718 VanDerWaalsContact O-CG 3.23Å; T714-L718 WeakPolarHBondContact O-CG 3.45Å; T714-L718 PolarHBondContact O-N 3.17Å; I715-L718 PolarHBondContact O-N 3.25Å; L718-A721 WeakPolarHBondContact O-CA 3.39Å; L718-A721 WeakPolarHBondContact O-CB 3.42Å; L718-A721 PolarHBondContact O-N 3.21Å; L718-A721 VanDerWaalsContact O-N 3.1Å; L718-G722 PolarHBondContact O-N 2.98Å; L718-I723 HydrophobicContact CB-CB 4.48Å; L718-I723 HydrophobicContact CD2-CD1 3.73Å; L718-I723 WeakPolarHBondContact O-CB 3.38Å; L718-I723 PolarHBondContact O-N 3.39Å; L718-I723 VanDerWaalsContact O-N 3.09Å; L718-I725 HydrophobicContact CB-CD1 4.13Å; L718-I725 HydrophobicContact CD1-CD1 4.12Å; L718-L926 HydrophobicContact CD1-CD2 4.12Å; L718-L926 HydrophobicContact CD1-CG 4.37Å; L718-L930 HydrophobicContact CD2-CB 4.48Å; L718-L930 HydrophobicContact CD2-CD1 4.06Å
719	A	91.9	Very high	92.7	Very high	59 Å²	59	30.4 Å²	30.4	49%	0.488	18%	0.178	S	C	.	.	H	α-helix	trans	-62	-43.4	173.9	0	0	0	0	0	111.6	I715 A721 G722	I715-A719 WeakPolarHBondContact O-CB 3.43Å; I715-A719 PolarHBondContact O-N 3.09Å; A719-A721 PolarHBondContact O-N 3.09Å; A719-G722 PolarHBondContact O-N 3.47Å
720	K	92.4	Very high	91.9	Very high	128 Å²	128	28.6 Å²	28.6	56%	0.557	18%	0.179	S	C	*	.	H	α-helix	trans	-61	-28.1	173	-72.6	170.4	-172.3	168.3	0	113.2	A716 N717 G722 P1010	A716-K720 VanDerWaalsContact O-CG 3.31Å; A716-K720 WeakPolarHBondContact O-CG 3.21Å; A716-K720 PolarHBondContact O-N 3.38Å; N717-K720 PolarHBondContact O-N 3.32Å; K720-G722 PolarHBondContact O-N 2.88Å; K720-P1010 HydrophobicContact CB-CB 4.15Å; K720-P1010 HydrophobicContact CB-CG 4.26Å
721	A	92.6	Very high	90.9	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-0.2	174.3	0	0	0	0	0	113.6	N717 L718 A719 I723 L931 P1010 Y1013 L1014	N717-A721 PolarHBondContact O-N 3.42Å; N717-A721 VanDerWaalsContact O-N 3.11Å; L718-A721 WeakPolarHBondContact O-CA 3.39Å; L718-A721 WeakPolarHBondContact O-CB 3.42Å; L718-A721 PolarHBondContact O-N 3.21Å; L718-A721 VanDerWaalsContact O-N 3.1Å; A719-A721 PolarHBondContact O-N 3.09Å; A721-I723 HydrophobicContact CB-CD1 4.14Å; A721-I723 HydrophobicContact CB-CG1 4.29Å; A721-L931 HydrophobicContact CB-CD2 3.64Å; A721-P1010 WeakPolarHBondContact CA-O 3.33Å; A721-P1010 HydrophobicContact CB-CB 3.87Å; A721-P1010 WeakPolarHBondContact CB-O 3.3Å; A721-Y1013 HydrophobicContact CB-CD1 4.42Å; A721-Y1013 HydrophobicContact CB-CG 4.4Å; A721-L1014 WeakPolarHBondContact O-CD2 3.33Å
722	G	91.3	Very high	89.6	Confident	35 Å²	35	32.5 Å²	32.5	36%	0.361	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	77.4	20.1	-176.8	0	0	0	0	0	113.5	L718 A719 K720 Q1017	L718-G722 PolarHBondContact O-N 2.98Å; A719-G722 PolarHBondContact O-N 3.47Å; K720-G722 PolarHBondContact O-N 2.88Å; G722-Q1017 PolarHBondContact O-NE2 3.09Å
723	I	94	Very high	89	Confident	5 Å²	5	34 Å²	34	3%	0.026	19%	0.194	C	C	.	.			trans	-93	125.6	176.6	-57.5	166.1	0	0	0	108.8	I444 I447 L718 A721 L930 Y1013	I444-I723 HydrophobicContact CG2-CG2 4.43Å; I447-I723 HydrophobicContact CB-CG2 4.46Å; I447-I723 HydrophobicContact CD1-CG2 3.49Å; I447-I723 VanDerWaalsContact CD1-CG2 3.49Å; I447-I723 HydrophobicContact CG1-CG2 3.63Å; L718-I723 HydrophobicContact CB-CB 4.48Å; L718-I723 HydrophobicContact CD2-CD1 3.73Å; L718-I723 WeakPolarHBondContact O-CB 3.38Å; L718-I723 PolarHBondContact O-N 3.39Å; L718-I723 VanDerWaalsContact O-N 3.09Å; A721-I723 HydrophobicContact CB-CD1 4.14Å; A721-I723 HydrophobicContact CB-CG1 4.29Å; I723-L930 HydrophobicContact CD1-CD1 4.17Å; I723-Y1013 HydrophobicContact CD1-CD1 4.14Å; I723-Y1013 HydrophobicContact CD1-CE1 3.84Å; I723-Y1013 HydrophobicContact CG1-CD1 4.25Å; I723-Y1013 HydrophobicContact CG1-CE1 4.01Å
724	K	92.6	Very high	88.1	Confident	57 Å²	57	32.7 Å²	32.7	25%	0.248	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	131.6	177.4	-63.8	-167.2	172	-143.9	0	110.4	Q445 Y446 I447 C852 C854	Q445-K724 PolarHBondContact O-N 3.27Å; Y446-K724 CarbonylContact C-O 3.6Å; Y446-K724 WeakPolarHBondContact CA-O 3.44Å; Y446-K724 HydrophobicContact CD1-CB 3.88Å; Y446-K724 HydrophobicContact CE1-CB 3.96Å; Y446-K724 HydrophobicContact CE1-CD 3.82Å; Y446-K724 HydrophobicContact CE1-CG 4.37Å; I447-K724 PolarHBondContact N-O 2.94Å; K724-C852 PolarHBondContact NZ-O 3.42Å; K724-C854 PolarHBondContact NZ-O 3.01Å
725	I	93.8	Very high	87.1	Confident	5 Å²	5	34.2 Å²	34.2	3%	0.026	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	126.4	-178.1	-55	-178.3	0	0	0	109.5	I447 I715 L718 L745	I447-I725 HydrophobicContact CB-CG1 4.28Å; I447-I725 CarbonylContact O-C 3.31Å; I447-I725 WeakPolarHBondContact O-CA 3.49Å; I715-I725 HydrophobicContact CB-CD1 4.25Å; I715-I725 HydrophobicContact CG1-CD1 3.92Å; I715-I725 HydrophobicContact CG2-CD1 4.14Å; L718-I725 HydrophobicContact CB-CD1 4.13Å; L718-I725 HydrophobicContact CD1-CD1 4.12Å; I725-L745 HydrophobicContact CB-CD1 4.16Å
726	W	95.4	Very high	86.6	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	125.8	177.1	-70	26.5	0	0	0	108.1	Y446 I447 F448 S449 A851 V857 V870 V874	Y446-W726 HydrophobicContact CD1-CZ2 4.49Å; Y446-W726 AromaticContact CD1-NE1 3.84Å; Y446-W726 HydrophobicContact CE1-CZ2 4.28Å; Y446-W726 AromaticContact CE1-NE1 4Å; I447-W726 PolarHBondContact O-N 3.12Å; F448-W726 CarbonylContact C-O 3.51Å; F448-W726 WeakPolarHBondContact CA-O 3.44Å; F448-W726 HydrophobicContact CD1-CB 3.73Å; F448-W726 HydrophobicContact CD1-CD2 4.42Å; F448-W726 HydrophobicContact CD1-CE3 4.25Å; F448-W726 HydrophobicContact CD1-CG 4.28Å; F448-W726 HydrophobicContact CE1-CB 4.03Å; F448-W726 AromaticContact CE1-CD2 3.82Å; F448-W726 HydrophobicContact CE1-CD2 3.82Å; F448-W726 AromaticContact CE1-CE3 3.56Å; F448-W726 HydrophobicContact CE1-CE3 3.56Å; F448-W726 HydrophobicContact CE1-CG 4.07Å; F448-W726 HydrophobicContact CE1-CZ3 4.25Å; S449-W726 PolarHBondContact N-O 3.38Å; W726-A851 HydrophobicContact CH2-CB 3.44Å; W726-A851 VanDerWaalsContact CH2-CB 3.44Å; W726-A851 HydrophobicContact CZ2-CB 3.78Å; W726-A851 HydrophobicContact CZ3-CB 4.3Å; W726-V857 CarbonylContact C-O 3.59Å; W726-V857 VanDerWaalsContact CA-O 3.25Å; W726-V857 WeakPolarHBondContact CA-O 3.38Å; W726-V857 HydrophobicContact CB-CB 4.38Å; W726-V857 HydrophobicContact CD2-CB 3.66Å; W726-V857 HydrophobicContact CD2-CG1 4.08Å; W726-V857 HydrophobicContact CD2-CG2 3.88Å; W726-V857 VanDerWaalsContact CE2-CG2 3.5Å; W726-V857 HydrophobicContact CE3-CB 4.11Å; W726-V857 HydrophobicContact CE3-CG1 3.98Å; W726-V857 HydrophobicContact CE3-CG2 4.47Å; W726-V857 HydrophobicContact CG-CB 3.76Å; W726-V857 HydrophobicContact CG-CG2 4.22Å; W726-V857 HydrophobicContact CH2-CG2 4.49Å; W726-V857 HydrophobicContact CZ2-CG2 3.85Å; W726-V857 HydrophobicContact CZ3-CG1 4.35Å; W726-V870 HydrophobicContact CE3-CG1 3.98Å; W726-V870 HydrophobicContact CZ3-CG1 3.92Å; W726-V874 HydrophobicContact CE3-CG2 4.44Å; W726-V874 HydrophobicContact CH2-CG2 3.67Å; W726-V874 HydrophobicContact CZ2-CG2 4.44Å; W726-V874 HydrophobicContact CZ3-CG2 3.69Å
727	V	95.1	Very high	86.3	Confident	6 Å²	6	34.5 Å²	34.5	4%	0.036	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	120.9	178.5	177.9	0	0	0	0	108.6	S449 K451 L455 L745 V857 I858 C859	S449-V727 CarbonylContact O-C 3.56Å; S449-V727 WeakPolarHBondContact O-CA 3.31Å; K451-V727 HydrophobicContact CB-CG1 4.04Å; L455-V727 HydrophobicContact CD1-CG1 4.38Å; L455-V727 HydrophobicContact CD1-CG2 3.95Å; V727-L745 HydrophobicContact CB-CD2 4.43Å; V727-L745 HydrophobicContact CG2-CD2 3.46Å; V727-L745 VanDerWaalsContact CG2-CD2 3.46Å; V727-V857 PolarHBondContact N-O 3.42Å; V727-I858 HydrophobicContact CB-CG1 4.44Å; V727-I858 HydrophobicContact CB-CG2 4.38Å; V727-I858 CarbonylContact O-C 3.54Å; V727-I858 WeakPolarHBondContact O-CA 3.46Å; V727-C859 PolarHBondContact O-N 3.43Å
728	L	92.5	Very high	85.6	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	96.7	-178.6	-53.1	-175.2	0	0	0	109.4	F448 S449 C859 V862 K867 V870 V871 M894	F448-L728 HydrophobicContact CB-CD1 4.09Å; F448-L728 HydrophobicContact CD1-CD1 3.89Å; F448-L728 HydrophobicContact CD1-CG 4.32Å; F448-L728 HydrophobicContact CG-CD1 4.34Å; S449-L728 PolarHBondContact O-N 3.15Å; L728-C859 HydrophobicContact CD2-CB 3.55Å; L728-C859 WeakPolarHBondContact CD2-SG 3.31Å; L728-V862 HydrophobicContact CB-CG2 4.35Å; L728-K867 HydrophobicContact CB-CD 4.28Å; L728-K867 HydrophobicContact CB-CG 4.09Å; L728-K867 HydrophobicContact CD1-CB 4.25Å; L728-K867 WeakPolarHBondContact O-CE 3.34Å; L728-K867 PolarHBondContact O-NZ 3.21Å; L728-V870 HydrophobicContact CD1-CB 4.24Å; L728-V870 HydrophobicContact CD1-CG1 4.24Å; L728-V870 HydrophobicContact CD2-CG1 4.1Å; L728-V871 HydrophobicContact CD1-CG2 4.42Å; L728-M894 HydrophobicContact CD1-SD 3.83Å
729	T	85.5	Confident	85.1	Confident	1 Å²	1	35.2 Å²	35.2	1%	0.006	20%	0.197	C	C	.	.			trans	-118.3	144.7	-172.8	-175.5	0	0	0	0	113.4	K451 D731 A736 C859 C860 R861 V862	K451-T729 HydrophobicContact CB-CG2 4.46Å; T729-D731 HydrophobicContact CG2-CB 4.08Å; T729-D731 PolarHBondContact O-N 3.44Å; T729-D731 WeakPolarHBondContact OG1-CB 3.49Å; T729-D731 PolarHBondContact OG1-N 3.18Å; T729-A736 HydrophobicContact CG2-CB 3.57Å; T729-C859 PolarHBondContact N-O 2.94Å; T729-C860 CarbonylContact O-C 3.5Å; T729-C860 WeakPolarHBondContact O-CA 3.37Å; T729-R861 PolarHBondContact O-N 3.47Å; T729-V862 WeakPolarHBondContact O-CG2 3.43Å; T729-V862 PolarHBondContact O-N 2.89Å; T729-V862 VanDerWaalsContact O-N 3.11Å
730	G	72.8	Confident	85	Confident	46 Å²	46	32.5 Å²	32.5	47%	0.474	18%	0.176	S	C	.	.	S	Bend	trans	-72.2	-13	167.5	0	0	0	0	0	112.9	R861	G730-R861 WeakPolarHBondContact O-CA 3.36Å
731	D	69.1	Low	84.6	Confident	40 Å²	40	29.4 Å²	29.4	21%	0.214	16%	0.162	C	C	.	.	S	Bend	trans	-68.1	164	-177.9	-77	2.8	0	0	0	113.1	K451 R649 T729 R861	K451-D731 VanDerWaalsContact CD-OD2 3.25Å; K451-D731 WeakPolarHBondContact CD-OD2 3.38Å; K451-D731 WeakPolarHBondContact CE-OD2 3.3Å; K451-D731 IonicContact NZ-OD2 2.67Å; K451-D731 PolarHBondContact NZ-OD2 3.32Å; R649-D731 IonicContact NH2-OD2 3.75Å; T729-D731 HydrophobicContact CG2-CB 4.08Å; T729-D731 PolarHBondContact O-N 3.44Å; T729-D731 WeakPolarHBondContact OG1-CB 3.49Å; T729-D731 PolarHBondContact OG1-N 3.18Å; D731-R861 PolarHBondContact O-N 3.28Å
732	K	65.4	Low	84.3	Confident	68 Å²	68	31 Å²	31	30%	0.296	17%	0.173	S	C	.	.			trans	-64.5	158.9	173.5	-64	178.9	179	170.5	0	111.1	E734 T735 A736	K732-E734 VanDerWaalsContact C-N 3.34Å; K732-E734 WeakPolarHBondContact CB-OE2 3.39Å; K732-E734 PolarHBondContact O-N 2.92Å; K732-T735 PolarHBondContact O-N 2.96Å; K732-A736 WeakPolarHBondContact O-CB 3.42Å; K732-A736 PolarHBondContact O-N 2.98Å; K732-A736 VanDerWaalsContact O-N 3.09Å
733	K	80.3	Confident	84.1	Confident	59 Å²	59	29.3 Å²	29.3	26%	0.257	16%	0.156	S	C	.	.	H	α-helix	trans	-58.3	-47.3	-174.9	-179.4	-168.3	169.5	-170.7	0	111.6	T735 A736 E737 Y754 I797 C860	K733-T735 PolarHBondContact O-N 2.89Å; K733-A736 PolarHBondContact O-N 3.41Å; K733-E737 WeakPolarHBondContact O-CB 3.33Å; K733-E737 PolarHBondContact O-N 3.3Å; K733-Y754 VanDerWaalsContact CE-CD1 3.42Å; K733-I797 HydrophobicContact CG-CG2 3.94Å; K733-C860 HydrophobicContact CB-CB 4.41Å
734	E	74.9	Confident	83.8	Confident	110 Å²	110	34.7 Å²	34.7	51%	0.514	18%	0.181	S	C	.	.	H	α-helix	trans	-64.3	-44.1	-174.3	-54.9	76.1	-165.3	0	0	110.9	K732 E737 N738	K732-E734 VanDerWaalsContact C-N 3.34Å; K732-E734 WeakPolarHBondContact CB-OE2 3.39Å; K732-E734 PolarHBondContact O-N 2.92Å; E734-E737 PolarHBondContact O-N 3.5Å; E734-N738 WeakPolarHBondContact O-CB 3.49Å; E734-N738 VanDerWaalsContact O-CG 3.28Å; E734-N738 PolarHBondContact O-N 3.35Å
735	T	75	Confident	83.7	Confident	31 Å²	31	32.6 Å²	32.6	19%	0.19	17%	0.173	C	C	.	.	H	α-helix	trans	-64.5	-43.2	176.4	-50.5	0	0	0	0	111.7	K732 K733 E737 N738 I739	K732-T735 PolarHBondContact O-N 2.96Å; K733-T735 PolarHBondContact O-N 2.89Å; T735-E737 VanDerWaalsContact C-N 3.34Å; T735-N738 PolarHBondContact O-N 3.41Å; T735-I739 WeakPolarHBondContact O-CG1 3.28Å; T735-I739 PolarHBondContact O-N 2.95Å
736	A	82.9	Confident	83.5	Confident	2 Å²	2	32.6 Å²	32.6	2%	0.017	17%	0.172	C	C	.	.	H	α-helix	trans	-66	-38.3	179.3	0	0	0	0	0	112.2	T729 K732 K733 G740 I858 C860	T729-A736 HydrophobicContact CG2-CB 3.57Å; K732-A736 WeakPolarHBondContact O-CB 3.42Å; K732-A736 PolarHBondContact O-N 2.98Å; K732-A736 VanDerWaalsContact O-N 3.09Å; K733-A736 PolarHBondContact O-N 3.41Å; A736-G740 PolarHBondContact O-N 2.85Å; A736-I858 HydrophobicContact CB-CG2 3.75Å; A736-C860 HydrophobicContact CB-CB 4.48Å; A736-C860 VanDerWaalsContact CB-SG 3.52Å
737	E	85.7	Confident	83	Confident	38 Å²	38	35.2 Å²	35.2	18%	0.178	19%	0.189	C	C	.	.	H	α-helix	trans	-65	-48.5	175.4	-175.8	169.4	-179.9	0	0	111.4	K733 E734 T735 I739 G740 F741 L746 I797	K733-E737 WeakPolarHBondContact O-CB 3.33Å; K733-E737 PolarHBondContact O-N 3.3Å; E734-E737 PolarHBondContact O-N 3.5Å; T735-E737 VanDerWaalsContact C-N 3.34Å; E737-I739 PolarHBondContact O-N 3.34Å; E737-G740 WeakPolarHBondContact O-CA 3.48Å; E737-G740 PolarHBondContact O-N 3.32Å; E737-F741 HydrophobicContact CG-CD2 4.16Å; E737-F741 HydrophobicContact CG-CE2 3.79Å; E737-F741 VanDerWaalsContact O-CD2 3.29Å; E737-F741 WeakPolarHBondContact O-CD2 3.43Å; E737-F741 PolarHBondContact O-N 3.43Å; E737-L746 HydrophobicContact CG-CD1 4.15Å; E737-I797 HydrophobicContact CB-CD1 4.2Å; E737-I797 HydrophobicContact CG-CD1 3.97Å
738	N	80	Confident	82.4	Confident	39 Å²	39	42.4 Å²	42.4	21%	0.209	23%	0.227	C	C	.	.	H	α-helix	trans	-56.1	-48.9	175.9	-75.6	-5.9	0	0	0	111.8	T647 E734 T735 G740 F741 S742	T647-N738 HydrophobicContact CG2-CB 4.06Å; T647-N738 WeakPolarHBondContact CG2-O 3.4Å; E734-N738 WeakPolarHBondContact O-CB 3.49Å; E734-N738 VanDerWaalsContact O-CG 3.28Å; E734-N738 PolarHBondContact O-N 3.35Å; T735-N738 PolarHBondContact O-N 3.41Å; N738-G740 VanDerWaalsContact C-N 3.26Å; N738-G740 PolarHBondContact O-N 3.49Å; N738-F741 PolarHBondContact O-N 2.79Å; N738-F741 VanDerWaalsContact O-N 3.12Å; N738-S742 PolarHBondContact O-N 3.32Å; N738-S742 PolarHBondContact O-OG 3.3Å
739	I	84.4	Confident	82	Confident	10 Å²	10	51.1 Å²	51.1	5%	0.051	27%	0.265	C	S	.	.	H	α-helix	trans	-63.9	-34.2	176.1	-67.4	-65.1	0	0	0	111.5	K451 T456 D705 L707 T735 E737 F741 S742 C743	K451-I739 HydrophobicContact CD-CB 4.5Å; K451-I739 HydrophobicContact CD-CG1 4.15Å; K451-I739 HydrophobicContact CD-CG2 4.44Å; K451-I739 HydrophobicContact CG-CB 4.29Å; K451-I739 HydrophobicContact CG-CG1 4.43Å; K451-I739 HydrophobicContact CG-CG2 3.8Å; T456-I739 HydrophobicContact CG2-CD1 3.92Å; D705-I739 HydrophobicContact CB-CD1 4.43Å; L707-I739 HydrophobicContact CD2-CD1 4.17Å; L707-I739 HydrophobicContact CD2-CG2 4.29Å; T735-I739 WeakPolarHBondContact O-CG1 3.28Å; T735-I739 PolarHBondContact O-N 2.95Å; E737-I739 PolarHBondContact O-N 3.34Å; I739-F741 VanDerWaalsContact C-N 3.32Å; I739-F741 PolarHBondContact O-N 3.42Å; I739-S742 PolarHBondContact O-N 3.22Å; I739-C743 WeakPolarHBondContact O-CB 3.24Å; I739-C743 PolarHBondContact O-N 3.35Å; I739-C743 PolarHBondContact O-SG 3.38Å
740	G	88.6	Confident	82.1	Confident	3 Å²	3	52.5 Å²	52.5	3%	0.031	27%	0.271	C	S	.	.	H	α-helix	trans	-56.1	-43.5	171.7	0	0	0	0	0	112.7	A736 E737 N738 Q744 L745 L746	A736-G740 PolarHBondContact O-N 2.85Å; E737-G740 WeakPolarHBondContact O-CA 3.48Å; E737-G740 PolarHBondContact O-N 3.32Å; N738-G740 VanDerWaalsContact C-N 3.26Å; N738-G740 PolarHBondContact O-N 3.49Å; G740-Q744 PolarHBondContact O-N 3.24Å; G740-L745 WeakPolarHBondContact O-CB 3.31Å; G740-L745 PolarHBondContact O-N 3.41Å; G740-L746 PolarHBondContact O-N 2.99Å
741	F	85.6	Confident	82.9	Confident	62 Å²	62	55.3 Å²	55.3	27%	0.272	27%	0.272	S	S	.	.	H	α-helix	trans	-70.2	-45.9	173.8	-75.2	-74.3	0	0	0	112.5	T647 E737 N738 I739 C743 Q744 L746 I752	T647-F741 HydrophobicContact CG2-CB 4.42Å; E737-F741 HydrophobicContact CG-CD2 4.16Å; E737-F741 HydrophobicContact CG-CE2 3.79Å; E737-F741 VanDerWaalsContact O-CD2 3.29Å; E737-F741 WeakPolarHBondContact O-CD2 3.43Å; E737-F741 PolarHBondContact O-N 3.43Å; N738-F741 PolarHBondContact O-N 2.79Å; N738-F741 VanDerWaalsContact O-N 3.12Å; I739-F741 VanDerWaalsContact C-N 3.32Å; I739-F741 PolarHBondContact O-N 3.42Å; F741-C743 PolarHBondContact O-N 3.39Å; F741-Q744 PolarHBondContact O-N 3.32Å; F741-L746 HydrophobicContact CD1-CB 3.79Å; F741-L746 HydrophobicContact CD2-CB 4.32Å; F741-L746 HydrophobicContact CD2-CD1 4.13Å; F741-L746 HydrophobicContact CE1-CB 3.84Å; F741-L746 HydrophobicContact CE2-CB 4.35Å; F741-L746 HydrophobicContact CE2-CD1 3.99Å; F741-L746 HydrophobicContact CG-CB 4.05Å; F741-L746 HydrophobicContact CZ-CB 4.12Å; F741-L746 HydrophobicContact CZ-CD1 4.38Å; F741-I752 HydrophobicContact CE2-CD1 4.41Å; F741-I752 HydrophobicContact CZ-CD1 4.08Å
742	S	84.9	Confident	83.8	Confident	33 Å²	33	55.1 Å²	55.1	23%	0.231	27%	0.271	C	S	.	.	H	α-helix	trans	-59.3	-36.2	178.6	-43.8	0	0	0	0	112.1	T647 L707 N738 I739 Q744	T647-S742 VanDerWaalsContact CB-OG 3.23Å; T647-S742 WeakPolarHBondContact CB-OG 3.31Å; T647-S742 WeakPolarHBondContact CG2-OG 3.04Å; T647-S742 PolarHBondContact OG1-OG 2.95Å; L707-S742 WeakPolarHBondContact CD1-O 3.32Å; N738-S742 PolarHBondContact O-N 3.32Å; N738-S742 PolarHBondContact O-OG 3.3Å; I739-S742 PolarHBondContact O-N 3.22Å; S742-Q744 VanDerWaalsContact C-N 3.25Å; S742-Q744 PolarHBondContact O-N 3.33Å
743	C	88.1	Confident	85	Confident	1 Å²	1	52.3 Å²	52.3	1%	0.007	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.1	-3.9	177.7	-69.7	0	0	0	0	114	L707 V711 I715 I739 F741 L745	L707-C743 VanDerWaalsContact CD2-SG 3.54Å; V711-C743 HydrophobicContact CG1-CB 4.44Å; I715-C743 HydrophobicContact CD1-CB 3.71Å; I739-C743 WeakPolarHBondContact O-CB 3.24Å; I739-C743 PolarHBondContact O-N 3.35Å; I739-C743 PolarHBondContact O-SG 3.38Å; F741-C743 PolarHBondContact O-N 3.39Å; C743-L745 HydrophobicContact CB-CB 4.39Å; C743-L745 PolarHBondContact O-N 2.97Å
744	Q	87.5	Confident	85.3	Confident	118 Å²	118	53.1 Å²	53.1	55%	0.551	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.2	24	-169.7	-56.8	178	1.1	0	0	113.6	P712 G740 F741 S742	P712-Q744 HydrophobicContact CB-CG 4.22Å; G740-Q744 PolarHBondContact O-N 3.24Å; F741-Q744 PolarHBondContact O-N 3.32Å; S742-Q744 VanDerWaalsContact C-N 3.25Å; S742-Q744 PolarHBondContact O-N 3.33Å
745	L	89.8	Confident	85.4	Confident	13 Å²	13	48.4 Å²	48.4	7%	0.068	24%	0.242	C	C	.	.	S	Bend	trans	-75.4	-38	170.1	179.8	66.9	0	0	0	110.1	I715 I725 V727 G740 C743 A856 I858	I715-L745 HydrophobicContact CG2-CD1 4.4Å; I725-L745 HydrophobicContact CB-CD1 4.16Å; V727-L745 HydrophobicContact CB-CD2 4.43Å; V727-L745 HydrophobicContact CG2-CD2 3.46Å; V727-L745 VanDerWaalsContact CG2-CD2 3.46Å; G740-L745 WeakPolarHBondContact O-CB 3.31Å; G740-L745 PolarHBondContact O-N 3.41Å; C743-L745 HydrophobicContact CB-CB 4.39Å; C743-L745 PolarHBondContact O-N 2.97Å; L745-A856 HydrophobicContact CD1-CB 3.74Å; L745-A856 HydrophobicContact CD2-CB 4.41Å; L745-A856 HydrophobicContact CG-CB 3.73Å; L745-I858 HydrophobicContact CD2-CD1 4.36Å; L745-I858 HydrophobicContact CD2-CG1 4.26Å
746	L	89.4	Confident	85.3	Confident	4 Å²	4	55 Å²	55	2%	0.021	27%	0.271	C	S	.	.	S	Bend	trans	-102.2	145.6	169.7	-58.4	179.8	0	0	0	109.7	E737 G740 F741 I752 A795 I797 A856 I858	E737-L746 HydrophobicContact CG-CD1 4.15Å; G740-L746 PolarHBondContact O-N 2.99Å; F741-L746 HydrophobicContact CD1-CB 3.79Å; F741-L746 HydrophobicContact CD2-CB 4.32Å; F741-L746 HydrophobicContact CD2-CD1 4.13Å; F741-L746 HydrophobicContact CE1-CB 3.84Å; F741-L746 HydrophobicContact CE2-CB 4.35Å; F741-L746 HydrophobicContact CE2-CD1 3.99Å; F741-L746 HydrophobicContact CG-CB 4.05Å; F741-L746 HydrophobicContact CZ-CB 4.12Å; F741-L746 HydrophobicContact CZ-CD1 4.38Å; L746-I752 HydrophobicContact CD1-CD1 4.49Å; L746-A795 HydrophobicContact CD2-CB 3.51Å; L746-I797 HydrophobicContact CD1-CD1 4.29Å; L746-A856 HydrophobicContact CD2-CB 4.13Å; L746-I858 HydrophobicContact CD1-CD1 3.8Å; L746-I858 HydrophobicContact CD2-CD1 4.33Å; L746-I858 HydrophobicContact CG-CD1 4.09Å
747	T	85.7	Confident	84.8	Confident	55 Å²	55	58.9 Å²	58.9	34%	0.337	29%	0.291	S	S	.	.			trans	-133.9	152.7	174.3	63.2	0	0	0	0	109.6	K749 M750	T747-K749 PolarHBondContact O-N 3.49Å; T747-M750 HydrophobicContact CG2-CE 4.37Å; T747-M750 WeakPolarHBondContact O-CB 3.36Å; T747-M750 PolarHBondContact O-N 2.81Å; T747-M750 WeakPolarHBondContact OG1-CG 3.49Å
748	D	82.3	Confident	84.4	Confident	157 Å²	157	57.1 Å²	57.1	84%	0.84	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-15.8	-179.1	-53.7	-31	0	0	0	113.9
749	K	84.6	Confident	84.3	Confident	184 Å²	184	57.1 Å²	57.1	80%	0.8	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85	-11.7	177.2	-62.9	-179.3	-178.4	175.7	0	113.2	T747	T747-K749 PolarHBondContact O-N 3.49Å
750	M	87.9	Confident	83.9	Confident	29 Å²	29	58.8 Å²	58.8	14%	0.143	30%	0.302	C	S	.	.	S	Bend	trans	-83.2	139.8	-179.5	-72.2	171.6	-177.9	0	0	110.9	T747 N793 A795 E855	T747-M750 HydrophobicContact CG2-CE 4.37Å; T747-M750 WeakPolarHBondContact O-CB 3.36Å; T747-M750 PolarHBondContact O-N 2.81Å; T747-M750 WeakPolarHBondContact OG1-CG 3.49Å; M750-N793 VanDerWaalsContact CA-O 3.29Å; M750-N793 WeakPolarHBondContact CA-O 3.26Å; M750-N793 HydrophobicContact CG-CB 4Å; M750-A795 HydrophobicContact CB-CB 4.45Å; M750-A795 HydrophobicContact SD-CB 4.38Å; M750-E855 HydrophobicContact CE-CB 4.31Å; M750-E855 WeakPolarHBondContact CE-OE2 3.42Å
751	Q	88.8	Confident	83.5	Confident	105 Å²	105	62 Å²	62	49%	0.491	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	118.1	168.2	-170.7	177	6.3	0	0	109.4	H753 N793 N794 A795	Q751-H753 PolarHBondContact O-CD2 3.35Å; Q751-N793 PolarHBondContact N-O 3.07Å; Q751-N794 WeakPolarHBondContact O-CA 3.03Å; Q751-A795 PolarHBondContact O-N 3.48Å
752	I	88.9	Confident	83.3	Confident	36 Å²	36	59 Å²	59	19%	0.185	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	126.7	178.5	-56.9	177.2	0	0	0	109.2	F741 L746 Y754 A795 I797	F741-I752 HydrophobicContact CE2-CD1 4.41Å; F741-I752 HydrophobicContact CZ-CD1 4.08Å; L746-I752 HydrophobicContact CD1-CD1 4.49Å; I752-Y754 HydrophobicContact CG2-CD1 4.35Å; I752-Y754 HydrophobicContact CG2-CE1 3.72Å; I752-Y754 HydrophobicContact CG2-CE2 4.26Å; I752-A795 HydrophobicContact CG1-CB 4.39Å; I752-I797 HydrophobicContact CD1-CD1 4.47Å; I752-I797 HydrophobicContact CG2-CB 4.43Å; I752-I797 HydrophobicContact CG2-CD1 3.65Å; I752-I797 HydrophobicContact CG2-CG1 3.85Å
753	H	88.8	Confident	83	Confident	10 Å²	10	61.6 Å²	61.6	5%	0.046	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	135.5	174.3	-56.8	-91.5	0	0	0	109.6	Q751 F788 N794 A795 I797	Q751-H753 PolarHBondContact O-CD2 3.35Å; H753-F788 AromaticContact CD2-CE1 3.56Å; H753-F788 AromaticContact CE1-CD1 3.72Å; H753-F788 AromaticContact CE1-CE1 3.52Å; H753-F788 AromaticContact CG-CE1 3.64Å; H753-F788 AromaticContact ND1-CE1 3.57Å; H753-F788 AromaticContact NE2-CD1 3.64Å; H753-F788 AromaticContact NE2-CE1 3.48Å; H753-F788 WeakPolarHBondContact NE2-CE1 3.47Å; H753-N794 PolarHBondContact NE2-OD1 3.18Å; H753-A795 PolarHBondContact N-O 3.12Å; H753-I797 PolarHBondContact O-N 2.91Å
754	Y	87.9	Confident	82.6	Confident	76 Å²	76	64.4 Å²	64.4	30%	0.298	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	167.6	179.4	-60.2	-69.3	0	0	0	112.2	K733 I752 E756 D757 V758 I797	K733-Y754 VanDerWaalsContact CE-CD1 3.42Å; I752-Y754 HydrophobicContact CG2-CD1 4.35Å; I752-Y754 HydrophobicContact CG2-CE1 3.72Å; I752-Y754 HydrophobicContact CG2-CE2 4.26Å; Y754-E756 VanDerWaalsContact C-N 3.25Å; Y754-E756 PolarHBondContact O-N 3.38Å; Y754-E756 VanDerWaalsContact O-N 3.16Å; Y754-D757 PolarHBondContact N-OD2 2.89Å; Y754-D757 WeakPolarHBondContact O-CB 3.46Å; Y754-D757 PolarHBondContact O-N 3.13Å; Y754-D757 VanDerWaalsContact O-N 3.14Å; Y754-V758 VanDerWaalsContact O-CG2 3.24Å; Y754-V758 WeakPolarHBondContact O-CG2 3.4Å; Y754-V758 PolarHBondContact O-N 2.97Å; Y754-V758 VanDerWaalsContact O-N 3.13Å; Y754-I797 WeakPolarHBondContact CA-O 3.45Å; Y754-I797 HydrophobicContact CD1-CB 4.03Å; Y754-I797 HydrophobicContact CD1-CG2 4.47Å; Y754-I797 HydrophobicContact CE1-CB 4.1Å; Y754-I797 HydrophobicContact CE1-CD1 4.25Å; Y754-I797 HydrophobicContact CE1-CG2 4.48Å
755	G	76.2	Confident	82.2	Confident	11 Å²	11	61 Å²	61	11%	0.113	32%	0.319	C	S	.	.	H	α-helix	trans	-54.2	-34.2	-176.3	0	0	0	0	0	115.3	V758 N759 W802	G755-V758 WeakPolarHBondContact O-CB 3.43Å; G755-V758 PolarHBondContact O-N 3.47Å; G755-N759 PolarHBondContact O-N 2.99Å; G755-N759 VanDerWaalsContact O-N 3.07Å; G755-W802 PolarHBondContact O-NE1 3.01Å; G755-W802 VanDerWaalsContact O-NE1 3.07Å
756	E	72.8	Confident	81.6	Confident	170 Å²	170	61.7 Å²	61.7	79%	0.794	32%	0.321	S	S	*	.	H	α-helix	trans	-67.1	-46.3	177.1	-68.3	173.7	-157.9	0	0	112.1	Y754 V758 N759 G760	Y754-E756 VanDerWaalsContact C-N 3.25Å; Y754-E756 PolarHBondContact O-N 3.38Å; Y754-E756 VanDerWaalsContact O-N 3.16Å; E756-V758 PolarHBondContact O-N 3.24Å; E756-N759 PolarHBondContact O-N 3.43Å; E756-N759 VanDerWaalsContact O-N 3.15Å; E756-G760 PolarHBondContact O-N 3.44Å
757	D	72.4	Confident	81	Confident	83 Å²	83	63.7 Å²	63.7	44%	0.444	34%	0.338	S	S	.	.	H	α-helix	trans	-60.3	-38.2	176.3	-59.9	-41.4	0	0	0	111.4	Y754 G760 K761	Y754-D757 PolarHBondContact N-OD2 2.89Å; Y754-D757 WeakPolarHBondContact O-CB 3.46Å; Y754-D757 PolarHBondContact O-N 3.13Å; Y754-D757 VanDerWaalsContact O-N 3.14Å; D757-G760 PolarHBondContact O-N 3.41Å; D757-K761 PolarHBondContact O-N 2.73Å
758	V	77.4	Confident	80.6	Confident	1 Å²	1	63.6 Å²	63.6	1%	0.006	34%	0.344	C	S	.	.	H	α-helix	trans	-64.6	-43.1	178.1	174.8	0	0	0	0	110.5	Y754 G755 E756 G760 K761 L762 L796 W802 M850	Y754-V758 VanDerWaalsContact O-CG2 3.24Å; Y754-V758 WeakPolarHBondContact O-CG2 3.4Å; Y754-V758 PolarHBondContact O-N 2.97Å; Y754-V758 VanDerWaalsContact O-N 3.13Å; G755-V758 WeakPolarHBondContact O-CB 3.43Å; G755-V758 PolarHBondContact O-N 3.47Å; E756-V758 PolarHBondContact O-N 3.24Å; V758-G760 VanDerWaalsContact C-N 3.33Å; V758-G760 PolarHBondContact O-N 3.14Å; V758-K761 PolarHBondContact O-N 2.89Å; V758-L762 HydrophobicContact CG1-CD1 3.77Å; V758-L762 HydrophobicContact CG1-CG 4.07Å; V758-L762 WeakPolarHBondContact O-CB 3.26Å; V758-L762 VanDerWaalsContact O-CG 3.3Å; V758-L762 WeakPolarHBondContact O-CG 3.35Å; V758-L762 PolarHBondContact O-N 3.16Å; V758-L796 HydrophobicContact CG2-CD1 3.34Å; V758-W802 HydrophobicContact CB-CH2 4.11Å; V758-W802 HydrophobicContact CB-CZ2 3.84Å; V758-W802 HydrophobicContact CG1-CH2 3.49Å; V758-W802 VanDerWaalsContact CG1-CH2 3.49Å; V758-W802 HydrophobicContact CG1-CZ2 3.52Å; V758-M850 HydrophobicContact CB-SD 4.23Å; V758-M850 HydrophobicContact CG1-CE 4.09Å; V758-M850 HydrophobicContact CG1-SD 3.61Å; V758-M850 HydrophobicContact CG2-SD 4.12Å
759	N	77.6	Confident	80.2	Confident	39 Å²	39	59.3 Å²	59.3	21%	0.209	32%	0.316	C	S	.	.	H	α-helix	trans	-62.6	-42.4	-179.3	-159.1	22.2	0	0	0	111.4	G755 E756 K761 L762 L763 R843	G755-N759 PolarHBondContact O-N 2.99Å; G755-N759 VanDerWaalsContact O-N 3.07Å; E756-N759 PolarHBondContact O-N 3.43Å; E756-N759 VanDerWaalsContact O-N 3.15Å; N759-K761 VanDerWaalsContact C-N 3.33Å; N759-K761 PolarHBondContact O-N 3.29Å; N759-L762 PolarHBondContact O-N 2.95Å; N759-L763 WeakPolarHBondContact O-CB 3.29Å; N759-L763 VanDerWaalsContact O-CG 3.26Å; N759-L763 WeakPolarHBondContact O-CG 3.49Å; N759-L763 PolarHBondContact O-N 2.72Å; N759-R843 PolarHBondContact OD1-NH2 3.33Å
760	G	76.4	Confident	79.6	Confident	45 Å²	45	58 Å²	58	46%	0.464	31%	0.306	S	S	.	.	H	α-helix	trans	-56.4	-45	173.9	0	0	0	0	0	112.7	E756 D757 V758 A764	E756-G760 PolarHBondContact O-N 3.44Å; D757-G760 PolarHBondContact O-N 3.41Å; V758-G760 VanDerWaalsContact C-N 3.33Å; V758-G760 PolarHBondContact O-N 3.14Å; G760-A764 VanDerWaalsContact O-CB 3.3Å; G760-A764 WeakPolarHBondContact O-CB 3.37Å; G760-A764 PolarHBondContact O-N 2.94Å
761	K	80.1	Confident	78.7	Confident	69 Å²	69	63.5 Å²	63.5	30%	0.3	34%	0.336	S	S	.	.	H	α-helix	trans	-69.4	-39.3	178.1	-68.2	-175	-177	-176.1	0	113.2	D757 V758 N759 R765 F788 M850	D757-K761 PolarHBondContact O-N 2.73Å; V758-K761 PolarHBondContact O-N 2.89Å; N759-K761 VanDerWaalsContact C-N 3.33Å; N759-K761 PolarHBondContact O-N 3.29Å; K761-R765 PolarHBondContact O-N 3.06Å; K761-R765 VanDerWaalsContact O-N 3.07Å; K761-F788 HydrophobicContact CD-CE1 4.31Å; K761-M850 HydrophobicContact CB-CE 3.76Å
762	L	80.8	Confident	77.7	Confident	0 Å²	0	63.8 Å²	63.8	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-64.3	-47.1	175.9	-70.3	176.7	0	0	0	111	V758 N759 A764 R765 Q766 F787 I806 D846 F847 M850	V758-L762 HydrophobicContact CG1-CD1 3.77Å; V758-L762 HydrophobicContact CG1-CG 4.07Å; V758-L762 WeakPolarHBondContact O-CB 3.26Å; V758-L762 VanDerWaalsContact O-CG 3.3Å; V758-L762 WeakPolarHBondContact O-CG 3.35Å; V758-L762 PolarHBondContact O-N 3.16Å; N759-L762 PolarHBondContact O-N 2.95Å; L762-A764 PolarHBondContact O-N 3.46Å; L762-R765 PolarHBondContact O-N 2.66Å; L762-Q766 WeakPolarHBondContact O-CG 3.35Å; L762-Q766 PolarHBondContact O-N 2.8Å; L762-F787 HydrophobicContact CD2-CE1 4.42Å; L762-I806 HydrophobicContact CD1-CD1 4.04Å; L762-D846 HydrophobicContact CD2-CB 3.52Å; L762-F847 HydrophobicContact CD1-CB 4.4Å; L762-M850 HydrophobicContact CD2-CE 3.6Å; L762-M850 HydrophobicContact CG-CE 3.77Å
763	L	78.7	Confident	76.1	Confident	87 Å²	87	64.8 Å²	64.8	46%	0.455	35%	0.351	S	S	.	.	H	α-helix	trans	-63	-41.3	177.3	-72.1	170.6	0	0	0	111.5	N759 R765 Q766 A767	N759-L763 WeakPolarHBondContact O-CB 3.29Å; N759-L763 VanDerWaalsContact O-CG 3.26Å; N759-L763 WeakPolarHBondContact O-CG 3.49Å; N759-L763 PolarHBondContact O-N 2.72Å; L763-R765 PolarHBondContact O-N 3.41Å; L763-Q766 PolarHBondContact O-N 3.09Å; L763-A767 WeakPolarHBondContact O-CB 3.34Å; L763-A767 PolarHBondContact O-N 3.17Å
764	A	79.8	Confident	74.5	Confident	61 Å²	61	69 Å²	69	50%	0.504	38%	0.379	S	S	.	.	H	α-helix	trans	-60.2	-43.6	175.6	0	0	0	0	0	111.9	G760 L762 A767 A768	G760-A764 VanDerWaalsContact O-CB 3.3Å; G760-A764 WeakPolarHBondContact O-CB 3.37Å; G760-A764 PolarHBondContact O-N 2.94Å; L762-A764 PolarHBondContact O-N 3.46Å; A764-A767 PolarHBondContact O-N 3.03Å; A764-A768 WeakPolarHBondContact O-CB 3.4Å; A764-A768 PolarHBondContact O-N 2.55Å
765	R	80.8	Confident	72.7	Confident	47 Å²	47	70.2 Å²	70.2	18%	0.177	40%	0.399	C	S	.	.	H	α-helix	trans	-65.8	-38.7	176.2	-174.9	73	80.8	120	14.9	112.2	K761 L762 L763 R769 E785 F787	K761-R765 PolarHBondContact O-N 3.06Å; K761-R765 VanDerWaalsContact O-N 3.07Å; L762-R765 PolarHBondContact O-N 2.66Å; L763-R765 PolarHBondContact O-N 3.41Å; R765-R769 PolarHBondContact O-N 3.42Å; R765-R769 VanDerWaalsContact O-N 3.13Å; R765-E785 PolarHBondContact NH1-O 3.11Å; R765-E785 PolarHBondContact NH2-O 3.21Å; R765-F787 HydrophobicContact CB-CE1 4.08Å; R765-F787 HydrophobicContact CG-CE1 4.25Å; R765-F787 HydrophobicContact CG-CZ 4.32Å
766	Q	76.4	Confident	71.4	Confident	26 Å²	26	77.3 Å²	77.3	12%	0.121	43%	0.428	C	S	.	.	H	α-helix	trans	-66.2	-43.4	175.4	-74	-179.4	-20.1	0	0	111.7	L762 L763 R769 R770 R843	L762-Q766 WeakPolarHBondContact O-CG 3.35Å; L762-Q766 PolarHBondContact O-N 2.8Å; L763-Q766 PolarHBondContact O-N 3.09Å; Q766-R769 PolarHBondContact O-N 2.96Å; Q766-R770 PolarHBondContact O-N 3.42Å; Q766-R843 VanDerWaalsContact NE2-CB 3.29Å
767	A	77.4	Confident	70.3	Confident	46 Å²	46	77.3 Å²	77.3	38%	0.38	42%	0.421	S	S	.	.	H	α-helix	trans	-63.1	-43.2	176.1	0	0	0	0	0	111.8	L763 A764 R769 R770 N771	L763-A767 WeakPolarHBondContact O-CB 3.34Å; L763-A767 PolarHBondContact O-N 3.17Å; A764-A767 PolarHBondContact O-N 3.03Å; A767-R769 VanDerWaalsContact C-N 3.31Å; A767-R769 PolarHBondContact O-N 2.93Å; A767-R770 PolarHBondContact O-N 3.47Å; A767-R770 VanDerWaalsContact O-N 3.15Å; A767-N771 VanDerWaalsContact O-CG 3.3Å; A767-N771 PolarHBondContact O-N 3.42Å; A767-N771 PolarHBondContact O-ND2 3.18Å
768	A	76.9	Confident	68.9	Low	54 Å²	54	81.3 Å²	81.3	45%	0.446	44%	0.442	S	S	.	.	H	α-helix	trans	-57.2	-43.9	174.2	0	0	0	0	0	111.6	A764 N771 E772	A764-A768 WeakPolarHBondContact O-CB 3.4Å; A764-A768 PolarHBondContact O-N 2.55Å; A768-N771 PolarHBondContact O-N 3.4Å; A768-E772 PolarHBondContact O-N 3.05Å
769	R	73.9	Confident	67.2	Low	66 Å²	66	84.7 Å²	84.7	25%	0.249	48%	0.477	C	S	.	.	H	α-helix	trans	-67.3	-33.2	175.4	-89.4	-172.3	-84.4	-145.8	-16.2	114.3	R765 Q766 A767 N771 E772 M842 D846	R765-R769 PolarHBondContact O-N 3.42Å; R765-R769 VanDerWaalsContact O-N 3.13Å; Q766-R769 PolarHBondContact O-N 2.96Å; A767-R769 VanDerWaalsContact C-N 3.31Å; A767-R769 PolarHBondContact O-N 2.93Å; R769-N771 VanDerWaalsContact C-N 3.25Å; R769-E772 PolarHBondContact O-N 3.28Å; R769-M842 PolarHBondContact NH1-SD 3.27Å; R769-D846 IonicContact CZ-OD1 3.91Å; R769-D846 IonicContact CZ-OD2 3.42Å; R769-D846 IonicContact NH1-OD1 2.66Å; R769-D846 IonicContact NH2-OD1 3.42Å; R769-D846 PolarHBondContact NH2-OD1 3.41Å; R769-D846 IonicContact NH2-OD2 3.22Å; R769-D846 PolarHBondContact NH2-OD2 2.87Å
770	R	71.2	Confident	65.3	Low	157 Å²	157	92 Å²	92	59%	0.592	51%	0.507	S	S	*	.	H	α-helix	trans	-66.2	-31.9	173.2	-77.3	-177.6	177	171.6	-0.2	111.7	Q766 A767 E839	Q766-R770 PolarHBondContact O-N 3.42Å; A767-R770 PolarHBondContact O-N 3.47Å; A767-R770 VanDerWaalsContact O-N 3.15Å; R770-E839 IonicContact CZ-OE1 3.17Å; R770-E839 IonicContact CZ-OE2 3.61Å; R770-E839 IonicContact NE-OE1 3.35Å; R770-E839 PolarHBondContact NE-OE1 3.18Å; R770-E839 IonicContact NH2-OE1 3.75Å; R770-E839 PolarHBondContact NH2-OE1 2.97Å; R770-E839 IonicContact NH2-OE2 2.63Å; R770-E839 PolarHBondContact NH2-OE2 3.47Å
771	N	70.4	Confident	63.8	Low	144 Å²	144	100.1 Å²	100.1	77%	0.77	53%	0.529	S	S	*	.	H	α-helix	trans	-83.9	-9.3	179.5	-64.4	-16	0	0	0	113.6	A767 A768 R769	A767-N771 VanDerWaalsContact O-CG 3.3Å; A767-N771 PolarHBondContact O-N 3.42Å; A767-N771 PolarHBondContact O-ND2 3.18Å; A768-N771 PolarHBondContact O-N 3.4Å; R769-N771 VanDerWaalsContact C-N 3.25Å
772	E	67.9	Low	62	Low	111 Å²	111	104.9 Å²	104.9	52%	0.519	55%	0.55	S	S	.	*	S	Bend	trans	-79.1	129.4	174.8	-79.2	-174.7	160	0	0	112.8	A768 R769	A768-E772 PolarHBondContact O-N 3.05Å; R769-E772 PolarHBondContact O-N 3.28Å
773	A	53.9	Low	60.5	Low	57 Å²	57	110.6 Å²	110.6	47%	0.471	59%	0.587	S	S	.	*			trans	-63	140.8	-178.4	0	0	0	0	0	112.9	S775 H776	A773-S775 PolarHBondContact O-N 3.32Å; A773-S775 VanDerWaalsContact O-N 3.08Å; A773-H776 PolarHBondContact O-N 3.36Å
774	P	55	Low	59.6	Low	98 Å²	98	111.3 Å²	111.3	64%	0.636	59%	0.591	S	S	*	*	G	3₁₀ helix	trans	-63.1	-18.9	-173.7	21.8	-32.3	0	0	0	115	H776 R777	P774-H776 VanDerWaalsContact C-N 3.25Å; P774-H776 PolarHBondContact O-N 3.04Å; P774-R777 PolarHBondContact O-N 3.42Å
775	S	50	Low	59.1	Low	103 Å²	103	115.4 Å²	115.4	72%	0.72	60%	0.6	S	S	*	*	G	3₁₀ helix	trans	-67.5	-19.2	177.3	50.5	0	0	0	0	114.2	A773	A773-S775 PolarHBondContact O-N 3.32Å; A773-S775 VanDerWaalsContact O-N 3.08Å
776	H	48.8	Very low	58.9	Low	159 Å²	159	116.9 Å²	116.9	74%	0.736	62%	0.616	S	S	*	*	G	3₁₀ helix	trans	-90.9	-5.8	177.8	-99.9	-73.6	0	0	0	114.4	A773 P774	A773-H776 PolarHBondContact O-N 3.36Å; P774-H776 VanDerWaalsContact C-N 3.25Å; P774-H776 PolarHBondContact O-N 3.04Å
777	R	51.2	Low	59	Low	170 Å²	170	116.5 Å²	116.5	64%	0.642	61%	0.614	S	S	*	*	S	Bend	trans	-77.7	-19.8	-175.3	-64.9	-176.7	-173.5	-175.5	2.2	114.2	P774	P774-R777 PolarHBondContact O-N 3.42Å
778	L	41.4	Very low	59.1	Low	167 Å²	167	115.1 Å²	115.1	87%	0.874	60%	0.599	S	S	*	*	S	Bend	trans	-110	84	-180	-78.6	136.3	0	0	0	109.5
779	G	43.7	Very low	58.7	Low	72 Å²	72	117.7 Å²	117.7	74%	0.742	61%	0.611	S	S	*	*	S	Bend	trans	157.7	-18.1	159.8	0	0	0	0	0	120.3
780	K	37.5	Very low	58.1	Low	193 Å²	193	118.7 Å²	118.7	84%	0.839	64%	0.642	S	S	*	*			trans	-143.4	115.8	177.8	-76.2	-176	177.8	175	0	111.8	K782	K780-K782 PolarHBondContact O-N 3.49Å
781	K	44.8	Very low	57.5	Low	216 Å²	216	114.2 Å²	114.2	94%	0.939	63%	0.632	S	S	*	*			trans	-65.1	89.2	156.9	-76.9	-177.9	176.8	-179.6	0	107.2
782	K	42.3	Very low	57.2	Low	169 Å²	169	114.1 Å²	114.1	74%	0.735	63%	0.63	S	S	*	*	P	Polyproline II helix	trans	-58.4	138.9	157.4	-90.5	-177.7	173.2	-178.2	0	106.8	K780 D784	K780-K782 PolarHBondContact O-N 3.49Å; K782-D784 PolarHBondContact O-N 3.5Å
783	P	47.9	Very low	57.9	Low	120 Å²	120	111.6 Å²	111.6	78%	0.779	62%	0.62	S	S	*	*	P	Polyproline II helix	trans	-56.3	130	165.8	23.9	-29.7	0	0	0	107.3	E785	P783-E785 PolarHBondContact O-N 3.19Å
784	D	61.3	Low	59.5	Low	101 Å²	101	109.1 Å²	109.1	54%	0.54	60%	0.599	S	S	.	*	P	Polyproline II helix	trans	-56	124.3	177.9	-69.2	-43.8	0	0	0	107.9	K782	K782-D784 PolarHBondContact O-N 3.5Å
785	E	69.3	Low	61.3	Low	148 Å²	148	104.5 Å²	104.5	69%	0.692	57%	0.569	S	S	*	*	P	Polyproline II helix	trans	-53.3	140	170.6	-74.6	177.9	175.7	0	0	108.9	R765 P783	R765-E785 PolarHBondContact NH1-O 3.11Å; R765-E785 PolarHBondContact NH2-O 3.21Å; P783-E785 PolarHBondContact O-N 3.19Å
786	P	75.7	Confident	63.3	Low	78 Å²	78	99.6 Å²	99.6	51%	0.506	54%	0.535	S	S	.	.	P	Polyproline II helix	trans	-64.6	144.3	179.8	26.3	-33.1	0	0	0	110.7	F788 E853	P786-F788 PolarHBondContact O-N 3.11Å; P786-E853 WeakPolarHBondContact CA-OE1 3.47Å
787	F	78.9	Confident	65.3	Low	18 Å²	18	92.2 Å²	92.2	8%	0.079	50%	0.501	C	S	.	.	S	Bend	trans	-69.8	-24	174.9	-75.8	-86.7	0	0	0	112.8	L762 R765 D846 N849 M850 E853	L762-F787 HydrophobicContact CD2-CE1 4.42Å; R765-F787 HydrophobicContact CB-CE1 4.08Å; R765-F787 HydrophobicContact CG-CE1 4.25Å; R765-F787 HydrophobicContact CG-CZ 4.32Å; F787-D846 HydrophobicContact CZ-CB 3.93Å; F787-N849 HydrophobicContact CE2-CB 4.06Å; F787-M850 HydrophobicContact CB-CB 4.29Å; F787-M850 HydrophobicContact CB-CE 4.44Å; F787-M850 HydrophobicContact CB-CG 3.87Å; F787-M850 HydrophobicContact CD1-CB 4.37Å; F787-M850 HydrophobicContact CD1-CE 3.4Å; F787-M850 HydrophobicContact CD1-CG 4.37Å; F787-M850 HydrophobicContact CD2-CB 3.75Å; F787-M850 HydrophobicContact CD2-CG 4.27Å; F787-M850 HydrophobicContact CE1-CE 3.66Å; F787-M850 HydrophobicContact CE2-CB 4.09Å; F787-M850 HydrophobicContact CG-CB 3.89Å; F787-M850 HydrophobicContact CG-CE 3.96Å; F787-M850 HydrophobicContact CG-CG 3.93Å; F787-M850 HydrophobicContact CZ-CE 4.43Å; F787-E853 WeakPolarHBondContact CB-OE2 3.48Å; F787-E853 PolarHBondContact N-OE1 3.12Å; F787-E853 PolarHBondContact N-OE2 3.08Å
788	F	80.1	Confident	67.2	Low	16 Å²	16	84.2 Å²	84.2	7%	0.07	47%	0.471	C	S	.	.	S	Bend	trans	-121	88	178.2	-51.5	-84	0	0	0	111.1	H753 K761 P786 G790 N794 M850 E853	H753-F788 AromaticContact CD2-CE1 3.56Å; H753-F788 AromaticContact CE1-CD1 3.72Å; H753-F788 AromaticContact CE1-CE1 3.52Å; H753-F788 AromaticContact CG-CE1 3.64Å; H753-F788 AromaticContact ND1-CE1 3.57Å; H753-F788 AromaticContact NE2-CD1 3.64Å; H753-F788 AromaticContact NE2-CE1 3.48Å; H753-F788 WeakPolarHBondContact NE2-CE1 3.47Å; K761-F788 HydrophobicContact CD-CE1 4.31Å; P786-F788 PolarHBondContact O-N 3.11Å; F788-G790 PolarHBondContact O-N 3.28Å; F788-N794 VanDerWaalsContact CB-ND2 3.31Å; F788-N794 WeakPolarHBondContact CB-ND2 3.26Å; F788-M850 HydrophobicContact CE2-CG 3.46Å; F788-M850 VanDerWaalsContact CE2-CG 3.46Å; F788-M850 HydrophobicContact CE2-SD 4.43Å; F788-M850 HydrophobicContact CZ-CG 3.64Å; F788-M850 HydrophobicContact CZ-SD 4.02Å; F788-E853 HydrophobicContact CD2-CB 4.1Å; F788-E853 HydrophobicContact CE2-CB 4.45Å; F788-E853 PolarHBondContact N-OE2 3.3Å
789	P	66.6	Low	69.3	Low	109 Å²	109	78.8 Å²	78.8	71%	0.708	44%	0.444	S	S	*	.	S	Bend	trans	-73.7	124.8	176.1	27.5	-31.6	0	0	0	111.2
790	G	63.1	Low	70.8	Confident	86 Å²	86	75.4 Å²	75.4	89%	0.887	41%	0.41	S	S	*	.	S	Bend	trans	94	-4.7	165.7	0	0	0	0	0	117.6	F788	F788-G790 PolarHBondContact O-N 3.28Å
791	T	57.3	Low	72.5	Confident	63 Å²	63	68.6 Å²	68.6	39%	0.387	40%	0.395	S	S	.	.			trans	-125.7	123.1	175.2	50.4	0	0	0	0	110.9	N794	T791-N794 PolarHBondContact O-ND2 2.86Å; T791-N794 PolarHBondContact OG1-ND2 2.88Å; T791-N794 VanDerWaalsContact OG1-ND2 3.12Å; T791-N794 PolarHBondContact OG1-OD1 3.03Å
792	I	64.2	Low	74.2	Confident	143 Å²	143	59.5 Å²	59.5	73%	0.733	35%	0.354	S	S	*	.	S	Bend	trans	-80.7	-24.5	179.3	-64.8	162.2	0	0	0	111
793	N	82.1	Confident	76	Confident	58 Å²	58	51.5 Å²	51.5	31%	0.31	32%	0.32	S	S	.	.			trans	-108.1	77.7	-169.2	-63.8	22.7	0	0	0	111.2	M750 Q751	M750-N793 VanDerWaalsContact CA-O 3.29Å; M750-N793 WeakPolarHBondContact CA-O 3.26Å; M750-N793 HydrophobicContact CG-CB 4Å; Q751-N793 PolarHBondContact N-O 3.07Å
794	N	89.3	Confident	77.2	Confident	4 Å²	4	49.4 Å²	49.4	2%	0.021	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	139.9	175.9	-63.6	-65.5	0	0	0	110.7	Q751 H753 F788 T791 C854 E855	Q751-N794 WeakPolarHBondContact O-CA 3.03Å; H753-N794 PolarHBondContact NE2-OD1 3.18Å; F788-N794 VanDerWaalsContact CB-ND2 3.31Å; F788-N794 WeakPolarHBondContact CB-ND2 3.26Å; T791-N794 PolarHBondContact O-ND2 2.86Å; T791-N794 PolarHBondContact OG1-ND2 2.88Å; T791-N794 VanDerWaalsContact OG1-ND2 3.12Å; T791-N794 PolarHBondContact OG1-OD1 3.03Å; N794-C854 CarbonylContact O-C 3.58Å; N794-C854 WeakPolarHBondContact O-CA 3.45Å; N794-C854 WeakPolarHBondContact O-CB 3.5Å; N794-E855 PolarHBondContact O-N 2.97Å
795	A	91.2	Very high	77.8	Confident	1 Å²	1	50 Å²	50	1%	0.008	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	149.7	171.4	0	0	0	0	0	110.5	L746 M750 Q751 I752 H753 A856	L746-A795 HydrophobicContact CD2-CB 3.51Å; M750-A795 HydrophobicContact CB-CB 4.45Å; M750-A795 HydrophobicContact SD-CB 4.38Å; Q751-A795 PolarHBondContact O-N 3.48Å; I752-A795 HydrophobicContact CG1-CB 4.39Å; H753-A795 PolarHBondContact N-O 3.12Å; A795-A856 WeakPolarHBondContact CA-O 3.39Å; A795-A856 HydrophobicContact CB-CB 4.41Å
796	L	91.9	Very high	78	Confident	1 Å²	1	43.1 Å²	43.1	1%	0.005	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	124.9	-178	174.9	62.9	0	0	0	110.4	V758 I798 F847 A851 C854 A856 V857 I858	V758-L796 HydrophobicContact CG2-CD1 3.34Å; L796-I798 HydrophobicContact CD1-CG2 3.72Å; L796-I798 HydrophobicContact CD2-CG2 4.39Å; L796-I798 HydrophobicContact CG-CG2 3.95Å; L796-F847 HydrophobicContact CD2-CE2 4.32Å; L796-A851 HydrophobicContact CD2-CB 3.68Å; L796-C854 HydrophobicContact CB-CB 4.35Å; L796-A856 PolarHBondContact N-O 3.34Å; L796-V857 HydrophobicContact CB-CG1 4.3Å; L796-V857 HydrophobicContact CB-CG2 4.22Å; L796-V857 HydrophobicContact CD2-CG1 4.11Å; L796-V857 HydrophobicContact CD2-CG2 4.47Å; L796-V857 HydrophobicContact CG-CG1 4.26Å; L796-V857 CarbonylContact O-C 3.47Å; L796-V857 WeakPolarHBondContact O-CA 3.32Å; L796-I858 PolarHBondContact O-N 3.38Å
797	I	92.1	Very high	77.7	Confident	4 Å²	4	40.3 Å²	40.3	2%	0.021	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	117.6	175.8	-56.3	-177.4	0	0	0	109.5	K733 E737 L746 I752 H753 Y754 I858	K733-I797 HydrophobicContact CG-CG2 3.94Å; E737-I797 HydrophobicContact CB-CD1 4.2Å; E737-I797 HydrophobicContact CG-CD1 3.97Å; L746-I797 HydrophobicContact CD1-CD1 4.29Å; I752-I797 HydrophobicContact CD1-CD1 4.47Å; I752-I797 HydrophobicContact CG2-CB 4.43Å; I752-I797 HydrophobicContact CG2-CD1 3.65Å; I752-I797 HydrophobicContact CG2-CG1 3.85Å; H753-I797 PolarHBondContact O-N 2.91Å; Y754-I797 WeakPolarHBondContact CA-O 3.45Å; Y754-I797 HydrophobicContact CD1-CB 4.03Å; Y754-I797 HydrophobicContact CD1-CG2 4.47Å; Y754-I797 HydrophobicContact CE1-CB 4.1Å; Y754-I797 HydrophobicContact CE1-CD1 4.25Å; Y754-I797 HydrophobicContact CE1-CG2 4.48Å; I797-I858 WeakPolarHBondContact CA-O 3.45Å; I797-I858 HydrophobicContact CG1-CB 4.29Å
798	I	91.1	Very high	76.8	Confident	1 Å²	1	42.9 Å²	42.9	1%	0.005	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	150.7	-176.2	58.8	176.4	0	0	0	111.9	L796 W802 L803 F847 I858 C859 C860	L796-I798 HydrophobicContact CD1-CG2 3.72Å; L796-I798 HydrophobicContact CD2-CG2 4.39Å; L796-I798 HydrophobicContact CG-CG2 3.95Å; I798-W802 HydrophobicContact CB-CE3 3.89Å; I798-W802 HydrophobicContact CB-CZ3 4Å; I798-W802 HydrophobicContact CD1-CE3 4.39Å; I798-W802 HydrophobicContact CD1-CZ3 3.96Å; I798-W802 HydrophobicContact CG2-CE3 3.87Å; I798-W802 HydrophobicContact CG2-CH2 4.2Å; I798-W802 HydrophobicContact CG2-CZ3 3.6Å; I798-L803 HydrophobicContact CD1-CD1 4.15Å; I798-F847 HydrophobicContact CD1-CE2 3.87Å; I798-F847 HydrophobicContact CD1-CZ 3.57Å; I798-I858 PolarHBondContact N-O 3.11Å; I798-C859 VanDerWaalsContact CD1-SG 3.58Å; I798-C859 HydrophobicContact CG1-CB 4.19Å; I798-C859 VanDerWaalsContact CG1-SG 3.57Å; I798-C859 CarbonylContact O-C 3.58Å; I798-C859 WeakPolarHBondContact O-CA 3.35Å; I798-C860 PolarHBondContact O-N 3.05Å
799	T	85	Confident	75.5	Confident	53 Å²	53	47.1 Å²	47.1	33%	0.325	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	152.3	179.4	59.5	0	0	0	0	111.5	G801 W802 L803 C860	T799-G801 VanDerWaalsContact C-N 3.26Å; T799-G801 PolarHBondContact O-N 2.96Å; T799-W802 PolarHBondContact O-N 3.25Å; T799-L803 WeakPolarHBondContact O-CB 2.99Å; T799-L803 PolarHBondContact O-N 2.7Å; T799-C860 CarbonylContact C-O 3.48Å; T799-C860 WeakPolarHBondContact CA-O 3.22Å
800	G	74.6	Confident	74.6	Confident	1 Å²	1	48.2 Å²	48.2	1%	0.01	27%	0.273	C	S	.	.	H	α-helix	trans	-60	-32.9	178.5	0	0	0	0	0	113.7	L803 N804 C860 R861 Q866	G800-L803 PolarHBondContact O-N 2.91Å; G800-N804 PolarHBondContact O-N 2.92Å; G800-C860 PolarHBondContact N-O 2.89Å; G800-R861 WeakPolarHBondContact CA-O 3.46Å; G800-Q866 PolarHBondContact O-NE2 2.82Å
801	G	74.1	Confident	73.5	Confident	51 Å²	51	51.6 Å²	51.6	53%	0.526	26%	0.263	S	S	.	.	H	α-helix	trans	-61.2	-49.3	174.3	0	0	0	0	0	112	T799 L803 N804	T799-G801 VanDerWaalsContact C-N 3.26Å; T799-G801 PolarHBondContact O-N 2.96Å; G801-L803 VanDerWaalsContact C-N 3.34Å; G801-L803 PolarHBondContact O-N 3.1Å; G801-N804 WeakPolarHBondContact O-CB 3.42Å; G801-N804 PolarHBondContact O-N 2.74Å
802	W	79.4	Confident	72.8	Confident	25 Å²	25	54 Å²	54	10%	0.095	27%	0.269	C	S	.	.	H	α-helix	trans	-65.1	-38.4	175.9	178.8	86.2	0	0	0	112.4	G755 V758 I798 T799 N804 E805 I806 F847	G755-W802 PolarHBondContact O-NE1 3.01Å; G755-W802 VanDerWaalsContact O-NE1 3.07Å; V758-W802 HydrophobicContact CB-CH2 4.11Å; V758-W802 HydrophobicContact CB-CZ2 3.84Å; V758-W802 HydrophobicContact CG1-CH2 3.49Å; V758-W802 VanDerWaalsContact CG1-CH2 3.49Å; V758-W802 HydrophobicContact CG1-CZ2 3.52Å; I798-W802 HydrophobicContact CB-CE3 3.89Å; I798-W802 HydrophobicContact CB-CZ3 4Å; I798-W802 HydrophobicContact CD1-CE3 4.39Å; I798-W802 HydrophobicContact CD1-CZ3 3.96Å; I798-W802 HydrophobicContact CG2-CE3 3.87Å; I798-W802 HydrophobicContact CG2-CH2 4.2Å; I798-W802 HydrophobicContact CG2-CZ3 3.6Å; T799-W802 PolarHBondContact O-N 3.25Å; W802-N804 PolarHBondContact O-N 3.21Å; W802-E805 WeakPolarHBondContact O-CB 3.23Å; W802-E805 PolarHBondContact O-N 3.31Å; W802-I806 HydrophobicContact CE3-CD1 4.17Å; W802-I806 HydrophobicContact CH2-CD1 3.07Å; W802-I806 HydrophobicContact CH2-CG1 4.31Å; W802-I806 HydrophobicContact CZ2-CD1 3.49Å; W802-I806 VanDerWaalsContact CZ2-CD1 3.49Å; W802-I806 HydrophobicContact CZ2-CG1 4.47Å; W802-I806 HydrophobicContact CZ3-CD1 3.44Å; W802-I806 VanDerWaalsContact CZ3-CD1 3.44Å; W802-I806 HydrophobicContact CZ3-CG1 4.46Å; W802-F847 AromaticContact CH2-CD2 3.74Å; W802-F847 HydrophobicContact CH2-CD2 3.74Å; W802-F847 AromaticContact CH2-CE2 3.72Å; W802-F847 HydrophobicContact CH2-CE2 3.72Å; W802-F847 HydrophobicContact CZ3-CD2 4.05Å; W802-F847 AromaticContact CZ3-CE2 3.61Å; W802-F847 HydrophobicContact CZ3-CE2 3.61Å; W802-F847 HydrophobicContact CZ3-CZ 4.31Å
803	L	79.8	Confident	71.8	Confident	1 Å²	1	54.5 Å²	54.5	1%	0.005	27%	0.265	C	S	.	.	H	α-helix	trans	-60	-30	-179.8	-173.7	66	0	0	0	112.1	I798 T799 G800 G801 E805 I806 L807 F847 V862 Q866 V870	I798-L803 HydrophobicContact CD1-CD1 4.15Å; T799-L803 WeakPolarHBondContact O-CB 2.99Å; T799-L803 PolarHBondContact O-N 2.7Å; G800-L803 PolarHBondContact O-N 2.91Å; G801-L803 VanDerWaalsContact C-N 3.34Å; G801-L803 PolarHBondContact O-N 3.1Å; L803-E805 VanDerWaalsContact C-N 3.26Å; L803-E805 PolarHBondContact O-N 2.88Å; L803-I806 PolarHBondContact O-N 2.89Å; L803-I806 VanDerWaalsContact O-N 3.08Å; L803-L807 HydrophobicContact CD1-CD1 4.39Å; L803-L807 HydrophobicContact CD1-CG 4.15Å; L803-L807 HydrophobicContact CD2-CD1 3.72Å; L803-L807 HydrophobicContact CD2-CG 4.39Å; L803-L807 HydrophobicContact CG-CD1 3.57Å; L803-L807 HydrophobicContact CG-CG 3.77Å; L803-L807 WeakPolarHBondContact O-CB 3.23Å; L803-L807 VanDerWaalsContact O-CG 3.29Å; L803-L807 WeakPolarHBondContact O-CG 3.45Å; L803-L807 PolarHBondContact O-N 3.24Å; L803-F847 HydrophobicContact CD1-CE1 4.32Å; L803-F847 HydrophobicContact CD1-CZ 4.23Å; L803-V862 HydrophobicContact CD2-CG1 3.59Å; L803-Q866 HydrophobicContact CD2-CB 4.23Å; L803-V870 HydrophobicContact CD1-CG2 4.27Å; L803-V870 HydrophobicContact CD2-CG2 3.58Å
804	N	74.4	Confident	69.8	Low	75 Å²	75	60.1 Å²	60.1	40%	0.401	28%	0.282	S	S	.	.	H	α-helix	trans	-60.4	-31.9	174.3	-77.7	-24.7	0	0	0	113.5	G800 G801 W802 I806 Q866	G800-N804 PolarHBondContact O-N 2.92Å; G801-N804 WeakPolarHBondContact O-CB 3.42Å; G801-N804 PolarHBondContact O-N 2.74Å; W802-N804 PolarHBondContact O-N 3.21Å; N804-I806 PolarHBondContact O-N 2.95Å; N804-Q866 VanDerWaalsContact CG-NE2 3.3Å; N804-Q866 PolarHBondContact ND2-NE2 3.35Å; N804-Q866 PolarHBondContact OD1-NE2 2.91Å
805	E	72.8	Confident	67.6	Low	115 Å²	115	69.4 Å²	69.4	54%	0.537	32%	0.317	S	S	.	.	H	α-helix	trans	-66.2	-24.6	176.7	-61	-173	-174.1	0	0	112.7	W802 L803 R843	W802-E805 WeakPolarHBondContact O-CB 3.23Å; W802-E805 PolarHBondContact O-N 3.31Å; L803-E805 VanDerWaalsContact C-N 3.26Å; L803-E805 PolarHBondContact O-N 2.88Å; E805-R843 IonicContact OE2-NH2 3.55Å
806	I	74.9	Confident	65.3	Low	3 Å²	3	77.1 Å²	77.1	2%	0.015	35%	0.346	C	S	.	.	H	α-helix	trans	-97.6	-36.5	-179.9	-62.5	-172.8	0	0	0	111.3	L762 W802 L803 N804 Y808 Q844 F847	L762-I806 HydrophobicContact CD1-CD1 4.04Å; W802-I806 HydrophobicContact CE3-CD1 4.17Å; W802-I806 HydrophobicContact CH2-CD1 3.07Å; W802-I806 HydrophobicContact CH2-CG1 4.31Å; W802-I806 HydrophobicContact CZ2-CD1 3.49Å; W802-I806 VanDerWaalsContact CZ2-CD1 3.49Å; W802-I806 HydrophobicContact CZ2-CG1 4.47Å; W802-I806 HydrophobicContact CZ3-CD1 3.44Å; W802-I806 VanDerWaalsContact CZ3-CD1 3.44Å; W802-I806 HydrophobicContact CZ3-CG1 4.46Å; L803-I806 PolarHBondContact O-N 2.89Å; L803-I806 VanDerWaalsContact O-N 3.08Å; N804-I806 PolarHBondContact O-N 2.95Å; I806-Y808 PolarHBondContact O-N 3.49Å; I806-Q844 HydrophobicContact CG2-CG 4.21Å; I806-Q844 VanDerWaalsContact O-CG 3.29Å; I806-Q844 WeakPolarHBondContact O-CG 3.39Å; I806-Q844 PolarHBondContact O-NE2 3.01Å; I806-F847 HydrophobicContact CD1-CB 4.05Å; I806-F847 HydrophobicContact CD1-CD2 3.7Å; I806-F847 HydrophobicContact CD1-CE2 4.33Å; I806-F847 HydrophobicContact CD1-CG 3.82Å; I806-F847 HydrophobicContact CG2-CB 4.07Å; I806-F847 HydrophobicContact CG2-CD1 3.92Å; I806-F847 HydrophobicContact CG2-CG 4Å
807	L	69.1	Low	63.2	Low	18 Å²	18	82.1 Å²	82.1	9%	0.094	37%	0.372	C	S	.	.			trans	-72.3	75.7	176.6	-67.8	-177.7	0	0	0	110.5	L803 E809 Q866 N869 L873	L803-L807 HydrophobicContact CD1-CD1 4.39Å; L803-L807 HydrophobicContact CD1-CG 4.15Å; L803-L807 HydrophobicContact CD2-CD1 3.72Å; L803-L807 HydrophobicContact CD2-CG 4.39Å; L803-L807 HydrophobicContact CG-CD1 3.57Å; L803-L807 HydrophobicContact CG-CG 3.77Å; L803-L807 WeakPolarHBondContact O-CB 3.23Å; L803-L807 VanDerWaalsContact O-CG 3.29Å; L803-L807 WeakPolarHBondContact O-CG 3.45Å; L803-L807 PolarHBondContact O-N 3.24Å; L807-E809 PolarHBondContact O-N 2.95Å; L807-E809 VanDerWaalsContact O-N 3.15Å; L807-Q866 HydrophobicContact CD1-CB 4.21Å; L807-Q866 HydrophobicContact CD1-CG 3.95Å; L807-N869 HydrophobicContact CD1-CB 3.92Å; L807-N869 HydrophobicContact CD2-CB 3.8Å; L807-N869 HydrophobicContact CG-CB 4.48Å; L807-L873 HydrophobicContact CD2-CD1 3.36Å; L807-L873 HydrophobicContact CD2-CG 4.19Å
808	Y	59	Low	60.9	Low	73 Å²	73	91.7 Å²	91.7	29%	0.286	41%	0.408	S	S	.	.			trans	-63.2	113.3	171	-176.4	-123.6	0	0	0	111.1	I806 K810 D837 K840	I806-Y808 PolarHBondContact O-N 3.49Å; Y808-K810 HydrophobicContact CD1-CG 4.41Å; Y808-K810 HydrophobicContact CE1-CG 4.32Å; Y808-D837 PolarHBondContact OH-OD1 3.04Å; Y808-K840 HydrophobicContact CD1-CB 4.4Å; Y808-K840 HydrophobicContact CD1-CD 4.28Å; Y808-K840 HydrophobicContact CD2-CD 3.49Å; Y808-K840 VanDerWaalsContact CD2-CD 3.49Å; Y808-K840 HydrophobicContact CE1-CD 4.26Å; Y808-K840 HydrophobicContact CE2-CD 3.51Å; Y808-K840 HydrophobicContact CG-CB 4.33Å; Y808-K840 HydrophobicContact CG-CD 3.9Å
809	E	52.5	Low	58.7	Low	105 Å²	105	97.4 Å²	97.4	49%	0.491	44%	0.438	S	S	.	.			trans	-74.6	121.3	163.7	-70.6	-167.7	157.8	0	0	109.4	L807 K811 K865	L807-E809 PolarHBondContact O-N 2.95Å; L807-E809 VanDerWaalsContact O-N 3.15Å; E809-K811 VanDerWaalsContact C-N 3.27Å; E809-K811 PolarHBondContact O-N 3.34Å; E809-K865 IonicContact OE1-NZ 2.75Å; E809-K865 PolarHBondContact OE1-NZ 3.42Å
810	K	47.7	Very low	56.8	Low	131 Å²	131	105.6 Å²	105.6	57%	0.57	46%	0.463	S	S	*	.			trans	-68.8	82.9	172.6	-77.6	180	174.9	170.2	0	109.6	Y808 K812	Y808-K810 HydrophobicContact CD1-CG 4.41Å; Y808-K810 HydrophobicContact CE1-CG 4.32Å; K810-K812 PolarHBondContact O-N 3.2Å; K810-K812 VanDerWaalsContact O-N 3.08Å
811	K	40.1	Very low	55.5	Low	158 Å²	158	116.4 Å²	116.4	69%	0.687	50%	0.503	S	S	*	.			trans	-60.4	115.5	165.4	-83.5	-164.1	174.8	-165.5	0	109	E22 E809	E22-K811 IonicContact OE2-NZ 2.94Å; E22-K811 PolarHBondContact OE2-NZ 3.23Å; E809-K811 VanDerWaalsContact C-N 3.27Å; E809-K811 PolarHBondContact O-N 3.34Å
812	K	44.2	Very low	54.2	Low	114 Å²	114	120.5 Å²	120.5	50%	0.496	51%	0.512	S	S	.	.			trans	41.5	85.3	164.6	-81.7	170.2	177	153.1	0	118	D24 K810 R814	D24-K812 VanDerWaalsContact OD1-CE 3.23Å; D24-K812 WeakPolarHBondContact OD1-CE 3.31Å; D24-K812 IonicContact OD1-NZ 2.75Å; D24-K812 PolarHBondContact OD1-NZ 3.11Å; D24-K812 IonicContact OD2-NZ 2.64Å; K810-K812 PolarHBondContact O-N 3.2Å; K810-K812 VanDerWaalsContact O-N 3.08Å; K812-R814 VanDerWaalsContact C-N 3.27Å; K812-R814 PolarHBondContact O-N 3.33Å
813	K	41.7	Very low	52.5	Low	153 Å²	153	122.8 Å²	122.8	67%	0.665	54%	0.544	S	S	*	.	H	α-helix	trans	-63.2	-25.5	166	-134	-177.1	-175.2	-168.5	0	113.7	L817	K813-L817 HydrophobicContact CG-CD1 4.45Å; K813-L817 WeakPolarHBondContact O-CD1 3.4Å
814	R	40.8	Very low	50.7	Low	176 Å²	176	133.8 Å²	133.8	66%	0.664	59%	0.585	S	S	*	*	H	α-helix	trans	-75.4	-31.5	-175.7	-94.4	178	167.4	159.2	-8	114.4	D28 K812	D28-R814 VanDerWaalsContact CG-NH1 3.25Å; D28-R814 IonicContact OD1-CZ 2.99Å; D28-R814 VanDerWaalsContact OD1-CZ 3.26Å; D28-R814 IonicContact OD1-NH1 2.79Å; D28-R814 PolarHBondContact OD1-NH1 3.47Å; D28-R814 IonicContact OD1-NH2 3.35Å; D28-R814 PolarHBondContact OD1-NH2 3.46Å; D28-R814 IonicContact OD2-CZ 2.66Å; D28-R814 IonicContact OD2-NH1 3.35Å; D28-R814 PolarHBondContact OD2-NH1 3.16Å; D28-R814 IonicContact OD2-NH2 2.75Å; D28-R814 PolarHBondContact OD2-NH2 3.14Å; K812-R814 VanDerWaalsContact C-N 3.27Å; K812-R814 PolarHBondContact O-N 3.33Å
815	R	42	Very low	48.8	Very low	198 Å²	198	142.1 Å²	142.1	75%	0.747	61%	0.611	S	S	*	*	H	α-helix	trans	-74.6	-38.3	179.9	-106.1	-177.5	174.9	-178.2	-0.9	113.3
816	R	43.8	Very low	47.1	Very low	163 Å²	163	145.5 Å²	145.5	62%	0.615	63%	0.627	S	S	*	*	H	α-helix	trans	-76.7	-31.4	-178.1	-81.8	-178.4	173.4	178.3	-1.9	114.2	R818 L819 R820 D837	R816-R818 PolarHBondContact O-N 3.46Å; R816-L819 PolarHBondContact O-N 2.78Å; R816-R820 WeakPolarHBondContact O-CB 3.5Å; R816-R820 PolarHBondContact O-N 3.46Å; R816-D837 IonicContact NH1-OD1 3.9Å; R816-D837 IonicContact NH1-OD2 3.98Å; R816-D837 PolarHBondContact NH1-OD2 3.29Å
817	L	47.5	Very low	45.2	Very low	106 Å²	106	151.3 Å²	151.3	56%	0.555	66%	0.663	S	S	*	*	H	α-helix	trans	-64.5	-29.4	175.6	-104.5	131.5	0	0	0	112.4	K813 R821	K813-L817 HydrophobicContact CG-CD1 4.45Å; K813-L817 WeakPolarHBondContact O-CD1 3.4Å; L817-R821 PolarHBondContact O-N 2.65Å
818	R	43.7	Very low	43.6	Very low	206 Å²	206	154.9 Å²	154.9	78%	0.777	69%	0.687	S	S	*	*	H	α-helix	trans	-71.2	-40.6	174.9	-144.4	176.2	-179.6	-175.9	-0.5	111.9	R816	R816-R818 PolarHBondContact O-N 3.46Å
819	L	45.4	Very low	42.5	Very low	121 Å²	121	157.1 Å²	157.1	63%	0.634	71%	0.714	S	S	*	*	H	α-helix	trans	-71.1	-30.8	174.5	-92.6	112.7	0	0	0	113.7	R816 R821 L822	R816-L819 PolarHBondContact O-N 2.78Å; L819-R821 VanDerWaalsContact C-N 3.29Å; L819-R821 PolarHBondContact O-N 3.34Å; L819-L822 WeakPolarHBondContact O-CB 3.44Å; L819-L822 PolarHBondContact O-N 3.33Å
820	R	44.3	Very low	41.5	Very low	224 Å²	224	157 Å²	157	85%	0.845	72%	0.716	S	S	*	*	H	α-helix	trans	-71.9	-22.5	179.3	-161.9	175.7	155.5	-176.7	-6.9	113	R816 L822	R816-R820 WeakPolarHBondContact O-CB 3.5Å; R816-R820 PolarHBondContact O-N 3.46Å; R820-L822 VanDerWaalsContact C-N 3.26Å
821	R	47.3	Very low	41.3	Very low	229 Å²	229	157.2 Å²	157.2	86%	0.864	73%	0.731	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.7	-13.8	168.2	-78.3	-173.4	178.2	-178.9	-0.2	113.4	L817 L819	L817-R821 PolarHBondContact O-N 2.65Å; L819-R821 VanDerWaalsContact C-N 3.29Å; L819-R821 PolarHBondContact O-N 3.34Å
822	L	48.3	Very low	41.3	Very low	136 Å²	136	158.2 Å²	158.2	71%	0.712	74%	0.738	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98	11.4	-177.8	-96	137.9	0	0	0	114.7	L819 R820 R824	L819-L822 WeakPolarHBondContact O-CB 3.44Å; L819-L822 PolarHBondContact O-N 3.33Å; R820-L822 VanDerWaalsContact C-N 3.26Å; L822-R824 PolarHBondContact O-N 3.2Å
823	G	43.3	Very low	41.3	Very low	74 Å²	74	157.2 Å²	157.2	76%	0.763	74%	0.738	S	S	*	*	T	Hydrogen-bonded Turn	trans	65.4	5.3	162.7	0	0	0	0	0	117.9
824	R	41.2	Very low	41.7	Very low	231 Å²	231	154.3 Å²	154.3	87%	0.872	74%	0.735	S	S	*	*			trans	-102.8	105.1	175.9	-80.1	-177	172.9	178.3	-1.3	111.4	L822	L822-R824 PolarHBondContact O-N 3.2Å
825	R	35.6	Very low	42.3	Very low	250 Å²	250	148.6 Å²	148.6	94%	0.943	72%	0.717	S	S	*	*			trans	-81.1	108.9	160.9	-118.4	179.2	175.9	175.3	-2.9	107.2
826	Q	37.5	Very low	43.4	Very low	186 Å²	186	143.7 Å²	143.7	87%	0.869	71%	0.705	S	S	*	*	P	Polyproline II helix	trans	-78.6	131.1	162.9	-83.9	178.8	-13.8	0	0	108.7
827	T	34.6	Very low	44.5	Very low	125 Å²	125	138.8 Å²	138.8	77%	0.767	69%	0.691	S	S	*	*	P	Polyproline II helix	trans	-71.7	136.7	166.8	39.9	0	0	0	0	109.7	S829	T827-S829 PolarHBondContact O-N 3.08Å
828	P	36.1	Very low	45.5	Very low	93 Å²	93	140.2 Å²	140.2	60%	0.604	70%	0.695	S	S	*	*	P	Polyproline II helix	trans	-65.9	128.5	176.9	26.4	-31.4	0	0	0	110	D833	P828-D833 HydrophobicContact CB-CB 3.99Å; P828-D833 WeakPolarHBondContact CB-OD2 3.4Å
829	S	34.5	Very low	46.8	Very low	121 Å²	121	133.2 Å²	133.2	85%	0.846	67%	0.671	S	S	*	*	S	Bend	trans	-92.6	7.9	-175.5	54.3	0	0	0	0	113.8	T827	T827-S829 PolarHBondContact O-N 3.08Å
830	N	32.5	Very low	48.2	Very low	103 Å²	103	129.9 Å²	129.9	55%	0.551	65%	0.651	S	S	*	*	S	Bend	trans	-139.8	138	-179.8	-128.1	-0.8	0	0	0	111.5	Q832 D833	N830-Q832 PolarHBondContact O-N 3.21Å; N830-Q832 VanDerWaalsContact O-N 3.13Å; N830-D833 PolarHBondContact O-N 2.62Å
831	P	42.3	Very low	49.8	Very low	134 Å²	134	123.2 Å²	123.2	87%	0.87	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.3	-3	178.5	-15	29.5	0	0	0	114.8
832	Q	40.7	Very low	51.3	Low	179 Å²	179	115.8 Å²	115.8	84%	0.836	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.3	36.5	177.7	-74.7	173.1	-33	0	0	111.7	N830	N830-Q832 PolarHBondContact O-N 3.21Å; N830-Q832 VanDerWaalsContact O-N 3.13Å
833	D	44.9	Very low	52.9	Low	93 Å²	93	110.8 Å²	110.8	50%	0.497	58%	0.578	S	S	.	*			trans	-82.2	150.4	173.7	-114.5	-20.2	0	0	0	112	P828 N830	P828-D833 HydrophobicContact CB-CB 3.99Å; P828-D833 WeakPolarHBondContact CB-OD2 3.4Å; N830-D833 PolarHBondContact O-N 2.62Å
834	P	49.4	Very low	54.9	Low	93 Å²	93	108.1 Å²	108.1	60%	0.604	55%	0.545	S	S	*	.			trans	-71.5	136.5	-162.3	30.3	-35.1	0	0	0	111.6	D836	P834-D836 PolarHBondContact O-N 3.07Å
835	M	53.6	Low	57	Low	56 Å²	56	98.9 Å²	98.9	28%	0.276	51%	0.514	S	S	.	.			trans	-31	127	173.4	-136.4	-178.7	102	0	0	112.5	E839 K840 R843	M835-E839 HydrophobicContact CE-CB 3.72Å; M835-E839 WeakPolarHBondContact CE-O 3.42Å; M835-E839 HydrophobicContact CG-CB 4.17Å; M835-E839 WeakPolarHBondContact CG-OE2 3.35Å; M835-K840 HydrophobicContact CB-CG 4.2Å; M835-K840 VanDerWaalsContact CE-CA 3.43Å; M835-K840 HydrophobicContact CE-CB 4.07Å; M835-K840 HydrophobicContact CE-CG 3.51Å; M835-K840 VanDerWaalsContact CE-N 3.27Å; M835-K840 VanDerWaalsContact O-CE 3.3Å; M835-K840 WeakPolarHBondContact O-CE 3.16Å; M835-K840 HydrophobicContact SD-CG 4.35Å; M835-R843 HydrophobicContact CE-CB 4.37Å
836	D	64.6	Low	59.3	Low	94 Å²	94	87.1 Å²	87.1	50%	0.503	47%	0.47	S	S	.	.			trans	-56.1	142.1	-178.8	-175	20.8	0	0	0	110.6	P834 Q838 E839 K840	P834-D836 PolarHBondContact O-N 3.07Å; D836-Q838 PolarHBondContact O-N 2.71Å; D836-Q838 VanDerWaalsContact O-N 3.08Å; D836-E839 HydrophobicContact CB-CB 4.49Å; D836-E839 HydrophobicContact CB-CG 4.2Å; D836-E839 WeakPolarHBondContact O-CA 3.46Å; D836-E839 WeakPolarHBondContact O-CB 3.41Å; D836-E839 PolarHBondContact O-N 3.46Å; D836-K840 PolarHBondContact O-N 2.86Å; D836-K840 VanDerWaalsContact O-N 3.07Å
837	D	66.8	Low	61.7	Low	61 Å²	61	78.3 Å²	78.3	33%	0.326	43%	0.429	S	S	.	.	H	α-helix	trans	-56.5	-31.8	-177.2	-76.7	-33.5	0	0	0	111.2	Y808 R816 K840 E841	Y808-D837 PolarHBondContact OH-OD1 3.04Å; R816-D837 IonicContact NH1-OD1 3.9Å; R816-D837 IonicContact NH1-OD2 3.98Å; R816-D837 PolarHBondContact NH1-OD2 3.29Å; D837-K840 PolarHBondContact O-N 2.69Å; D837-E841 PolarHBondContact O-N 3.02Å; D837-E841 VanDerWaalsContact O-N 3.08Å
838	Q	69.1	Low	64.2	Low	136 Å²	136	72.4 Å²	72.4	64%	0.636	39%	0.393	S	S	*	.	H	α-helix	trans	-70.3	-36.6	175.9	-171.2	173.8	-16.9	0	0	112.7	D836 K840 M842	D836-Q838 PolarHBondContact O-N 2.71Å; D836-Q838 VanDerWaalsContact O-N 3.08Å; Q838-K840 VanDerWaalsContact C-N 3.34Å; Q838-M842 WeakPolarHBondContact O-CB 3.41Å; Q838-M842 PolarHBondContact O-N 3.44Å
839	E	70.4	Confident	66.6	Low	58 Å²	58	69 Å²	69	27%	0.271	37%	0.369	S	S	.	.	H	α-helix	trans	-68.5	-36	174.5	-70	-172.2	146.8	0	0	111	R770 M835 D836 M842 R843	R770-E839 IonicContact CZ-OE1 3.17Å; R770-E839 IonicContact CZ-OE2 3.61Å; R770-E839 IonicContact NE-OE1 3.35Å; R770-E839 PolarHBondContact NE-OE1 3.18Å; R770-E839 IonicContact NH2-OE1 3.75Å; R770-E839 PolarHBondContact NH2-OE1 2.97Å; R770-E839 IonicContact NH2-OE2 2.63Å; R770-E839 PolarHBondContact NH2-OE2 3.47Å; M835-E839 HydrophobicContact CE-CB 3.72Å; M835-E839 WeakPolarHBondContact CE-O 3.42Å; M835-E839 HydrophobicContact CG-CB 4.17Å; M835-E839 WeakPolarHBondContact CG-OE2 3.35Å; D836-E839 HydrophobicContact CB-CB 4.49Å; D836-E839 HydrophobicContact CB-CG 4.2Å; D836-E839 WeakPolarHBondContact O-CA 3.46Å; D836-E839 WeakPolarHBondContact O-CB 3.41Å; D836-E839 PolarHBondContact O-N 3.46Å; E839-M842 PolarHBondContact O-N 3.49Å; E839-R843 PolarHBondContact O-N 3.22Å
840	K	74.8	Confident	69.1	Low	51 Å²	51	63.3 Å²	63.3	22%	0.222	33%	0.329	C	S	.	.	H	α-helix	trans	-65.4	-45.2	175.8	-66.5	-176.2	-178.4	175.4	0	111.7	Y808 M835 D836 D837 Q838 M842 R843 Q844	Y808-K840 HydrophobicContact CD1-CB 4.4Å; Y808-K840 HydrophobicContact CD1-CD 4.28Å; Y808-K840 HydrophobicContact CD2-CD 3.49Å; Y808-K840 VanDerWaalsContact CD2-CD 3.49Å; Y808-K840 HydrophobicContact CE1-CD 4.26Å; Y808-K840 HydrophobicContact CE2-CD 3.51Å; Y808-K840 HydrophobicContact CG-CB 4.33Å; Y808-K840 HydrophobicContact CG-CD 3.9Å; M835-K840 HydrophobicContact CB-CG 4.2Å; M835-K840 VanDerWaalsContact CE-CA 3.43Å; M835-K840 HydrophobicContact CE-CB 4.07Å; M835-K840 HydrophobicContact CE-CG 3.51Å; M835-K840 VanDerWaalsContact CE-N 3.27Å; M835-K840 VanDerWaalsContact O-CE 3.3Å; M835-K840 WeakPolarHBondContact O-CE 3.16Å; M835-K840 HydrophobicContact SD-CG 4.35Å; D836-K840 PolarHBondContact O-N 2.86Å; D836-K840 VanDerWaalsContact O-N 3.07Å; D837-K840 PolarHBondContact O-N 2.69Å; Q838-K840 VanDerWaalsContact C-N 3.34Å; K840-M842 VanDerWaalsContact C-N 3.29Å; K840-M842 PolarHBondContact O-N 3.47Å; K840-R843 PolarHBondContact O-N 3.14Å; K840-Q844 PolarHBondContact O-N 3.25Å
841	E	78.9	Confident	71.8	Confident	85 Å²	85	58.4 Å²	58.4	40%	0.397	30%	0.303	S	S	.	.	H	α-helix	trans	-62	-39	174.9	-174.7	157.9	-142.6	0	0	111.4	D837 Q844 V845 K876 Y877	D837-E841 PolarHBondContact O-N 3.02Å; D837-E841 VanDerWaalsContact O-N 3.08Å; E841-Q844 WeakPolarHBondContact O-CB 3.21Å; E841-Q844 PolarHBondContact O-N 3.28Å; E841-V845 WeakPolarHBondContact O-CG2 3.34Å; E841-V845 PolarHBondContact O-N 3.02Å; E841-V845 VanDerWaalsContact O-N 3.14Å; E841-K876 IonicContact OE1-NZ 2.88Å; E841-K876 PolarHBondContact OE1-NZ 3.13Å; E841-Y877 HydrophobicContact CG-CE1 4.39Å
842	M	79.5	Confident	73.9	Confident	72 Å²	72	52.5 Å²	52.5	36%	0.355	27%	0.265	S	S	.	.	H	α-helix	trans	-66.7	-39.1	176.2	-160.4	63.9	66.3	0	0	112.7	R769 Q838 E839 K840 Q844 V845 D846	R769-M842 PolarHBondContact NH1-SD 3.27Å; Q838-M842 WeakPolarHBondContact O-CB 3.41Å; Q838-M842 PolarHBondContact O-N 3.44Å; E839-M842 PolarHBondContact O-N 3.49Å; K840-M842 VanDerWaalsContact C-N 3.29Å; K840-M842 PolarHBondContact O-N 3.47Å; M842-Q844 VanDerWaalsContact C-N 3.27Å; M842-Q844 PolarHBondContact O-N 2.97Å; M842-V845 WeakPolarHBondContact O-CB 3.39Å; M842-V845 PolarHBondContact O-N 3.02Å; M842-V845 VanDerWaalsContact O-N 3.16Å; M842-D846 VanDerWaalsContact O-CG 3.23Å; M842-D846 PolarHBondContact O-N 2.71Å
843	R	81.6	Confident	76.1	Confident	32 Å²	32	46.9 Å²	46.9	12%	0.121	24%	0.239	C	C	.	.	H	α-helix	trans	-58.7	-39.8	174.8	-161.5	173.7	-179.2	-163.3	-3.9	111.7	N759 Q766 E805 M835 E839 K840 D846 F847	N759-R843 PolarHBondContact OD1-NH2 3.33Å; Q766-R843 VanDerWaalsContact NE2-CB 3.29Å; E805-R843 IonicContact OE2-NH2 3.55Å; M835-R843 HydrophobicContact CE-CB 4.37Å; E839-R843 PolarHBondContact O-N 3.22Å; K840-R843 PolarHBondContact O-N 3.14Å; R843-D846 PolarHBondContact O-N 2.87Å; R843-F847 WeakPolarHBondContact O-CB 3.17Å; R843-F847 PolarHBondContact O-N 3.32Å
844	Q	84.3	Confident	78.1	Confident	17 Å²	17	42.5 Å²	42.5	8%	0.079	22%	0.215	C	C	.	.	H	α-helix	trans	-65.4	-42.4	175.4	-69.4	-177.2	-21.5	0	0	112.4	I806 K840 E841 M842 D846 F847 V848 L873 Y877	I806-Q844 HydrophobicContact CG2-CG 4.21Å; I806-Q844 VanDerWaalsContact O-CG 3.29Å; I806-Q844 WeakPolarHBondContact O-CG 3.39Å; I806-Q844 PolarHBondContact O-NE2 3.01Å; K840-Q844 PolarHBondContact O-N 3.25Å; E841-Q844 WeakPolarHBondContact O-CB 3.21Å; E841-Q844 PolarHBondContact O-N 3.28Å; M842-Q844 VanDerWaalsContact C-N 3.27Å; M842-Q844 PolarHBondContact O-N 2.97Å; Q844-D846 VanDerWaalsContact C-N 3.33Å; Q844-F847 PolarHBondContact O-N 3.4Å; Q844-V848 WeakPolarHBondContact O-CG2 3.4Å; Q844-V848 PolarHBondContact O-N 3.34Å; Q844-L873 HydrophobicContact CB-CD2 4.22Å; Q844-L873 HydrophobicContact CG-CD2 4.25Å; Q844-Y877 HydrophobicContact CB-CE2 3.74Å; Q844-Y877 PolarHBondContact OE1-OH 3.13Å
845	V	84.7	Confident	79.9	Confident	37 Å²	37	41.5 Å²	41.5	22%	0.224	20%	0.203	C	C	.	.	H	α-helix	trans	-60.8	-45.5	176.3	173.4	0	0	0	0	110.4	E841 M842 V848 N849 Y877	E841-V845 WeakPolarHBondContact O-CG2 3.34Å; E841-V845 PolarHBondContact O-N 3.02Å; E841-V845 VanDerWaalsContact O-N 3.14Å; M842-V845 WeakPolarHBondContact O-CB 3.39Å; M842-V845 PolarHBondContact O-N 3.02Å; M842-V845 VanDerWaalsContact O-N 3.16Å; V845-V848 PolarHBondContact O-N 3.46Å; V845-N849 WeakPolarHBondContact O-CB 3.37Å; V845-N849 VanDerWaalsContact O-CG 3.29Å; V845-N849 PolarHBondContact O-N 3.09Å; V845-Y877 HydrophobicContact CG2-CD1 3.48Å; V845-Y877 VanDerWaalsContact CG2-CD1 3.48Å; V845-Y877 HydrophobicContact CG2-CD2 4.5Å; V845-Y877 HydrophobicContact CG2-CE1 3.5Å; V845-Y877 VanDerWaalsContact CG2-CE1 3.5Å; V845-Y877 HydrophobicContact CG2-CE2 4.49Å; V845-Y877 HydrophobicContact CG2-CG 4.02Å
846	D	85.3	Confident	81.5	Confident	3 Å²	3	38.9 Å²	38.9	2%	0.016	19%	0.19	C	C	.	.	H	α-helix	trans	-63.4	-44.4	179.7	-68.1	-18.8	0	0	0	112.3	L762 R769 F787 M842 R843 Q844 N849 M850	L762-D846 HydrophobicContact CD2-CB 3.52Å; R769-D846 IonicContact CZ-OD1 3.91Å; R769-D846 IonicContact CZ-OD2 3.42Å; R769-D846 IonicContact NH1-OD1 2.66Å; R769-D846 IonicContact NH2-OD1 3.42Å; R769-D846 PolarHBondContact NH2-OD1 3.41Å; R769-D846 IonicContact NH2-OD2 3.22Å; R769-D846 PolarHBondContact NH2-OD2 2.87Å; F787-D846 HydrophobicContact CZ-CB 3.93Å; M842-D846 VanDerWaalsContact O-CG 3.23Å; M842-D846 PolarHBondContact O-N 2.71Å; R843-D846 PolarHBondContact O-N 2.87Å; Q844-D846 VanDerWaalsContact C-N 3.33Å; D846-N849 PolarHBondContact O-N 3.4Å; D846-M850 WeakPolarHBondContact O-CB 3.19Å; D846-M850 PolarHBondContact O-N 3.29Å
847	F	88.2	Confident	82.9	Confident	2 Å²	2	34.4 Å²	34.4	1%	0.009	17%	0.166	C	C	.	.	H	α-helix	trans	-58.2	-49.7	174.6	167.6	-107	0	0	0	111.4	L762 L796 I798 W802 L803 I806 R843 Q844 N849 M850 A851	L762-F847 HydrophobicContact CD1-CB 4.4Å; L796-F847 HydrophobicContact CD2-CE2 4.32Å; I798-F847 HydrophobicContact CD1-CE2 3.87Å; I798-F847 HydrophobicContact CD1-CZ 3.57Å; W802-F847 AromaticContact CH2-CD2 3.74Å; W802-F847 HydrophobicContact CH2-CD2 3.74Å; W802-F847 AromaticContact CH2-CE2 3.72Å; W802-F847 HydrophobicContact CH2-CE2 3.72Å; W802-F847 HydrophobicContact CZ3-CD2 4.05Å; W802-F847 AromaticContact CZ3-CE2 3.61Å; W802-F847 HydrophobicContact CZ3-CE2 3.61Å; W802-F847 HydrophobicContact CZ3-CZ 4.31Å; L803-F847 HydrophobicContact CD1-CE1 4.32Å; L803-F847 HydrophobicContact CD1-CZ 4.23Å; I806-F847 HydrophobicContact CD1-CB 4.05Å; I806-F847 HydrophobicContact CD1-CD2 3.7Å; I806-F847 HydrophobicContact CD1-CE2 4.33Å; I806-F847 HydrophobicContact CD1-CG 3.82Å; I806-F847 HydrophobicContact CG2-CB 4.07Å; I806-F847 HydrophobicContact CG2-CD1 3.92Å; I806-F847 HydrophobicContact CG2-CG 4Å; R843-F847 WeakPolarHBondContact O-CB 3.17Å; R843-F847 PolarHBondContact O-N 3.32Å; Q844-F847 PolarHBondContact O-N 3.4Å; F847-N849 VanDerWaalsContact C-N 3.31Å; F847-N849 PolarHBondContact O-N 3.36Å; F847-M850 PolarHBondContact O-N 3.11Å; F847-A851 HydrophobicContact CE2-CB 4.44Å; F847-A851 HydrophobicContact CZ-CB 4.46Å; F847-A851 VanDerWaalsContact O-CB 3.31Å; F847-A851 WeakPolarHBondContact O-CB 3.41Å; F847-A851 PolarHBondContact O-N 2.98Å
848	V	87.1	Confident	84.2	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-63.7	-39	178.8	172.4	0	0	0	0	110.9	Q844 V845 C852 L873 Y877 K878	Q844-V848 WeakPolarHBondContact O-CG2 3.4Å; Q844-V848 PolarHBondContact O-N 3.34Å; V845-V848 PolarHBondContact O-N 3.46Å; V848-C852 WeakPolarHBondContact O-CB 3.29Å; V848-C852 PolarHBondContact O-N 2.98Å; V848-C852 PolarHBondContact O-SG 3.27Å; V848-L873 HydrophobicContact CG2-CB 3.99Å; V848-Y877 HydrophobicContact CG2-CD2 4.09Å; V848-K878 HydrophobicContact CG1-CD 4.4Å; V848-K878 HydrophobicContact CG1-CG 3.77Å
849	N	86.6	Confident	85.3	Confident	22 Å²	22	25.1 Å²	25.1	12%	0.118	12%	0.121	C	C	.	.	H	α-helix	trans	-61.7	-48.9	176	-78.3	-18.6	0	0	0	111.7	F787 V845 D846 F847 C852 E853 K878	F787-N849 HydrophobicContact CE2-CB 4.06Å; V845-N849 WeakPolarHBondContact O-CB 3.37Å; V845-N849 VanDerWaalsContact O-CG 3.29Å; V845-N849 PolarHBondContact O-N 3.09Å; D846-N849 PolarHBondContact O-N 3.4Å; F847-N849 VanDerWaalsContact C-N 3.31Å; F847-N849 PolarHBondContact O-N 3.36Å; N849-C852 PolarHBondContact O-N 2.85Å; N849-E853 PolarHBondContact O-N 3.06Å; N849-K878 WeakPolarHBondContact OD1-CE 3.39Å; N849-K878 PolarHBondContact OD1-NZ 2.9Å
850	M	86.8	Confident	86	Confident	1 Å²	1	22.4 Å²	22.4	1%	0.005	11%	0.108	C	C	.	.	H	α-helix	trans	-61.6	-50.4	177.6	-174.6	-169.3	-56.8	0	0	112	V758 K761 L762 F787 F788 D846 F847 C852 E853 C854	V758-M850 HydrophobicContact CB-SD 4.23Å; V758-M850 HydrophobicContact CG1-CE 4.09Å; V758-M850 HydrophobicContact CG1-SD 3.61Å; V758-M850 HydrophobicContact CG2-SD 4.12Å; K761-M850 HydrophobicContact CB-CE 3.76Å; L762-M850 HydrophobicContact CD2-CE 3.6Å; L762-M850 HydrophobicContact CG-CE 3.77Å; F787-M850 HydrophobicContact CB-CB 4.29Å; F787-M850 HydrophobicContact CB-CE 4.44Å; F787-M850 HydrophobicContact CB-CG 3.87Å; F787-M850 HydrophobicContact CD1-CB 4.37Å; F787-M850 HydrophobicContact CD1-CE 3.4Å; F787-M850 HydrophobicContact CD1-CG 4.37Å; F787-M850 HydrophobicContact CD2-CB 3.75Å; F787-M850 HydrophobicContact CD2-CG 4.27Å; F787-M850 HydrophobicContact CE1-CE 3.66Å; F787-M850 HydrophobicContact CE2-CB 4.09Å; F787-M850 HydrophobicContact CG-CB 3.89Å; F787-M850 HydrophobicContact CG-CE 3.96Å; F787-M850 HydrophobicContact CG-CG 3.93Å; F787-M850 HydrophobicContact CZ-CE 4.43Å; F788-M850 HydrophobicContact CE2-CG 3.46Å; F788-M850 VanDerWaalsContact CE2-CG 3.46Å; F788-M850 HydrophobicContact CE2-SD 4.43Å; F788-M850 HydrophobicContact CZ-CG 3.64Å; F788-M850 HydrophobicContact CZ-SD 4.02Å; D846-M850 WeakPolarHBondContact O-CB 3.19Å; D846-M850 PolarHBondContact O-N 3.29Å; F847-M850 PolarHBondContact O-N 3.11Å; M850-C852 PolarHBondContact O-N 2.93Å; M850-E853 WeakPolarHBondContact O-CB 3.39Å; M850-E853 PolarHBondContact O-N 3.22Å; M850-C854 PolarHBondContact O-N 3.27Å
851	A	88.3	Confident	86.2	Confident	0 Å²	0	26.2 Å²	26.2	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-62.3	-30.3	179.5	0	0	0	0	0	112.1	W726 L796 F847 E853 C854 V857	W726-A851 HydrophobicContact CH2-CB 3.44Å; W726-A851 VanDerWaalsContact CH2-CB 3.44Å; W726-A851 HydrophobicContact CZ2-CB 3.78Å; W726-A851 HydrophobicContact CZ3-CB 4.3Å; L796-A851 HydrophobicContact CD2-CB 3.68Å; F847-A851 HydrophobicContact CE2-CB 4.44Å; F847-A851 HydrophobicContact CZ-CB 4.46Å; F847-A851 VanDerWaalsContact O-CB 3.31Å; F847-A851 WeakPolarHBondContact O-CB 3.41Å; F847-A851 PolarHBondContact O-N 2.98Å; A851-E853 VanDerWaalsContact C-N 3.33Å; A851-C854 PolarHBondContact O-N 2.71Å; A851-V857 HydrophobicContact CB-CG2 4.36Å; A851-V857 WeakPolarHBondContact O-CG2 3.36Å
852	C	86.1	Confident	86.1	Confident	10 Å²	10	22.4 Å²	22.4	7%	0.068	10%	0.103	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.1	-12.1	174.4	-70.1	0	0	0	0	114.2	Y446 K724 V848 N849 M850 K878	Y446-C852 WeakPolarHBondContact OH-CB 3.47Å; Y446-C852 PolarHBondContact OH-SG 3.37Å; K724-C852 PolarHBondContact NZ-O 3.42Å; V848-C852 WeakPolarHBondContact O-CB 3.29Å; V848-C852 PolarHBondContact O-N 2.98Å; V848-C852 PolarHBondContact O-SG 3.27Å; N849-C852 PolarHBondContact O-N 2.85Å; M850-C852 PolarHBondContact O-N 2.93Å; C852-K878 WeakPolarHBondContact SG-CE 3.46Å
853	E	86.6	Confident	85.7	Confident	62 Å²	62	22.3 Å²	22.3	29%	0.29	11%	0.107	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-30.8	169.8	-72.1	175	-159.5	0	0	111.2	P786 F787 F788 N849 M850 A851	P786-E853 WeakPolarHBondContact CA-OE1 3.47Å; F787-E853 WeakPolarHBondContact CB-OE2 3.48Å; F787-E853 PolarHBondContact N-OE1 3.12Å; F787-E853 PolarHBondContact N-OE2 3.08Å; F788-E853 HydrophobicContact CD2-CB 4.1Å; F788-E853 HydrophobicContact CE2-CB 4.45Å; F788-E853 PolarHBondContact N-OE2 3.3Å; N849-E853 PolarHBondContact O-N 3.06Å; M850-E853 WeakPolarHBondContact O-CB 3.39Å; M850-E853 PolarHBondContact O-N 3.22Å; A851-E853 VanDerWaalsContact C-N 3.33Å
854	C	87.9	Confident	85.3	Confident	0 Å²	0	22.9 Å²	22.9	0%	0	12%	0.115	C	C	.	.	S	Bend	trans	-63.7	150.7	175	-57.5	0	0	0	0	112.4	K724 N794 L796 M850 A851 V857	K724-C854 PolarHBondContact NZ-O 3.01Å; N794-C854 CarbonylContact O-C 3.58Å; N794-C854 WeakPolarHBondContact O-CA 3.45Å; N794-C854 WeakPolarHBondContact O-CB 3.5Å; L796-C854 HydrophobicContact CB-CB 4.35Å; M850-C854 PolarHBondContact O-N 3.27Å; A851-C854 PolarHBondContact O-N 2.71Å; C854-V857 HydrophobicContact CB-CG2 4.19Å
855	E	86	Confident	84.8	Confident	73 Å²	73	27.8 Å²	27.8	34%	0.341	14%	0.136	S	C	.	.	S	Bend	trans	-77.9	-40.5	174	-67.5	-168.4	146.4	0	0	111.1	M750 N794	M750-E855 HydrophobicContact CE-CB 4.31Å; M750-E855 WeakPolarHBondContact CE-OE2 3.42Å; N794-E855 PolarHBondContact O-N 2.97Å
856	A	88.8	Confident	84.6	Confident	1 Å²	1	26.5 Å²	26.5	1%	0.008	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	143.3	178.2	0	0	0	0	0	111.3	L745 L746 A795 L796	L745-A856 HydrophobicContact CD1-CB 3.74Å; L745-A856 HydrophobicContact CD2-CB 4.41Å; L745-A856 HydrophobicContact CG-CB 3.73Å; L746-A856 HydrophobicContact CD2-CB 4.13Å; A795-A856 WeakPolarHBondContact CA-O 3.39Å; A795-A856 HydrophobicContact CB-CB 4.41Å; L796-A856 PolarHBondContact N-O 3.34Å
857	V	93.8	Very high	84.7	Confident	0 Å²	0	26.7 Å²	26.7	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	128.8	174.1	-176.5	0	0	0	0	108.9	W726 V727 L796 A851 C854	W726-V857 CarbonylContact C-O 3.59Å; W726-V857 VanDerWaalsContact CA-O 3.25Å; W726-V857 WeakPolarHBondContact CA-O 3.38Å; W726-V857 HydrophobicContact CB-CB 4.38Å; W726-V857 HydrophobicContact CD2-CB 3.66Å; W726-V857 HydrophobicContact CD2-CG1 4.08Å; W726-V857 HydrophobicContact CD2-CG2 3.88Å; W726-V857 VanDerWaalsContact CE2-CG2 3.5Å; W726-V857 HydrophobicContact CE3-CB 4.11Å; W726-V857 HydrophobicContact CE3-CG1 3.98Å; W726-V857 HydrophobicContact CE3-CG2 4.47Å; W726-V857 HydrophobicContact CG-CB 3.76Å; W726-V857 HydrophobicContact CG-CG2 4.22Å; W726-V857 HydrophobicContact CH2-CG2 4.49Å; W726-V857 HydrophobicContact CZ2-CG2 3.85Å; W726-V857 HydrophobicContact CZ3-CG1 4.35Å; V727-V857 PolarHBondContact N-O 3.42Å; L796-V857 HydrophobicContact CB-CG1 4.3Å; L796-V857 HydrophobicContact CB-CG2 4.22Å; L796-V857 HydrophobicContact CD2-CG1 4.11Å; L796-V857 HydrophobicContact CD2-CG2 4.47Å; L796-V857 HydrophobicContact CG-CG1 4.26Å; L796-V857 CarbonylContact O-C 3.47Å; L796-V857 WeakPolarHBondContact O-CA 3.32Å; A851-V857 HydrophobicContact CB-CG2 4.36Å; A851-V857 WeakPolarHBondContact O-CG2 3.36Å; C854-V857 HydrophobicContact CB-CG2 4.19Å
858	I	93.9	Very high	84.6	Confident	1 Å²	1	27.1 Å²	27.1	1%	0.005	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	121.9	176.4	-52.3	-176.7	0	0	0	108.3	V727 A736 L745 L746 L796 I797 I798	V727-I858 HydrophobicContact CB-CG1 4.44Å; V727-I858 HydrophobicContact CB-CG2 4.38Å; V727-I858 CarbonylContact O-C 3.54Å; V727-I858 WeakPolarHBondContact O-CA 3.46Å; A736-I858 HydrophobicContact CB-CG2 3.75Å; L745-I858 HydrophobicContact CD2-CD1 4.36Å; L745-I858 HydrophobicContact CD2-CG1 4.26Å; L746-I858 HydrophobicContact CD1-CD1 3.8Å; L746-I858 HydrophobicContact CD2-CD1 4.33Å; L746-I858 HydrophobicContact CG-CD1 4.09Å; L796-I858 PolarHBondContact O-N 3.38Å; I797-I858 WeakPolarHBondContact CA-O 3.45Å; I797-I858 HydrophobicContact CG1-CB 4.29Å; I798-I858 PolarHBondContact N-O 3.11Å
859	C	91.4	Very high	84.6	Confident	1 Å²	1	29.6 Å²	29.6	1%	0.007	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	122.8	172	-56	0	0	0	0	108.5	V727 L728 T729 I798 V862	V727-C859 PolarHBondContact O-N 3.43Å; L728-C859 HydrophobicContact CD2-CB 3.55Å; L728-C859 WeakPolarHBondContact CD2-SG 3.31Å; T729-C859 PolarHBondContact N-O 2.94Å; I798-C859 VanDerWaalsContact CD1-SG 3.58Å; I798-C859 HydrophobicContact CG1-CB 4.19Å; I798-C859 VanDerWaalsContact CG1-SG 3.57Å; I798-C859 CarbonylContact O-C 3.58Å; I798-C859 WeakPolarHBondContact O-CA 3.35Å; C859-V862 HydrophobicContact CB-CG1 4.09Å; C859-V862 HydrophobicContact CB-CG2 3.89Å; C859-V862 WeakPolarHBondContact O-CG2 3.24Å
860	C	85.9	Confident	84.7	Confident	0 Å²	0	28.6 Å²	28.6	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	154.7	-175.6	-45.2	0	0	0	0	110	T729 K733 A736 I798 T799 G800 V862	T729-C860 CarbonylContact O-C 3.5Å; T729-C860 WeakPolarHBondContact O-CA 3.37Å; K733-C860 HydrophobicContact CB-CB 4.41Å; A736-C860 HydrophobicContact CB-CB 4.48Å; A736-C860 VanDerWaalsContact CB-SG 3.52Å; I798-C860 PolarHBondContact O-N 3.05Å; T799-C860 CarbonylContact C-O 3.48Å; T799-C860 WeakPolarHBondContact CA-O 3.22Å; G800-C860 PolarHBondContact N-O 2.89Å; C860-V862 PolarHBondContact O-N 3.31Å
861	R	78.4	Confident	85	Confident	132 Å²	132	28.6 Å²	28.6	50%	0.498	14%	0.14	S	C	.	.	S	Bend	trans	49.5	37.2	-175.9	-57.4	-166.8	-177.6	-168.6	5.2	113.5	T729 G730 D731 G800	T729-R861 PolarHBondContact O-N 3.47Å; G730-R861 WeakPolarHBondContact O-CA 3.36Å; D731-R861 PolarHBondContact O-N 3.28Å; G800-R861 WeakPolarHBondContact CA-O 3.46Å
862	V	76.6	Confident	85	Confident	5 Å²	5	31.3 Å²	31.3	3%	0.03	16%	0.159	C	C	.	.			trans	-90.7	130.3	178.2	-93.6	0	0	0	0	111.4	L728 T729 L803 C859 C860 Q866 K867	L728-V862 HydrophobicContact CB-CG2 4.35Å; T729-V862 WeakPolarHBondContact O-CG2 3.43Å; T729-V862 PolarHBondContact O-N 2.89Å; T729-V862 VanDerWaalsContact O-N 3.11Å; L803-V862 HydrophobicContact CD2-CG1 3.59Å; C859-V862 HydrophobicContact CB-CG1 4.09Å; C859-V862 HydrophobicContact CB-CG2 3.89Å; C859-V862 WeakPolarHBondContact O-CG2 3.24Å; C860-V862 PolarHBondContact O-N 3.31Å; V862-Q866 VanDerWaalsContact CA-OE1 3.32Å; V862-Q866 HydrophobicContact CB-CB 4.19Å; V862-Q866 HydrophobicContact CG1-CB 3.94Å; V862-K867 HydrophobicContact CB-CG 4.33Å; V862-K867 HydrophobicContact CG2-CG 4.25Å
863	T	72.6	Confident	85.2	Confident	69 Å²	69	31.5 Å²	31.5	42%	0.423	16%	0.159	S	C	.	.			trans	-72.4	158.7	174.9	70.4	0	0	0	0	111.4	K865 Q866 K867	T863-K865 PolarHBondContact O-N 3.14Å; T863-K865 VanDerWaalsContact O-N 3.13Å; T863-Q866 WeakPolarHBondContact O-CA 3.46Å; T863-Q866 WeakPolarHBondContact O-CB 3.26Å; T863-Q866 PolarHBondContact O-N 3.26Å; T863-Q866 VanDerWaalsContact OG1-CG 3.3Å; T863-Q866 WeakPolarHBondContact OG1-CG 3.32Å; T863-Q866 PolarHBondContact OG1-N 3.46Å; T863-K867 PolarHBondContact O-N 3.48Å
864	P	72.2	Confident	85.4	Confident	45 Å²	45	28.6 Å²	28.6	29%	0.292	15%	0.145	S	C	.	.	H	α-helix	trans	-50.7	-39	175.7	-31.4	37.8	0	0	0	113.9	K867 A868 N890	P864-K867 PolarHBondContact O-N 2.89Å; P864-A868 PolarHBondContact O-N 3.28Å; P864-N890 WeakPolarHBondContact CB-O 3.46Å; P864-N890 HydrophobicContact CG-CB 4.05Å
865	K	74.7	Confident	85.4	Confident	120 Å²	120	32.3 Å²	32.3	52%	0.522	16%	0.162	S	C	.	.	H	α-helix	trans	-65.6	-44	175.9	-170.2	-174.9	-172.5	-172.3	0	111.4	E809 T863 A868 N869	E809-K865 IonicContact OE1-NZ 2.75Å; E809-K865 PolarHBondContact OE1-NZ 3.42Å; T863-K865 PolarHBondContact O-N 3.14Å; T863-K865 VanDerWaalsContact O-N 3.13Å; K865-A868 PolarHBondContact O-N 3.43Å; K865-N869 VanDerWaalsContact O-CG 3.28Å; K865-N869 PolarHBondContact O-N 2.89Å; K865-N869 PolarHBondContact O-ND2 3.19Å
866	Q	80.2	Confident	85.4	Confident	10 Å²	10	33.2 Å²	33.2	5%	0.047	17%	0.165	C	C	.	.	H	α-helix	trans	-64.6	-40.1	177.6	-71.2	173.6	-28.5	0	0	111.9	G800 L803 N804 L807 V862 T863 A868 N869 V870	G800-Q866 PolarHBondContact O-NE2 2.82Å; L803-Q866 HydrophobicContact CD2-CB 4.23Å; N804-Q866 VanDerWaalsContact CG-NE2 3.3Å; N804-Q866 PolarHBondContact ND2-NE2 3.35Å; N804-Q866 PolarHBondContact OD1-NE2 2.91Å; L807-Q866 HydrophobicContact CD1-CB 4.21Å; L807-Q866 HydrophobicContact CD1-CG 3.95Å; V862-Q866 VanDerWaalsContact CA-OE1 3.32Å; V862-Q866 HydrophobicContact CB-CB 4.19Å; V862-Q866 HydrophobicContact CG1-CB 3.94Å; T863-Q866 WeakPolarHBondContact O-CA 3.46Å; T863-Q866 WeakPolarHBondContact O-CB 3.26Å; T863-Q866 PolarHBondContact O-N 3.26Å; T863-Q866 VanDerWaalsContact OG1-CG 3.3Å; T863-Q866 WeakPolarHBondContact OG1-CG 3.32Å; T863-Q866 PolarHBondContact OG1-N 3.46Å; Q866-A868 VanDerWaalsContact C-N 3.33Å; Q866-A868 PolarHBondContact O-N 3.09Å; Q866-N869 WeakPolarHBondContact O-CB 3.41Å; Q866-N869 PolarHBondContact O-N 3.1Å; Q866-N869 VanDerWaalsContact O-N 3.11Å; Q866-V870 WeakPolarHBondContact O-CG2 3.35Å; Q866-V870 PolarHBondContact O-N 3.38Å
867	K	86.3	Confident	85.3	Confident	7 Å²	7	35.3 Å²	35.3	3%	0.03	17%	0.173	C	C	.	.	H	α-helix	trans	-54.2	-50.2	174	-62.6	-169	-170.6	-174.2	0	111.1	D450 L728 V862 T863 P864 N869 V870 V871 D891 M894	D450-K867 IonicContact OD1-NZ 2.7Å; D450-K867 PolarHBondContact OD1-NZ 3.36Å; L728-K867 HydrophobicContact CB-CD 4.28Å; L728-K867 HydrophobicContact CB-CG 4.09Å; L728-K867 HydrophobicContact CD1-CB 4.25Å; L728-K867 WeakPolarHBondContact O-CE 3.34Å; L728-K867 PolarHBondContact O-NZ 3.21Å; V862-K867 HydrophobicContact CB-CG 4.33Å; V862-K867 HydrophobicContact CG2-CG 4.25Å; T863-K867 PolarHBondContact O-N 3.48Å; P864-K867 PolarHBondContact O-N 2.89Å; K867-N869 VanDerWaalsContact C-N 3.34Å; K867-N869 PolarHBondContact O-N 3.43Å; K867-V870 PolarHBondContact O-N 3.23Å; K867-V871 WeakPolarHBondContact O-CG2 3.49Å; K867-V871 PolarHBondContact O-N 3.18Å; K867-D891 IonicContact NZ-OD1 2.61Å; K867-D891 PolarHBondContact NZ-OD1 2.88Å; K867-M894 HydrophobicContact CB-CB 4.14Å; K867-M894 HydrophobicContact CB-CG 4.3Å; K867-M894 HydrophobicContact CB-SD 4.28Å; K867-M894 HydrophobicContact CD-SD 4.42Å
868	A	85.8	Confident	84.9	Confident	10 Å²	10	38.9 Å²	38.9	8%	0.083	19%	0.188	C	C	.	.	H	α-helix	trans	-61.8	-39.2	177	0	0	0	0	0	112.8	P864 K865 Q866 V870 V871 S872 N893	P864-A868 PolarHBondContact O-N 3.28Å; K865-A868 PolarHBondContact O-N 3.43Å; Q866-A868 VanDerWaalsContact C-N 3.33Å; Q866-A868 PolarHBondContact O-N 3.09Å; A868-V870 PolarHBondContact O-N 3.47Å; A868-V871 PolarHBondContact O-N 3.38Å; A868-S872 WeakPolarHBondContact O-CB 3.26Å; A868-S872 PolarHBondContact O-N 2.95Å; A868-N893 HydrophobicContact CB-CB 4.07Å
869	N	87.1	Confident	84.4	Confident	53 Å²	53	46.8 Å²	46.8	28%	0.283	22%	0.222	S	C	.	.	H	α-helix	trans	-64	-39.7	177.7	-73	-20.5	0	0	0	112.6	L807 K865 Q866 K867 S872 L873	L807-N869 HydrophobicContact CD1-CB 3.92Å; L807-N869 HydrophobicContact CD2-CB 3.8Å; L807-N869 HydrophobicContact CG-CB 4.48Å; K865-N869 VanDerWaalsContact O-CG 3.28Å; K865-N869 PolarHBondContact O-N 2.89Å; K865-N869 PolarHBondContact O-ND2 3.19Å; Q866-N869 WeakPolarHBondContact O-CB 3.41Å; Q866-N869 PolarHBondContact O-N 3.1Å; Q866-N869 VanDerWaalsContact O-N 3.11Å; K867-N869 VanDerWaalsContact C-N 3.34Å; K867-N869 PolarHBondContact O-N 3.43Å; N869-S872 WeakPolarHBondContact O-CB 3.34Å; N869-S872 PolarHBondContact O-N 3.27Å; N869-L873 WeakPolarHBondContact O-CG 3.32Å; N869-L873 PolarHBondContact O-N 3.11Å
870	V	90.3	Very high	84.1	Confident	1 Å²	1	46.9 Å²	46.9	1%	0.006	22%	0.223	C	C	.	.	H	α-helix	trans	-61	-46.7	175.6	174.1	0	0	0	0	110.9	F448 W726 L728 L803 Q866 K867 A868 S872 L873 V874	F448-V870 HydrophobicContact CE1-CG1 4.17Å; W726-V870 HydrophobicContact CE3-CG1 3.98Å; W726-V870 HydrophobicContact CZ3-CG1 3.92Å; L728-V870 HydrophobicContact CD1-CB 4.24Å; L728-V870 HydrophobicContact CD1-CG1 4.24Å; L728-V870 HydrophobicContact CD2-CG1 4.1Å; L803-V870 HydrophobicContact CD1-CG2 4.27Å; L803-V870 HydrophobicContact CD2-CG2 3.58Å; Q866-V870 WeakPolarHBondContact O-CG2 3.35Å; Q866-V870 PolarHBondContact O-N 3.38Å; K867-V870 PolarHBondContact O-N 3.23Å; A868-V870 PolarHBondContact O-N 3.47Å; V870-S872 VanDerWaalsContact C-N 3.32Å; V870-S872 PolarHBondContact O-N 3.1Å; V870-L873 PolarHBondContact O-N 3.21Å; V870-V874 WeakPolarHBondContact O-CG2 3.4Å; V870-V874 PolarHBondContact O-N 2.95Å; V870-V874 VanDerWaalsContact O-N 3.12Å
871	V	91.4	Very high	84.4	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-59.9	-44.9	176.4	178.8	0	0	0	0	110.9	F448 L728 K867 A868 L873 V874 K875 M894 T897 A898	F448-V871 HydrophobicContact CB-CG2 4.13Å; F448-V871 HydrophobicContact CD1-CG2 4.15Å; F448-V871 HydrophobicContact CD2-CB 4.44Å; F448-V871 HydrophobicContact CD2-CG1 4.25Å; F448-V871 HydrophobicContact CD2-CG2 3.71Å; F448-V871 HydrophobicContact CE2-CB 4.46Å; F448-V871 HydrophobicContact CE2-CG1 4.22Å; F448-V871 HydrophobicContact CE2-CG2 4.15Å; F448-V871 HydrophobicContact CG-CG2 3.71Å; L728-V871 HydrophobicContact CD1-CG2 4.42Å; K867-V871 WeakPolarHBondContact O-CG2 3.49Å; K867-V871 PolarHBondContact O-N 3.18Å; A868-V871 PolarHBondContact O-N 3.38Å; V871-L873 PolarHBondContact O-N 2.96Å; V871-V874 PolarHBondContact O-N 3.43Å; V871-K875 VanDerWaalsContact O-CB 3.29Å; V871-K875 WeakPolarHBondContact O-CB 3.43Å; V871-K875 PolarHBondContact O-N 3.5Å; V871-M894 HydrophobicContact CG2-CG 3.64Å; V871-T897 HydrophobicContact CB-CG2 4.31Å; V871-T897 HydrophobicContact CG1-CG2 4.19Å; V871-A898 HydrophobicContact CG1-CB 3.93Å
872	S	89.1	Confident	85.2	Confident	57 Å²	57	40.6 Å²	40.6	40%	0.399	20%	0.199	S	C	.	.	H	α-helix	trans	-60.8	-41.7	178	-175.4	0	0	0	0	112.5	A868 N869 V870 K876	A868-S872 WeakPolarHBondContact O-CB 3.26Å; A868-S872 PolarHBondContact O-N 2.95Å; N869-S872 WeakPolarHBondContact O-CB 3.34Å; N869-S872 PolarHBondContact O-N 3.27Å; V870-S872 VanDerWaalsContact C-N 3.32Å; V870-S872 PolarHBondContact O-N 3.1Å; S872-K876 VanDerWaalsContact O-CB 3.23Å; S872-K876 WeakPolarHBondContact O-CB 3.3Å; S872-K876 PolarHBondContact O-N 3.35Å
873	L	89.3	Confident	86.1	Confident	14 Å²	14	40.3 Å²	40.3	7%	0.073	20%	0.198	C	C	.	.	H	α-helix	trans	-61.9	-50.2	176.6	-76.4	176.3	0	0	0	112.3	L807 Q844 V848 N869 V870 V871 K875 K876 Y877	L807-L873 HydrophobicContact CD2-CD1 3.36Å; L807-L873 HydrophobicContact CD2-CG 4.19Å; Q844-L873 HydrophobicContact CB-CD2 4.22Å; Q844-L873 HydrophobicContact CG-CD2 4.25Å; V848-L873 HydrophobicContact CG2-CB 3.99Å; N869-L873 WeakPolarHBondContact O-CG 3.32Å; N869-L873 PolarHBondContact O-N 3.11Å; V870-L873 PolarHBondContact O-N 3.21Å; V871-L873 PolarHBondContact O-N 2.96Å; L873-K875 VanDerWaalsContact C-N 3.34Å; L873-K875 PolarHBondContact O-N 3.11Å; L873-K876 PolarHBondContact O-N 2.97Å; L873-Y877 HydrophobicContact CD2-CD2 4.22Å; L873-Y877 HydrophobicContact CD2-CE2 3.59Å; L873-Y877 VanDerWaalsContact O-CD2 3.27Å; L873-Y877 WeakPolarHBondContact O-CD2 3.3Å; L873-Y877 PolarHBondContact O-N 3.12Å
874	V	90.7	Very high	87.3	Confident	1 Å²	1	37 Å²	37	1%	0.006	18%	0.178	C	C	.	.	H	α-helix	trans	-63	-44.6	-179	175.5	0	0	0	0	109.9	Y446 F448 W726 V870 V871 K876 K878 T882	Y446-V874 HydrophobicContact CD1-CG1 4.43Å; Y446-V874 HydrophobicContact CD2-CG1 4.3Å; Y446-V874 HydrophobicContact CG-CG1 4.22Å; F448-V874 HydrophobicContact CE1-CG2 4.15Å; F448-V874 HydrophobicContact CZ-CB 3.81Å; F448-V874 HydrophobicContact CZ-CG1 3.93Å; F448-V874 HydrophobicContact CZ-CG2 3.81Å; W726-V874 HydrophobicContact CE3-CG2 4.44Å; W726-V874 HydrophobicContact CH2-CG2 3.67Å; W726-V874 HydrophobicContact CZ2-CG2 4.44Å; W726-V874 HydrophobicContact CZ3-CG2 3.69Å; V870-V874 WeakPolarHBondContact O-CG2 3.4Å; V870-V874 PolarHBondContact O-N 2.95Å; V870-V874 VanDerWaalsContact O-N 3.12Å; V871-V874 PolarHBondContact O-N 3.43Å; V874-K876 PolarHBondContact O-N 3.19Å; V874-K878 WeakPolarHBondContact O-CB 3.21Å; V874-K878 PolarHBondContact O-N 3.38Å; V874-T882 HydrophobicContact CG1-CG2 4.31Å
875	K	88.7	Confident	88.4	Confident	79 Å²	79	34.9 Å²	34.9	34%	0.343	16%	0.164	S	C	.	.	H	α-helix	trans	-60.1	-44.8	176.1	-179	168.5	168.8	166.7	0	112.2	V871 L873 K879 T882 T897 D899	V871-K875 VanDerWaalsContact O-CB 3.29Å; V871-K875 WeakPolarHBondContact O-CB 3.43Å; V871-K875 PolarHBondContact O-N 3.5Å; L873-K875 VanDerWaalsContact C-N 3.34Å; L873-K875 PolarHBondContact O-N 3.11Å; K875-K879 WeakPolarHBondContact O-CA 3.31Å; K875-K879 PolarHBondContact O-N 3.29Å; K875-T882 HydrophobicContact CB-CG2 4.38Å; K875-T897 PolarHBondContact NZ-O 3.48Å; K875-D899 WeakPolarHBondContact CE-OD1 3.47Å; K875-D899 IonicContact NZ-OD1 2.79Å; K875-D899 PolarHBondContact NZ-OD1 2.94Å
876	K	86.2	Confident	89.1	Confident	92 Å²	92	29.2 Å²	29.2	40%	0.4	14%	0.139	S	C	.	.	H	α-helix	trans	-64.9	-47.7	-179.2	-175.1	-173	173.2	-152.1	0	112.4	E841 S872 L873 V874	E841-K876 IonicContact OE1-NZ 2.88Å; E841-K876 PolarHBondContact OE1-NZ 3.13Å; S872-K876 VanDerWaalsContact O-CB 3.23Å; S872-K876 WeakPolarHBondContact O-CB 3.3Å; S872-K876 PolarHBondContact O-N 3.35Å; L873-K876 PolarHBondContact O-N 2.97Å; V874-K876 PolarHBondContact O-N 3.19Å
877	Y	86.5	Confident	89.3	Confident	45 Å²	45	28.7 Å²	28.7	18%	0.176	14%	0.137	C	C	.	.	H	α-helix	trans	-94	-34.4	-169.2	-62.4	-58.8	0	0	0	114.2	E841 Q844 V845 V848 L873	E841-Y877 HydrophobicContact CG-CE1 4.39Å; Q844-Y877 HydrophobicContact CB-CE2 3.74Å; Q844-Y877 PolarHBondContact OE1-OH 3.13Å; V845-Y877 HydrophobicContact CG2-CD1 3.48Å; V845-Y877 VanDerWaalsContact CG2-CD1 3.48Å; V845-Y877 HydrophobicContact CG2-CD2 4.5Å; V845-Y877 HydrophobicContact CG2-CE1 3.5Å; V845-Y877 VanDerWaalsContact CG2-CE1 3.5Å; V845-Y877 HydrophobicContact CG2-CE2 4.49Å; V845-Y877 HydrophobicContact CG2-CG 4.02Å; V848-Y877 HydrophobicContact CG2-CD2 4.09Å; L873-Y877 HydrophobicContact CD2-CD2 4.22Å; L873-Y877 HydrophobicContact CD2-CE2 3.59Å; L873-Y877 VanDerWaalsContact O-CD2 3.27Å; L873-Y877 WeakPolarHBondContact O-CD2 3.3Å; L873-Y877 PolarHBondContact O-N 3.12Å
878	K	85.4	Confident	88.7	Confident	75 Å²	75	28.4 Å²	28.4	33%	0.326	14%	0.136	S	C	.	.	H	α-helix	trans	-88.4	-19.8	176.2	-69.4	-57.2	-164.3	-177.1	0	114.1	V848 N849 C852 V874 A880	V848-K878 HydrophobicContact CG1-CD 4.4Å; V848-K878 HydrophobicContact CG1-CG 3.77Å; N849-K878 WeakPolarHBondContact OD1-CE 3.39Å; N849-K878 PolarHBondContact OD1-NZ 2.9Å; C852-K878 WeakPolarHBondContact SG-CE 3.46Å; V874-K878 WeakPolarHBondContact O-CB 3.21Å; V874-K878 PolarHBondContact O-N 3.38Å; K878-A880 HydrophobicContact CB-CB 4.17Å; K878-A880 PolarHBondContact O-N 3.32Å; K878-A880 VanDerWaalsContact O-N 3.1Å
879	K	82.9	Confident	87.7	Confident	166 Å²	166	29 Å²	29	72%	0.722	14%	0.14	S	C	*	.			trans	52.8	25.9	-172.6	-57	-176.7	177.7	-175.5	0	113.3	K328 K875	K328-K879 PolarHBondContact NZ-O 2.69Å; K875-K879 WeakPolarHBondContact O-CA 3.31Å; K875-K879 PolarHBondContact O-N 3.29Å
880	A	86.1	Confident	87	Confident	3 Å²	3	29.6 Å²	29.6	3%	0.025	14%	0.144	C	C	.	.			trans	-80.3	154.3	176.2	0	0	0	0	0	110.3	Q445 Y446 K878 T882	Q445-A880 HydrophobicContact CB-CB 4.21Å; Y446-A880 HydrophobicContact CD2-CB 3.6Å; Y446-A880 HydrophobicContact CE2-CB 3.67Å; K878-A880 HydrophobicContact CB-CB 4.17Å; K878-A880 PolarHBondContact O-N 3.32Å; K878-A880 VanDerWaalsContact O-N 3.1Å; A880-T882 PolarHBondContact O-N 3.35Å
881	V	91.9	Very high	86.5	Confident	0 Å²	0	29.7 Å²	29.7	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	121.9	171.8	176.4	0	0	0	0	108.1	K328 Q440 Q443 I444 Q445 D899	K328-V881 HydrophobicContact CD-CG2 3.7Å; K328-V881 VanDerWaalsContact CE-CG2 3.46Å; K328-V881 HydrophobicContact CG-CG2 4.48Å; Q440-V881 HydrophobicContact CG-CG1 3.68Å; Q440-V881 HydrophobicContact CG-CG2 4.37Å; Q443-V881 HydrophobicContact CB-CG2 4.09Å; Q443-V881 WeakPolarHBondContact O-CB 3.18Å; I444-V881 HydrophobicContact CG1-CG1 3.98Å; Q445-V881 PolarHBondContact N-O 3.31Å; V881-D899 WeakPolarHBondContact CA-OD2 3.34Å; V881-D899 HydrophobicContact CG1-CB 4.27Å
882	T	95.1	Very high	85.9	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	135.9	-177	59.9	0	0	0	0	112	F448 V874 K875 A880 D899 I900	F448-T882 HydrophobicContact CE2-CG2 3.71Å; F448-T882 HydrophobicContact CZ-CG2 4.42Å; V874-T882 HydrophobicContact CG1-CG2 4.31Å; K875-T882 HydrophobicContact CB-CG2 4.38Å; A880-T882 PolarHBondContact O-N 3.35Å; T882-D899 PolarHBondContact N-OD2 3.09Å; T882-D899 VanDerWaalsContact N-OD2 3.12Å; T882-D899 WeakPolarHBondContact O-CB 3.39Å; T882-D899 PolarHBondContact O-N 3Å; T882-D899 VanDerWaalsContact O-N 3.13Å; T882-D899 PolarHBondContact OG1-N 3.35Å; T882-I900 PolarHBondContact O-N 3.05Å; T882-I900 VanDerWaalsContact O-N 3.07Å
883	L	96.8	Very high	85.6	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	138.3	169.1	-178	149.3	0	0	0	109.3	I444 Y446 I447 F448 I885 I900 V902 L926 L930	I444-L883 HydrophobicContact CD1-CB 3.97Å; I444-L883 HydrophobicContact CD1-CD1 3.43Å; I444-L883 VanDerWaalsContact CD1-CD1 3.43Å; I444-L883 HydrophobicContact CD1-CG 4.34Å; I444-L883 HydrophobicContact CG1-CB 4.19Å; I444-L883 HydrophobicContact CG1-CD1 4.5Å; I444-L883 HydrophobicContact CG2-CB 3.81Å; Y446-L883 PolarHBondContact O-N 3.14Å; I447-L883 CarbonylContact C-O 2.74Å; I447-L883 VanDerWaalsContact CA-O 3.32Å; I447-L883 WeakPolarHBondContact CA-O 3.41Å; I447-L883 HydrophobicContact CG1-CB 4.28Å; I447-L883 HydrophobicContact CG1-CD2 4.18Å; I447-L883 HydrophobicContact CG2-CD2 3.99Å; F448-L883 WeakPolarHBondContact CD2-O 3.16Å; F448-L883 PolarHBondContact N-O 2.8Å; L883-I885 HydrophobicContact CD2-CB 4.15Å; L883-I885 HydrophobicContact CD2-CG2 4.5Å; L883-I900 CarbonylContact C-O 3.56Å; L883-I900 VanDerWaalsContact CA-O 3.3Å; L883-I900 WeakPolarHBondContact CA-O 3.44Å; L883-I900 HydrophobicContact CD1-CB 4.41Å; L883-I900 HydrophobicContact CD1-CG2 4.05Å; L883-I900 HydrophobicContact CG-CB 4.41Å; L883-I900 HydrophobicContact CG-CG2 4.37Å; L883-V902 HydrophobicContact CD1-CG2 3.75Å; L883-V902 HydrophobicContact CD2-CG2 4.07Å; L883-V902 HydrophobicContact CG-CG2 4.07Å; L883-L926 HydrophobicContact CD1-CD1 4.24Å; L883-L926 HydrophobicContact CD2-CD1 4.37Å; L883-L930 HydrophobicContact CD1-CD1 4.44Å; L883-L930 HydrophobicContact CD1-CD2 4.01Å
884	S	95.9	Very high	85.5	Confident	0 Å²	0	30.6 Å²	30.6	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	135.7	169.9	-72.8	0	0	0	0	110.6	F448 M894 A898 I900 G901 V902	F448-S884 CarbonylContact O-C 3.56Å; F448-S884 VanDerWaalsContact O-CA 3.28Å; F448-S884 WeakPolarHBondContact O-CA 3.28Å; S884-M894 WeakPolarHBondContact OG-CG 3.44Å; S884-A898 WeakPolarHBondContact OG-CB 3.46Å; S884-I900 PolarHBondContact N-O 3.48Å; S884-G901 CarbonylContact O-C 3.51Å; S884-V902 PolarHBondContact O-N 3.37Å
885	I	95.5	Very high	85.4	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	134.7	178.6	-171.5	165.9	0	0	0	110.4	I447 F448 D450 T454 L883 M894 V902 I904 F920 F923 L926	I447-I885 HydrophobicContact CG2-CG2 4.11Å; F448-I885 PolarHBondContact O-N 3.32Å; D450-I885 PolarHBondContact N-O 3.39Å; T454-I885 HydrophobicContact CG2-CG1 4.17Å; T454-I885 HydrophobicContact CG2-CG2 4.15Å; L883-I885 HydrophobicContact CD2-CB 4.15Å; L883-I885 HydrophobicContact CD2-CG2 4.5Å; I885-M894 WeakPolarHBondContact O-CE 3.47Å; I885-V902 WeakPolarHBondContact CA-O 3.34Å; I885-V902 HydrophobicContact CB-CB 4.11Å; I885-V902 HydrophobicContact CD1-CB 4.19Å; I885-V902 HydrophobicContact CD1-CG1 3.72Å; I885-V902 HydrophobicContact CG1-CB 3.95Å; I885-V902 HydrophobicContact CG1-CG1 3.87Å; I885-I904 HydrophobicContact CD1-CD1 3.78Å; I885-I904 HydrophobicContact CD1-CG1 3.95Å; I885-I904 HydrophobicContact CG1-CD1 3.98Å; I885-I904 HydrophobicContact CG1-CG1 4Å; I885-F920 HydrophobicContact CD1-CE2 4.23Å; I885-F920 HydrophobicContact CD1-CZ 4.01Å; I885-F923 HydrophobicContact CD1-CD2 3.92Å; I885-F923 HydrophobicContact CD1-CE2 4.23Å; I885-F923 HydrophobicContact CG2-CE2 4.09Å; I885-L926 HydrophobicContact CD1-CD1 4.4Å; I885-L926 HydrophobicContact CD1-CD2 3.99Å
886	G	90.7	Very high	85.2	Confident	0 Å²	0	30.1 Å²	30.1	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-164.6	166.9	-179.2	0	0	0	0	0	111.1	T454 D891 V902 G903 I904	T454-G886 VanDerWaalsContact OG1-CA 3.31Å; T454-G886 WeakPolarHBondContact OG1-CA 3.49Å; G886-D891 WeakPolarHBondContact CA-OD2 3.22Å; G886-V902 PolarHBondContact N-O 3.09Å; G886-G903 CarbonylContact O-C 3.52Å; G886-G903 WeakPolarHBondContact O-CA 3.46Å; G886-I904 PolarHBondContact O-N 2.69Å
887	D	84.1	Confident	85.3	Confident	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.137	C	C	.	.	S	Bend	trans	-119.7	-32.2	179.2	71.5	-42.3	0	0	0	113	T452 G453 T454 I904 E908 A912	T452-D887 VanDerWaalsContact O-OD1 3.07Å; G453-D887 VanDerWaalsContact C-CG 3.45Å; G453-D887 WeakPolarHBondContact CA-OD2 3.21Å; T454-D887 PolarHBondContact OG1-N 3.47Å; D887-I904 HydrophobicContact CB-CB 3.92Å; D887-I904 HydrophobicContact CB-CG2 4.19Å; D887-I904 WeakPolarHBondContact CB-O 3.45Å; D887-E908 WeakPolarHBondContact OD2-CB 3.35Å; D887-A912 WeakPolarHBondContact O-CB 3.5Å
888	G	72.8	Confident	85.5	Confident	1 Å²	1	25.8 Å²	25.8	1%	0.01	13%	0.129	C	C	.	.	S	Bend	trans	-90.6	171.2	-178.3	0	0	0	0	0	115.7	N890 D891	G888-N890 PolarHBondContact O-N 3.35Å; G888-D891 PolarHBondContact O-N 3.28Å
889	A	65.8	Low	85.9	Confident	21 Å²	21	23.3 Å²	23.3	17%	0.174	12%	0.119	C	C	.	.	G	3₁₀ helix	trans	-68.1	-25.8	178	0	0	0	0	0	112.8	L227 D228 D891 V892 Q911	L227-A889 WeakPolarHBondContact O-CB 3.48Å; D228-A889 VanDerWaalsContact C-CB 3.43Å; D228-A889 VanDerWaalsContact CA-CB 3.49Å; D228-A889 VanDerWaalsContact O-CB 3.26Å; D228-A889 WeakPolarHBondContact O-CB 3.47Å; D228-A889 PolarHBondContact O-N 2.67Å; A889-D891 PolarHBondContact O-N 3.23Å; A889-D891 VanDerWaalsContact O-N 3.08Å; A889-V892 WeakPolarHBondContact O-CB 3.25Å; A889-V892 WeakPolarHBondContact O-CG2 3.3Å; A889-V892 PolarHBondContact O-N 3.21Å; A889-V892 VanDerWaalsContact O-N 3.07Å; A889-Q911 HydrophobicContact CB-CB 4.11Å
890	N	72.3	Confident	86.4	Confident	67 Å²	67	15.4 Å²	15.4	36%	0.358	9%	0.085	S	C	.	.	G	3₁₀ helix	trans	-56.9	-22.8	174.3	-70	-34	0	0	0	112.8	P864 G888	P864-N890 WeakPolarHBondContact CB-O 3.46Å; P864-N890 HydrophobicContact CG-CB 4.05Å; G888-N890 PolarHBondContact O-N 3.35Å
891	D	80.4	Confident	86.8	Confident	2 Å²	2	15.2 Å²	15.2	1%	0.011	8%	0.084	C	C	.	.	G	3₁₀ helix	trans	-98.5	-9.4	-177.8	-58.1	-37.4	0	0	0	113.2	D450 K867 G886 G888 A889 N893 M894 I895	D450-D891 VanDerWaalsContact CB-OD2 3.31Å; D450-D891 WeakPolarHBondContact CB-OD2 3.21Å; K867-D891 IonicContact NZ-OD1 2.61Å; K867-D891 PolarHBondContact NZ-OD1 2.88Å; G886-D891 WeakPolarHBondContact CA-OD2 3.22Å; G888-D891 PolarHBondContact O-N 3.28Å; A889-D891 PolarHBondContact O-N 3.23Å; A889-D891 VanDerWaalsContact O-N 3.08Å; D891-N893 VanDerWaalsContact C-N 3.27Å; D891-N893 PolarHBondContact O-N 3.48Å; D891-M894 HydrophobicContact CB-CE 3.89Å; D891-M894 CarbonylContact O-C 3.58Å; D891-M894 WeakPolarHBondContact O-CA 3.49Å; D891-M894 VanDerWaalsContact O-CB 3.3Å; D891-M894 WeakPolarHBondContact O-CB 3.29Å; D891-M894 PolarHBondContact O-N 3.38Å; D891-I895 HydrophobicContact CB-CD1 4.11Å; D891-I895 HydrophobicContact CB-CG1 4.45Å; D891-I895 WeakPolarHBondContact O-CB 3.31Å; D891-I895 VanDerWaalsContact O-CG1 3.29Å; D891-I895 WeakPolarHBondContact O-CG1 3.47Å; D891-I895 PolarHBondContact O-N 3.14Å
892	V	78.6	Confident	86.9	Confident	16 Å²	16	15.2 Å²	15.2	10%	0.097	8%	0.084	C	C	.	.	H	α-helix	trans	-56.5	-42.7	-176.8	168.4	0	0	0	0	111.5	A889 M894 I895 K896 Q911	A889-V892 WeakPolarHBondContact O-CB 3.25Å; A889-V892 WeakPolarHBondContact O-CG2 3.3Å; A889-V892 PolarHBondContact O-N 3.21Å; A889-V892 VanDerWaalsContact O-N 3.07Å; V892-M894 VanDerWaalsContact C-N 3.34Å; V892-M894 PolarHBondContact O-N 2.91Å; V892-I895 PolarHBondContact O-N 3.38Å; V892-K896 HydrophobicContact CG1-CD 3.85Å; V892-K896 HydrophobicContact CG1-CG 4.39Å; V892-K896 WeakPolarHBondContact O-CB 3.48Å; V892-K896 VanDerWaalsContact O-CG 3.29Å; V892-K896 WeakPolarHBondContact O-CG 3.35Å; V892-K896 PolarHBondContact O-N 2.69Å; V892-Q911 HydrophobicContact CG2-CB 4.34Å
893	N	81.4	Confident	86.8	Confident	74 Å²	74	15.2 Å²	15.2	40%	0.396	8%	0.084	S	C	.	.	H	α-helix	trans	-67.5	-35.9	178	-72.4	-27.3	0	0	0	112.2	A868 D891 T897	A868-N893 HydrophobicContact CB-CB 4.07Å; D891-N893 VanDerWaalsContact C-N 3.27Å; D891-N893 PolarHBondContact O-N 3.48Å; N893-T897 WeakPolarHBondContact O-CB 3.3Å; N893-T897 PolarHBondContact O-N 2.85Å; N893-T897 VanDerWaalsContact O-N 3.15Å; N893-T897 PolarHBondContact O-OG1 2.83Å
894	M	87.4	Confident	86.4	Confident	0 Å²	0	15.2 Å²	15.2	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-65	-50.6	174.5	-174.7	-172.6	55.5	0	0	110.7	F448 L728 K867 V871 S884 I885 D891 V892 K896 T897 A898	F448-M894 HydrophobicContact CB-SD 3.98Å; L728-M894 HydrophobicContact CD1-SD 3.83Å; K867-M894 HydrophobicContact CB-CB 4.14Å; K867-M894 HydrophobicContact CB-CG 4.3Å; K867-M894 HydrophobicContact CB-SD 4.28Å; K867-M894 HydrophobicContact CD-SD 4.42Å; V871-M894 HydrophobicContact CG2-CG 3.64Å; S884-M894 WeakPolarHBondContact OG-CG 3.44Å; I885-M894 WeakPolarHBondContact O-CE 3.47Å; D891-M894 HydrophobicContact CB-CE 3.89Å; D891-M894 CarbonylContact O-C 3.58Å; D891-M894 WeakPolarHBondContact O-CA 3.49Å; D891-M894 VanDerWaalsContact O-CB 3.3Å; D891-M894 WeakPolarHBondContact O-CB 3.29Å; D891-M894 PolarHBondContact O-N 3.38Å; V892-M894 VanDerWaalsContact C-N 3.34Å; V892-M894 PolarHBondContact O-N 2.91Å; M894-K896 PolarHBondContact O-N 2.84Å; M894-T897 PolarHBondContact O-N 2.77Å; M894-T897 VanDerWaalsContact O-N 3.14Å; M894-A898 PolarHBondContact O-N 3.42Å; M894-A898 VanDerWaalsContact O-N 3.11Å
895	I	88.6	Confident	85.6	Confident	0 Å²	0	16.4 Å²	16.4	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-58	-44	177.8	-69.6	171.6	0	0	0	111.8	K325 D891 V892 T897 A912	K325-I895 PolarHBondContact NZ-O 2.67Å; D891-I895 HydrophobicContact CB-CD1 4.11Å; D891-I895 HydrophobicContact CB-CG1 4.45Å; D891-I895 WeakPolarHBondContact O-CB 3.31Å; D891-I895 VanDerWaalsContact O-CG1 3.29Å; D891-I895 WeakPolarHBondContact O-CG1 3.47Å; D891-I895 PolarHBondContact O-N 3.14Å; V892-I895 PolarHBondContact O-N 3.38Å; I895-T897 VanDerWaalsContact C-N 3.33Å; I895-T897 PolarHBondContact O-N 2.95Å; I895-A912 HydrophobicContact CD1-CB 3.83Å
896	K	84.8	Confident	84.3	Confident	70 Å²	70	17.1 Å²	17.1	30%	0.304	10%	0.099	S	C	.	.	H	α-helix	trans	-68.2	-31	177.8	-76.4	176.3	179	172.1	0	112.7	G319 V892 M894	G319-K896 PolarHBondContact O-NZ 3.04Å; V892-K896 HydrophobicContact CG1-CD 3.85Å; V892-K896 HydrophobicContact CG1-CG 4.39Å; V892-K896 WeakPolarHBondContact O-CB 3.48Å; V892-K896 VanDerWaalsContact O-CG 3.29Å; V892-K896 WeakPolarHBondContact O-CG 3.35Å; V892-K896 PolarHBondContact O-N 2.69Å; M894-K896 PolarHBondContact O-N 2.84Å
897	T	88.1	Confident	82.7	Confident	45 Å²	45	22.4 Å²	22.4	28%	0.276	12%	0.124	S	C	.	.	H	α-helix	trans	-79.7	-34.4	-177.1	-59.2	0	0	0	0	112.7	V871 K875 N893 M894 I895	V871-T897 HydrophobicContact CB-CG2 4.31Å; V871-T897 HydrophobicContact CG1-CG2 4.19Å; K875-T897 PolarHBondContact NZ-O 3.48Å; N893-T897 WeakPolarHBondContact O-CB 3.3Å; N893-T897 PolarHBondContact O-N 2.85Å; N893-T897 VanDerWaalsContact O-N 3.15Å; N893-T897 PolarHBondContact O-OG1 2.83Å; M894-T897 PolarHBondContact O-N 2.77Å; M894-T897 VanDerWaalsContact O-N 3.14Å; I895-T897 VanDerWaalsContact C-N 3.33Å; I895-T897 PolarHBondContact O-N 2.95Å
898	A	91.8	Very high	81.3	Confident	1 Å²	1	23.4 Å²	23.4	1%	0.008	13%	0.129	C	C	.	.	S	Bend	trans	-64.5	157.9	176.7	0	0	0	0	0	113.3	K325 V871 S884 M894 I900	K325-A898 WeakPolarHBondContact CE-O 3.34Å; K325-A898 PolarHBondContact NZ-O 2.71Å; V871-A898 HydrophobicContact CG1-CB 3.93Å; S884-A898 WeakPolarHBondContact OG-CB 3.46Å; M894-A898 PolarHBondContact O-N 3.42Å; M894-A898 VanDerWaalsContact O-N 3.11Å; A898-I900 VanDerWaalsContact C-N 3.26Å; A898-I900 WeakPolarHBondContact CB-O 3.26Å; A898-I900 PolarHBondContact O-N 3.37Å
899	D	92.8	Very high	80.7	Confident	23 Å²	23	24 Å²	24	12%	0.123	13%	0.134	C	C	.	.	S	Bend	trans	-64.5	-35	173.3	-64.1	-42	0	0	0	111.7	K325 K875 V881 T882	K325-D899 VanDerWaalsContact CD-O 3.3Å; K325-D899 WeakPolarHBondContact CD-O 3.28Å; K875-D899 WeakPolarHBondContact CE-OD1 3.47Å; K875-D899 IonicContact NZ-OD1 2.79Å; K875-D899 PolarHBondContact NZ-OD1 2.94Å; V881-D899 WeakPolarHBondContact CA-OD2 3.34Å; V881-D899 HydrophobicContact CG1-CB 4.27Å; T882-D899 PolarHBondContact N-OD2 3.09Å; T882-D899 VanDerWaalsContact N-OD2 3.12Å; T882-D899 WeakPolarHBondContact O-CB 3.39Å; T882-D899 PolarHBondContact O-N 3Å; T882-D899 VanDerWaalsContact O-N 3.13Å; T882-D899 PolarHBondContact OG1-N 3.35Å
900	I	94.4	Very high	80.7	Confident	0 Å²	0	27.6 Å²	27.6	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	128.2	175.1	-59.2	179.6	0	0	0	109	Q440 L441 I444 T882 L883 S884 A898 V902 Y918	Q440-I900 HydrophobicContact CB-CD1 3.97Å; Q440-I900 HydrophobicContact CG-CD1 3.98Å; Q440-I900 HydrophobicContact CG-CG1 4.45Å; L441-I900 HydrophobicContact CD2-CD1 3.8Å; L441-I900 HydrophobicContact CD2-CG2 3.96Å; L441-I900 HydrophobicContact CG-CD1 4.11Å; I444-I900 HydrophobicContact CD1-CD1 4.14Å; I444-I900 HydrophobicContact CG1-CD1 4.26Å; T882-I900 PolarHBondContact O-N 3.05Å; T882-I900 VanDerWaalsContact O-N 3.07Å; L883-I900 CarbonylContact C-O 3.56Å; L883-I900 VanDerWaalsContact CA-O 3.3Å; L883-I900 WeakPolarHBondContact CA-O 3.44Å; L883-I900 HydrophobicContact CD1-CB 4.41Å; L883-I900 HydrophobicContact CD1-CG2 4.05Å; L883-I900 HydrophobicContact CG-CB 4.41Å; L883-I900 HydrophobicContact CG-CG2 4.37Å; S884-I900 PolarHBondContact N-O 3.48Å; A898-I900 VanDerWaalsContact C-N 3.26Å; A898-I900 WeakPolarHBondContact CB-O 3.26Å; A898-I900 PolarHBondContact O-N 3.37Å; I900-V902 HydrophobicContact CG2-CG2 4.48Å; I900-Y918 HydrophobicContact CG2-CD2 3.86Å; I900-Y918 HydrophobicContact CG2-CE2 3.82Å
901	G	93.8	Very high	80.4	Confident	0 Å²	0	26.8 Å²	26.8	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	130.3	174.3	0	0	0	0	0	111.5	S884 D917 Y918	S884-G901 CarbonylContact O-C 3.51Å; G901-D917 PolarHBondContact N-OD2 3.39Å; G901-D917 WeakPolarHBondContact O-CA 3.32Å; G901-D917 WeakPolarHBondContact O-CB 3.31Å; G901-D917 PolarHBondContact O-N 2.91Å; G901-Y918 PolarHBondContact O-N 3.44Å; G901-Y918 VanDerWaalsContact O-N 3.13Å
902	V	95.1	Very high	80	Confident	0 Å²	0	26.7 Å²	26.7	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	130.3	173.4	-179.5	0	0	0	0	109	L883 S884 I885 G886 I900 Y918 F920 L926 L929	L883-V902 HydrophobicContact CD1-CG2 3.75Å; L883-V902 HydrophobicContact CD2-CG2 4.07Å; L883-V902 HydrophobicContact CG-CG2 4.07Å; S884-V902 PolarHBondContact O-N 3.37Å; I885-V902 WeakPolarHBondContact CA-O 3.34Å; I885-V902 HydrophobicContact CB-CB 4.11Å; I885-V902 HydrophobicContact CD1-CB 4.19Å; I885-V902 HydrophobicContact CD1-CG1 3.72Å; I885-V902 HydrophobicContact CG1-CB 3.95Å; I885-V902 HydrophobicContact CG1-CG1 3.87Å; G886-V902 PolarHBondContact N-O 3.09Å; I900-V902 HydrophobicContact CG2-CG2 4.48Å; V902-Y918 CarbonylContact C-O 3.46Å; V902-Y918 WeakPolarHBondContact CA-O 3.36Å; V902-F920 HydrophobicContact CG1-CD1 4.16Å; V902-F920 HydrophobicContact CG1-CE1 3.34Å; V902-F920 HydrophobicContact CG1-CE2 4.18Å; V902-F920 HydrophobicContact CG1-CZ 3.38Å; V902-L926 HydrophobicContact CG2-CD1 4.45Å; V902-L929 HydrophobicContact CG2-CD2 4.48Å
903	G	91.6	Very high	79.9	Confident	0 Å²	0	26.6 Å²	26.6	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	126.1	177.8	0	0	0	0	0	110.2	G886 S916 Y918 A919 F920	G886-G903 CarbonylContact O-C 3.52Å; G886-G903 WeakPolarHBondContact O-CA 3.46Å; G903-S916 PolarHBondContact N-OG 3.31Å; G903-Y918 PolarHBondContact N-O 3.46Å; G903-A919 WeakPolarHBondContact O-CA 3.11Å; G903-F920 PolarHBondContact O-N 3.28Å
904	I	89.5	Confident	79.5	Confident	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	131.9	171.5	-71.1	178.8	0	0	0	109.2	T454 I885 G886 D887 G906 F920 F923	T454-I904 HydrophobicContact CG2-CD1 3.71Å; I885-I904 HydrophobicContact CD1-CD1 3.78Å; I885-I904 HydrophobicContact CD1-CG1 3.95Å; I885-I904 HydrophobicContact CG1-CD1 3.98Å; I885-I904 HydrophobicContact CG1-CG1 4Å; G886-I904 PolarHBondContact O-N 2.69Å; D887-I904 HydrophobicContact CB-CB 3.92Å; D887-I904 HydrophobicContact CB-CG2 4.19Å; D887-I904 WeakPolarHBondContact CB-O 3.45Å; I904-G906 PolarHBondContact O-N 3.04Å; I904-F920 CarbonylContact C-O 3.6Å; I904-F920 VanDerWaalsContact CA-O 3.28Å; I904-F920 WeakPolarHBondContact CA-O 3.12Å; I904-F920 HydrophobicContact CG1-CE2 4.17Å; I904-F923 HydrophobicContact CD1-CB 4.05Å; I904-F923 HydrophobicContact CD1-CD2 4.28Å
905	S	79.4	Confident	78.8	Confident	25 Å²	25	28.8 Å²	28.8	18%	0.175	16%	0.155	C	C	.	.			trans	-80.1	71.3	174.3	-166.3	0	0	0	0	109.9	K426 F920	K426-S905 PolarHBondContact NZ-O 3.11Å; K426-S905 VanDerWaalsContact NZ-O 3.1Å; S905-F920 PolarHBondContact N-O 2.99Å
906	G	67.5	Low	78.7	Confident	15 Å²	15	29 Å²	29	16%	0.155	16%	0.156	C	C	.	.			trans	-75.4	-166.1	-174.6	0	0	0	0	0	114.1	K426 I904 E908	K426-G906 VanDerWaalsContact NZ-C 3.28Å; K426-G906 PolarHBondContact NZ-O 3.32Å; I904-G906 PolarHBondContact O-N 3.04Å; G906-E908 VanDerWaalsContact C-N 3.27Å
907	Q	57.7	Low	78.9	Confident	111 Å²	111	26.2 Å²	26.2	52%	0.519	15%	0.145	S	C	.	.	S	Bend	trans	-73.3	-30.8	158.6	-67.5	-66.5	-18.4	0	0	108.9	T231 G909	T231-Q907 HydrophobicContact CG2-CB 4.39Å; T231-Q907 WeakPolarHBondContact CG2-O 3.5Å; Q907-G909 PolarHBondContact O-N 3.26Å
908	E	54.4	Low	79.2	Confident	20 Å²	20	24.2 Å²	24.2	9%	0.093	13%	0.132	C	C	.	.	S	Bend	trans	-74.8	44.6	-170.7	-57	-172.7	-177.5	0	0	115.6	G229 T452 N458 D887 G906	G229-E908 VanDerWaalsContact C-C 3.45Å; G229-E908 CarbonylContact C-O 3.53Å; G229-E908 VanDerWaalsContact C-O 3.31Å; G229-E908 VanDerWaalsContact CA-C 3.47Å; G229-E908 WeakPolarHBondContact CA-O 3.28Å; G229-E908 CarbonylContact O-C 3.54Å; G229-E908 WeakPolarHBondContact O-CA 3.37Å; G229-E908 WeakPolarHBondContact O-CB 3.04Å; T452-E908 WeakPolarHBondContact CG2-OE1 3.5Å; N458-E908 PolarHBondContact ND2-OE1 2.98Å; D887-E908 WeakPolarHBondContact OD2-CB 3.35Å; G906-E908 VanDerWaalsContact C-N 3.27Å
909	G	59.6	Low	79.1	Confident	13 Å²	13	24.5 Å²	24.5	13%	0.134	13%	0.134	C	C	.	.			trans	78.2	-171.6	172.2	0	0	0	0	0	115.3	A225 G229 Q907	A225-G909 WeakPolarHBondContact O-CA 3.41Å; G229-G909 PolarHBondContact O-N 3.19Å; Q907-G909 PolarHBondContact O-N 3.26Å
910	M	66.5	Low	79.2	Confident	98 Å²	98	23.5 Å²	23.5	48%	0.483	13%	0.129	S	C	.	.	S	Bend	trans	-109.8	1.4	-174.8	-69.5	-164.8	-67	0	0	114.2	A912 V913 M914	M910-A912 PolarHBondContact O-N 2.94Å; M910-V913 CarbonylContact O-C 3.52Å; M910-V913 WeakPolarHBondContact O-CB 3.42Å; M910-V913 PolarHBondContact O-N 3.47Å; M910-M914 HydrophobicContact CB-CE 4.11Å; M910-M914 HydrophobicContact CB-CG 4.38Å; M910-M914 HydrophobicContact CE-CE 4.1Å; M910-M914 VanDerWaalsContact O-CG 3.27Å; M910-M914 WeakPolarHBondContact O-CG 3.31Å; M910-M914 PolarHBondContact O-N 2.95Å; M910-M914 HydrophobicContact SD-CE 3.77Å
911	Q	65.6	Low	78.9	Confident	50 Å²	50	23.9 Å²	23.9	23%	0.234	13%	0.132	C	C	.	.	H	α-helix	trans	-66	-42.7	-170.2	-73.5	-58.4	-27.5	0	0	113.8	E226 A889 V892 V913 M914 S915	E226-Q911 WeakPolarHBondContact O-CG 3.31Å; E226-Q911 PolarHBondContact O-NE2 3.45Å; A889-Q911 HydrophobicContact CB-CB 4.11Å; V892-Q911 HydrophobicContact CG2-CB 4.34Å; Q911-V913 VanDerWaalsContact C-N 3.33Å; Q911-V913 PolarHBondContact O-N 3.13Å; Q911-M914 PolarHBondContact O-N 3.45Å; Q911-S915 WeakPolarHBondContact O-CB 3.48Å; Q911-S915 PolarHBondContact O-N 3.09Å; Q911-S915 VanDerWaalsContact O-N 3.09Å; Q911-S915 PolarHBondContact O-OG 2.87Å
912	A	71.3	Confident	78.8	Confident	0 Å²	0	24.9 Å²	24.9	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-61.1	-44.5	173.2	0	0	0	0	0	111	D887 I895 M910 M914 S915 S916	D887-A912 WeakPolarHBondContact O-CB 3.5Å; I895-A912 HydrophobicContact CD1-CB 3.83Å; M910-A912 PolarHBondContact O-N 2.94Å; A912-M914 VanDerWaalsContact C-N 3.33Å; A912-M914 PolarHBondContact O-N 2.74Å; A912-S915 CarbonylContact O-C 3.55Å; A912-S915 PolarHBondContact O-N 3.48Å; A912-S916 WeakPolarHBondContact O-CB 3.47Å; A912-S916 PolarHBondContact O-N 3.36Å; A912-S916 PolarHBondContact O-OG 3.36Å
913	V	77.6	Confident	78.8	Confident	14 Å²	14	24.9 Å²	24.9	9%	0.085	14%	0.137	C	C	.	.	H	α-helix	trans	-61.7	-36.9	177.7	167.9	0	0	0	0	112.7	R433 M910 Q911 S916 A919	R433-V913 WeakPolarHBondContact CD-O 3.35Å; R433-V913 PolarHBondContact NE-O 3.37Å; M910-V913 CarbonylContact O-C 3.52Å; M910-V913 WeakPolarHBondContact O-CB 3.42Å; M910-V913 PolarHBondContact O-N 3.47Å; Q911-V913 VanDerWaalsContact C-N 3.33Å; Q911-V913 PolarHBondContact O-N 3.13Å; V913-S916 PolarHBondContact O-OG 2.89Å; V913-A919 HydrophobicContact CB-CB 4.26Å; V913-A919 HydrophobicContact CG1-CB 3.62Å; V913-A919 HydrophobicContact CG2-CB 4.18Å
914	M	72.6	Confident	78.9	Confident	86 Å²	86	25.7 Å²	25.7	42%	0.424	14%	0.142	S	C	.	.	H	α-helix	trans	-74	-30.9	178.6	-68.4	-58.6	162.2	0	0	112.2	R433 M910 Q911 A912	R433-M914 PolarHBondContact NH1-SD 3.44Å; R433-M914 PolarHBondContact NH2-O 3.01Å; R433-M914 PolarHBondContact NH2-SD 2.82Å; M910-M914 HydrophobicContact CB-CE 4.11Å; M910-M914 HydrophobicContact CB-CG 4.38Å; M910-M914 HydrophobicContact CE-CE 4.1Å; M910-M914 VanDerWaalsContact O-CG 3.27Å; M910-M914 WeakPolarHBondContact O-CG 3.31Å; M910-M914 PolarHBondContact O-N 2.95Å; M910-M914 HydrophobicContact SD-CE 3.77Å; Q911-M914 PolarHBondContact O-N 3.45Å; A912-M914 VanDerWaalsContact C-N 3.33Å; A912-M914 PolarHBondContact O-N 2.74Å
915	S	72.1	Confident	79.2	Confident	34 Å²	34	27.1 Å²	27.1	24%	0.238	15%	0.148	C	C	.	.	H	α-helix	trans	-93.3	-6.5	-179.2	-65.1	0	0	0	0	114.5	Q911 A912	Q911-S915 WeakPolarHBondContact O-CB 3.48Å; Q911-S915 PolarHBondContact O-N 3.09Å; Q911-S915 VanDerWaalsContact O-N 3.09Å; Q911-S915 PolarHBondContact O-OG 2.87Å; A912-S915 CarbonylContact O-C 3.55Å; A912-S915 PolarHBondContact O-N 3.48Å
916	S	85.8	Confident	80	Confident	4 Å²	4	26 Å²	26	3%	0.028	14%	0.14	C	C	.	.	S	Bend	trans	-89.7	160.7	-177.7	69.2	0	0	0	0	113.5	R433 G903 A912 V913 Y918	R433-S916 WeakPolarHBondContact CD-O 3.32Å; G903-S916 PolarHBondContact N-OG 3.31Å; A912-S916 WeakPolarHBondContact O-CB 3.47Å; A912-S916 PolarHBondContact O-N 3.36Å; A912-S916 PolarHBondContact O-OG 3.36Å; V913-S916 PolarHBondContact O-OG 2.89Å; S916-Y918 VanDerWaalsContact CB-O 3.31Å; S916-Y918 WeakPolarHBondContact CB-O 3.33Å; S916-Y918 PolarHBondContact OG-O 3.49Å
917	D	89.9	Confident	81.3	Confident	12 Å²	12	26.8 Å²	26.8	6%	0.064	14%	0.139	C	C	.	.	S	Bend	trans	-81.1	-36.6	174.7	-61.8	-61.8	0	0	0	111.5	K325 R433 T434 L437 G901	K325-D917 IonicContact NZ-OD2 3.67Å; K325-D917 PolarHBondContact NZ-OD2 2.85Å; R433-D917 WeakPolarHBondContact CA-O 3.31Å; R433-D917 WeakPolarHBondContact CB-O 3.48Å; R433-D917 PolarHBondContact N-O 3.31Å; T434-D917 WeakPolarHBondContact CB-OD1 3.49Å; T434-D917 PolarHBondContact N-O 3.28Å; T434-D917 PolarHBondContact OG1-OD1 3.46Å; L437-D917 HydrophobicContact CD1-CB 3.96Å; L437-D917 VanDerWaalsContact CD1-CG 3.41Å; L437-D917 WeakPolarHBondContact CD1-OD1 3.33Å; G901-D917 PolarHBondContact N-OD2 3.39Å; G901-D917 WeakPolarHBondContact O-CA 3.32Å; G901-D917 WeakPolarHBondContact O-CB 3.31Å; G901-D917 PolarHBondContact O-N 2.91Å
918	Y	93.6	Very high	83.2	Confident	3 Å²	3	22.4 Å²	22.4	1%	0.012	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	147.8	173.7	-57.2	-90.3	0	0	0	109.8	I415 K431 A432 L437 N438 L441 I900 G901 V902 G903 S916 L929	I415-Y918 HydrophobicContact CD1-CE1 3.9Å; K431-Y918 CarbonylContact O-C 3.12Å; K431-Y918 WeakPolarHBondContact O-CA 2.99Å; A432-Y918 HydrophobicContact CB-CD1 3.75Å; A432-Y918 HydrophobicContact CB-CE1 3.7Å; L437-Y918 VanDerWaalsContact C-OH 3.29Å; L437-Y918 HydrophobicContact CB-CE2 4.49Å; L437-Y918 PolarHBondContact O-OH 3.26Å; N438-Y918 VanDerWaalsContact CA-OH 3.26Å; N438-Y918 WeakPolarHBondContact CA-OH 3.31Å; N438-Y918 PolarHBondContact N-OH 3.43Å; N438-Y918 PolarHBondContact OD1-OH 2.85Å; L441-Y918 HydrophobicContact CD1-CE1 3.88Å; L441-Y918 HydrophobicContact CD1-CE2 4.01Å; L441-Y918 WeakPolarHBondContact CD1-OH 3.46Å; L441-Y918 HydrophobicContact CD2-CD2 4.19Å; L441-Y918 HydrophobicContact CD2-CE2 3.76Å; L441-Y918 HydrophobicContact CG-CE2 4.01Å; I900-Y918 HydrophobicContact CG2-CD2 3.86Å; I900-Y918 HydrophobicContact CG2-CE2 3.82Å; G901-Y918 PolarHBondContact O-N 3.44Å; G901-Y918 VanDerWaalsContact O-N 3.13Å; V902-Y918 CarbonylContact C-O 3.46Å; V902-Y918 WeakPolarHBondContact CA-O 3.36Å; G903-Y918 PolarHBondContact N-O 3.46Å; S916-Y918 VanDerWaalsContact CB-O 3.31Å; S916-Y918 WeakPolarHBondContact CB-O 3.33Å; S916-Y918 PolarHBondContact OG-O 3.49Å; Y918-L929 HydrophobicContact CD1-CD1 4.26Å; Y918-L929 HydrophobicContact CD1-CD2 4.48Å; Y918-L929 HydrophobicContact CG-CD2 4.17Å
919	A	91.4	Very high	85.2	Confident	7 Å²	7	21.5 Å²	21.5	6%	0.058	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	138.5	176.1	0	0	0	0	0	111.9	A430 K431 G903 V913	A430-A919 CarbonylContact C-O 3.54Å; A430-A919 WeakPolarHBondContact CA-O 3.4Å; K431-A919 PolarHBondContact N-O 2.9Å; K431-A919 PolarHBondContact O-N 3.22Å; G903-A919 WeakPolarHBondContact O-CA 3.11Å; V913-A919 HydrophobicContact CB-CB 4.26Å; V913-A919 HydrophobicContact CG1-CB 3.62Å; V913-A919 HydrophobicContact CG2-CB 4.18Å
920	F	93	Very high	87	Confident	2 Å²	2	20.9 Å²	20.9	1%	0.009	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.7	169.2	175.5	51.6	-109.6	0	0	0	110.6	A430 I885 V902 G903 I904 S905 Q922 Y925 L926 L929	A430-F920 HydrophobicContact CB-CB 4.13Å; I885-F920 HydrophobicContact CD1-CE2 4.23Å; I885-F920 HydrophobicContact CD1-CZ 4.01Å; V902-F920 HydrophobicContact CG1-CD1 4.16Å; V902-F920 HydrophobicContact CG1-CE1 3.34Å; V902-F920 HydrophobicContact CG1-CE2 4.18Å; V902-F920 HydrophobicContact CG1-CZ 3.38Å; G903-F920 PolarHBondContact O-N 3.28Å; I904-F920 CarbonylContact C-O 3.6Å; I904-F920 VanDerWaalsContact CA-O 3.28Å; I904-F920 WeakPolarHBondContact CA-O 3.12Å; I904-F920 HydrophobicContact CG1-CE2 4.17Å; S905-F920 PolarHBondContact N-O 2.99Å; F920-Q922 WeakPolarHBondContact CD2-O 3.3Å; F920-Q922 WeakPolarHBondContact CE2-O 3.45Å; F920-Y925 HydrophobicContact CB-CD2 4.12Å; F920-Y925 HydrophobicContact CD2-CD2 4.24Å; F920-Y925 HydrophobicContact CG-CD2 4.39Å; F920-L926 HydrophobicContact CZ-CB 4.04Å; F920-L926 HydrophobicContact CZ-CD1 4.18Å; F920-L929 HydrophobicContact CD1-CD2 4.44Å; F920-L929 HydrophobicContact CE1-CD2 3.76Å
921	A	89.6	Confident	88.4	Confident	7 Å²	7	16.3 Å²	16.3	6%	0.058	9%	0.085	C	C	.	.	S	Bend	trans	-84.8	-27.1	-169.5	0	0	0	0	0	115.8	Y423 T428	Y423-A921 VanDerWaalsContact CB-CB 3.5Å; Y423-A921 HydrophobicContact CD1-CB 3.6Å; Y423-A921 HydrophobicContact CE1-CB 4.47Å; Y423-A921 HydrophobicContact CG-CB 3.74Å; T428-A921 HydrophobicContact CG2-CB 4.28Å
922	Q	91.5	Very high	89.9	Confident	22 Å²	22	14 Å²	14	10%	0.103	7%	0.074	C	C	.	.			trans	-131	142.8	-173.6	-64.8	-166.9	-34.6	0	0	112.8	Y423 F920 S924 Y925	Y423-Q922 HydrophobicContact CD2-CG 4Å; Y423-Q922 HydrophobicContact CE2-CG 4.07Å; Y423-Q922 HydrophobicContact CG-CG 4.48Å; F920-Q922 WeakPolarHBondContact CD2-O 3.3Å; F920-Q922 WeakPolarHBondContact CE2-O 3.45Å; Q922-S924 PolarHBondContact O-N 3.32Å; Q922-S924 PolarHBondContact OE1-OG 2.97Å; Q922-Y925 HydrophobicContact CB-CD2 4.13Å; Q922-Y925 HydrophobicContact CB-CE2 4.02Å; Q922-Y925 HydrophobicContact CG-CE2 4.33Å; Q922-Y925 PolarHBondContact O-N 2.7Å
923	F	94	Very high	91.1	Very high	0 Å²	0	14.5 Å²	14.5	0%	0	8%	0.076	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-33.1	176.3	-175.2	-88.8	0	0	0	113.1	T454 L455 V711 T714 I715 I885 I904 Y925 L926	T454-F923 HydrophobicContact CG2-CD2 3.88Å; T454-F923 HydrophobicContact CG2-CE2 4.31Å; T454-F923 WeakPolarHBondContact O-CB 3.49Å; L455-F923 HydrophobicContact CD2-CD1 4.38Å; L455-F923 HydrophobicContact CD2-CD2 3.96Å; L455-F923 HydrophobicContact CD2-CE1 4.12Å; L455-F923 HydrophobicContact CD2-CE2 3.66Å; L455-F923 HydrophobicContact CD2-CG 4.31Å; L455-F923 HydrophobicContact CD2-CZ 3.75Å; V711-F923 HydrophobicContact CB-CD1 4.43Å; V711-F923 HydrophobicContact CG1-CD1 4.42Å; V711-F923 HydrophobicContact CG2-CB 4Å; V711-F923 HydrophobicContact CG2-CD1 3.85Å; V711-F923 HydrophobicContact CG2-CG 4.16Å; T714-F923 HydrophobicContact CG2-CD1 3.91Å; T714-F923 HydrophobicContact CG2-CE1 3.63Å; I715-F923 HydrophobicContact CG1-CE1 4.01Å; I715-F923 HydrophobicContact CG1-CZ 4.28Å; I885-F923 HydrophobicContact CD1-CD2 3.92Å; I885-F923 HydrophobicContact CD1-CE2 4.23Å; I885-F923 HydrophobicContact CG2-CE2 4.09Å; I904-F923 HydrophobicContact CD1-CB 4.05Å; I904-F923 HydrophobicContact CD1-CD2 4.28Å; F923-Y925 PolarHBondContact O-N 2.95Å; F923-Y925 VanDerWaalsContact O-N 3.11Å; F923-L926 HydrophobicContact CE2-CD2 3.99Å; F923-L926 HydrophobicContact CZ-CD2 4.03Å; F923-L926 WeakPolarHBondContact O-CB 3.34Å; F923-L926 PolarHBondContact O-N 3.18Å
924	S	94.2	Very high	91.9	Very high	17 Å²	17	13.8 Å²	13.8	12%	0.119	7%	0.072	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-20.9	179.8	60.7	0	0	0	0	114.4	D709 T714 Q922 L926 Q927	D709-S924 WeakPolarHBondContact O-CB 3.29Å; T714-S924 WeakPolarHBondContact OG1-CA 3.35Å; Q922-S924 PolarHBondContact O-N 3.32Å; Q922-S924 PolarHBondContact OE1-OG 2.97Å; S924-L926 PolarHBondContact O-N 3.42Å; S924-Q927 WeakPolarHBondContact O-CG 3.41Å
925	Y	95.9	Very high	93	Very high	30 Å²	30	10.1 Å²	10.1	12%	0.118	5%	0.054	C	C	.	.	H	α-helix	trans	-74.7	-14.9	174.9	-57.6	-27.9	0	0	0	112.7	Q420 M421 Y422 F920 Q922 F923 Q927 R928 L929	Q420-Y925 WeakPolarHBondContact O-CE1 3.29Å; M421-Y925 HydrophobicContact CB-CD2 4.37Å; M421-Y925 HydrophobicContact CB-CG 4.21Å; M421-Y925 HydrophobicContact CG-CG 4.32Å; Y422-Y925 PolarHBondContact O-OH 3.06Å; F920-Y925 HydrophobicContact CB-CD2 4.12Å; F920-Y925 HydrophobicContact CD2-CD2 4.24Å; F920-Y925 HydrophobicContact CG-CD2 4.39Å; Q922-Y925 HydrophobicContact CB-CD2 4.13Å; Q922-Y925 HydrophobicContact CB-CE2 4.02Å; Q922-Y925 HydrophobicContact CG-CE2 4.33Å; Q922-Y925 PolarHBondContact O-N 2.7Å; F923-Y925 PolarHBondContact O-N 2.95Å; F923-Y925 VanDerWaalsContact O-N 3.11Å; Y925-Q927 VanDerWaalsContact C-N 3.35Å; Y925-Q927 PolarHBondContact O-N 3.47Å; Y925-R928 PolarHBondContact O-N 3.28Å; Y925-R928 VanDerWaalsContact O-N 3.13Å; Y925-L929 PolarHBondContact O-N 3.21Å
926	L	96.1	Very high	94.1	Very high	0 Å²	0	9.4 Å²	9.4	0%	0	5%	0.046	C	C	.	.	H	α-helix	trans	-60.7	-41.3	178	-172.3	61.2	0	0	0	112	I447 L718 L883 I885 V902 F920 F923 S924 R928 L929 L930	I447-L926 HydrophobicContact CD1-CD2 4.1Å; I447-L926 HydrophobicContact CG2-CD2 4.49Å; L718-L926 HydrophobicContact CD1-CD2 4.12Å; L718-L926 HydrophobicContact CD1-CG 4.37Å; L883-L926 HydrophobicContact CD1-CD1 4.24Å; L883-L926 HydrophobicContact CD2-CD1 4.37Å; I885-L926 HydrophobicContact CD1-CD1 4.4Å; I885-L926 HydrophobicContact CD1-CD2 3.99Å; V902-L926 HydrophobicContact CG2-CD1 4.45Å; F920-L926 HydrophobicContact CZ-CB 4.04Å; F920-L926 HydrophobicContact CZ-CD1 4.18Å; F923-L926 HydrophobicContact CE2-CD2 3.99Å; F923-L926 HydrophobicContact CZ-CD2 4.03Å; F923-L926 WeakPolarHBondContact O-CB 3.34Å; F923-L926 PolarHBondContact O-N 3.18Å; S924-L926 PolarHBondContact O-N 3.42Å; L926-R928 VanDerWaalsContact C-N 3.3Å; L926-R928 PolarHBondContact O-N 3.22Å; L926-L929 PolarHBondContact O-N 2.96Å; L926-L930 HydrophobicContact CD1-CD1 4.11Å; L926-L930 HydrophobicContact CD1-CD2 4.39Å; L926-L930 HydrophobicContact CD1-CG 4.03Å; L926-L930 HydrophobicContact CG-CD1 4.23Å; L926-L930 HydrophobicContact CG-CG 4.36Å; L926-L930 WeakPolarHBondContact O-CG 3.22Å; L926-L930 PolarHBondContact O-N 2.88Å
927	Q	95.7	Very high	94.5	Very high	32 Å²	32	9.3 Å²	9.3	15%	0.15	5%	0.045	C	C	.	.	H	α-helix	trans	-60.7	-39.5	175.6	47.8	169.9	3.4	0	0	112	T714 N717 S924 Y925 L931 L1007	T714-Q927 HydrophobicContact CG2-CB 3.96Å; T714-Q927 HydrophobicContact CG2-CG 3.91Å; N717-Q927 PolarHBondContact ND2-OE1 2.89Å; S924-Q927 WeakPolarHBondContact O-CG 3.41Å; Y925-Q927 VanDerWaalsContact C-N 3.35Å; Y925-Q927 PolarHBondContact O-N 3.47Å; Q927-L931 HydrophobicContact CB-CD1 4.27Å; Q927-L931 WeakPolarHBondContact O-CB 3.2Å; Q927-L931 VanDerWaalsContact O-CG 3.28Å; Q927-L931 WeakPolarHBondContact O-CG 3.39Å; Q927-L931 PolarHBondContact O-N 3.35Å; Q927-L1007 HydrophobicContact CB-CD2 4.5Å
928	R	96.2	Very high	94.7	Very high	20 Å²	20	8.9 Å²	8.9	8%	0.075	4%	0.043	C	C	.	.	I	π-helix	trans	-71.8	-42.6	178.9	-173.9	166.8	176.3	90.3	-1.1	111.2	D418 Q420 M421 Y925 L926 L930 V932 H933 D1003	D418-R928 IonicContact OD1-CZ 3.79Å; D418-R928 IonicContact OD1-NE 3.79Å; D418-R928 PolarHBondContact OD1-NE 3.02Å; D418-R928 IonicContact OD1-NH2 3.67Å; D418-R928 PolarHBondContact OD1-NH2 3.46Å; D418-R928 IonicContact OD2-CZ 3.44Å; D418-R928 IonicContact OD2-NE 2.86Å; D418-R928 PolarHBondContact OD2-NE 2.97Å; D418-R928 IonicContact OD2-NH2 3.07Å; D418-R928 PolarHBondContact OD2-NH2 3.08Å; Q420-R928 VanDerWaalsContact CD-NH1 3.29Å; M421-R928 HydrophobicContact CG-CB 4.32Å; M421-R928 HydrophobicContact CG-CG 4.19Å; M421-R928 HydrophobicContact SD-CB 4.21Å; M421-R928 HydrophobicContact SD-CG 4.18Å; Y925-R928 PolarHBondContact O-N 3.28Å; Y925-R928 VanDerWaalsContact O-N 3.13Å; L926-R928 VanDerWaalsContact C-N 3.3Å; L926-R928 PolarHBondContact O-N 3.22Å; R928-L930 VanDerWaalsContact C-N 3.31Å; R928-L930 PolarHBondContact O-N 3.44Å; R928-V932 HydrophobicContact CG-CB 4.31Å; R928-V932 HydrophobicContact CG-CG2 4.11Å; R928-V932 VanDerWaalsContact O-CB 3.26Å; R928-V932 WeakPolarHBondContact O-CB 3.47Å; R928-V932 PolarHBondContact O-N 3.09Å; R928-V932 VanDerWaalsContact O-N 3.11Å; R928-H933 PolarHBondContact O-N 3.3Å; R928-D1003 IonicContact CZ-OD2 3.44Å; R928-D1003 IonicContact NH1-OD2 2.65Å; R928-D1003 PolarHBondContact NH1-OD2 3.45Å; R928-D1003 IonicContact NH2-OD2 3.76Å; R928-D1003 PolarHBondContact NH2-OD2 2.54Å; R928-D1003 VanDerWaalsContact NH2-OD2 3.07Å
929	L	97.1	Very high	94.7	Very high	1 Å²	1	9.7 Å²	9.7	1%	0.005	5%	0.047	C	C	.	.	I	π-helix	trans	-56.7	-45.3	175.1	-179.2	64.3	0	0	0	111.6	I415 M421 L441 V902 Y918 F920 Y925 L926 H933 G934	I415-L929 HydrophobicContact CD1-CD1 4.19Å; I415-L929 HydrophobicContact CG1-CD1 4.49Å; I415-L929 HydrophobicContact CG2-CD1 4.06Å; M421-L929 HydrophobicContact SD-CB 4.26Å; L441-L929 HydrophobicContact CD1-CD1 3.79Å; L441-L929 HydrophobicContact CD1-CG 4.09Å; L441-L929 HydrophobicContact CD2-CD2 4.26Å; L441-L929 HydrophobicContact CD2-CG 4.33Å; V902-L929 HydrophobicContact CG2-CD2 4.48Å; Y918-L929 HydrophobicContact CD1-CD1 4.26Å; Y918-L929 HydrophobicContact CD1-CD2 4.48Å; Y918-L929 HydrophobicContact CG-CD2 4.17Å; F920-L929 HydrophobicContact CD1-CD2 4.44Å; F920-L929 HydrophobicContact CE1-CD2 3.76Å; Y925-L929 PolarHBondContact O-N 3.21Å; L926-L929 PolarHBondContact O-N 2.96Å; L929-H933 HydrophobicContact CD1-CB 4.49Å; L929-H933 WeakPolarHBondContact O-CB 3.35Å; L929-H933 PolarHBondContact O-N 3.25Å; L929-G934 PolarHBondContact O-N 3.41Å
930	L	96.7	Very high	94.9	Very high	0 Å²	0	9.8 Å²	9.8	0%	0	5%	0.046	C	C	.	.	I	π-helix	trans	-82.3	-55.4	-175.7	-59.9	-167	0	0	0	112.6	L441 I444 I447 L718 I723 L883 L926 R928 G934 R935 Y1013	L441-L930 HydrophobicContact CB-CD2 4.26Å; L441-L930 HydrophobicContact CD2-CD2 3.71Å; I444-L930 HydrophobicContact CD1-CD1 4Å; I444-L930 HydrophobicContact CD1-CD2 3.37Å; I444-L930 HydrophobicContact CD1-CG 4.3Å; I447-L930 HydrophobicContact CD1-CD1 3.85Å; L718-L930 HydrophobicContact CD2-CB 4.48Å; L718-L930 HydrophobicContact CD2-CD1 4.06Å; I723-L930 HydrophobicContact CD1-CD1 4.17Å; L883-L930 HydrophobicContact CD1-CD1 4.44Å; L883-L930 HydrophobicContact CD1-CD2 4.01Å; L926-L930 HydrophobicContact CD1-CD1 4.11Å; L926-L930 HydrophobicContact CD1-CD2 4.39Å; L926-L930 HydrophobicContact CD1-CG 4.03Å; L926-L930 HydrophobicContact CG-CD1 4.23Å; L926-L930 HydrophobicContact CG-CG 4.36Å; L926-L930 WeakPolarHBondContact O-CG 3.22Å; L926-L930 PolarHBondContact O-N 2.88Å; R928-L930 VanDerWaalsContact C-N 3.31Å; R928-L930 PolarHBondContact O-N 3.44Å; L930-G934 WeakPolarHBondContact O-CA 3.29Å; L930-G934 PolarHBondContact O-N 3.04Å; L930-R935 PolarHBondContact O-N 3.12Å; L930-R935 VanDerWaalsContact O-N 3.09Å; L930-Y1013 HydrophobicContact CB-CE2 4.44Å; L930-Y1013 WeakPolarHBondContact O-CE2 3.11Å
931	L	96.3	Very high	94.9	Very high	2 Å²	2	9.7 Å²	9.7	1%	0.01	5%	0.045	C	C	.	.	I	π-helix	trans	-71.3	-36.1	-171.1	-57.4	179.5	0	0	0	111.5	N717 A721 Q927 R935 S1006 L1007 P1010 Y1013	N717-L931 HydrophobicContact CB-CD1 4.49Å; A721-L931 HydrophobicContact CB-CD2 3.64Å; Q927-L931 HydrophobicContact CB-CD1 4.27Å; Q927-L931 WeakPolarHBondContact O-CB 3.2Å; Q927-L931 VanDerWaalsContact O-CG 3.28Å; Q927-L931 WeakPolarHBondContact O-CG 3.39Å; Q927-L931 PolarHBondContact O-N 3.35Å; L931-R935 WeakPolarHBondContact O-CB 3.21Å; L931-R935 PolarHBondContact O-NH1 3.19Å; L931-S1006 PolarHBondContact O-OG 3.33Å; L931-L1007 HydrophobicContact CB-CD2 4.29Å; L931-L1007 HydrophobicContact CD1-CD2 4.23Å; L931-P1010 HydrophobicContact CD1-CB 4.02Å; L931-P1010 HydrophobicContact CD1-CG 4.26Å; L931-P1010 HydrophobicContact CD2-CB 4.4Å; L931-Y1013 HydrophobicContact CD2-CD2 4.01Å; L931-Y1013 HydrophobicContact CD2-CG 4.13Å
932	V	96.3	Very high	95	Very high	0 Å²	0	9.6 Å²	9.6	0%	0	4%	0.044	C	C	.	.	I	π-helix	trans	-92.3	-71.2	179.5	-176	0	0	0	0	110.5	R928 W936 D1003 S1006 L1007	R928-V932 HydrophobicContact CG-CB 4.31Å; R928-V932 HydrophobicContact CG-CG2 4.11Å; R928-V932 VanDerWaalsContact O-CB 3.26Å; R928-V932 WeakPolarHBondContact O-CB 3.47Å; R928-V932 PolarHBondContact O-N 3.09Å; R928-V932 VanDerWaalsContact O-N 3.11Å; V932-W936 HydrophobicContact CG1-CD2 3.92Å; V932-W936 HydrophobicContact CG1-CE3 3.53Å; V932-W936 HydrophobicContact CG1-CH2 3.52Å; V932-W936 HydrophobicContact CG1-CZ2 3.88Å; V932-W936 HydrophobicContact CG1-CZ3 3.32Å; V932-W936 VanDerWaalsContact O-CB 3.31Å; V932-W936 WeakPolarHBondContact O-CB 3.28Å; V932-W936 VanDerWaalsContact O-CG 3.26Å; V932-W936 PolarHBondContact O-N 2.93Å; V932-D1003 HydrophobicContact CG1-CB 3.74Å; V932-D1003 HydrophobicContact CG2-CB 4.13Å; V932-S1006 WeakPolarHBondContact CG2-OG 3.16Å; V932-L1007 HydrophobicContact CG2-CD1 4.43Å; V932-L1007 HydrophobicContact CG2-CD2 4.13Å; V932-L1007 HydrophobicContact CG2-CG 3.96Å
933	H	96.5	Very high	95	Very high	11 Å²	11	11.6 Å²	11.6	5%	0.051	5%	0.053	C	C	.	.	I	π-helix	trans	-68.1	-42.6	-171.7	-72.6	-74	0	0	0	113	I415 D418 M421 R928 L929 S937	I415-H933 HydrophobicContact CD1-CB 4.3Å; I415-H933 HydrophobicContact CG1-CB 3.94Å; D418-H933 IonicContact OD2-CD2 3.11Å; D418-H933 IonicContact OD2-CE1 2.72Å; D418-H933 IonicContact OD2-NE2 3.4Å; D418-H933 PolarHBondContact OD2-NE2 3.11Å; M421-H933 VanDerWaalsContact CE-CD2 3.46Å; M421-H933 WeakPolarHBondContact CE-CD2 3.44Å; M421-H933 WeakPolarHBondContact CE-NE2 3.43Å; R928-H933 PolarHBondContact O-N 3.3Å; L929-H933 HydrophobicContact CD1-CB 4.49Å; L929-H933 WeakPolarHBondContact O-CB 3.35Å; L929-H933 PolarHBondContact O-N 3.25Å; H933-S937 WeakPolarHBondContact O-CB 3.12Å; H933-S937 PolarHBondContact O-N 3.13Å; H933-S937 PolarHBondContact O-OG 2.87Å
934	G	95.2	Very high	95	Very high	0 Å²	0	11.6 Å²	11.6	0%	0	5%	0.053	C	C	.	.	I	π-helix	trans	-64.7	-48.4	179.1	0	0	0	0	0	112.3	L441 G442 L929 L930 S937 Y938	L441-G934 VanDerWaalsContact CB-CA 3.46Å; G442-G934 VanDerWaalsContact CA-C 3.48Å; G442-G934 VanDerWaalsContact CA-O 3.3Å; G442-G934 WeakPolarHBondContact CA-O 3.39Å; G442-G934 PolarHBondContact N-O 3.42Å; L929-G934 PolarHBondContact O-N 3.41Å; L930-G934 WeakPolarHBondContact O-CA 3.29Å; L930-G934 PolarHBondContact O-N 3.04Å; G934-S937 PolarHBondContact O-N 3.24Å; G934-Y938 WeakPolarHBondContact O-CB 3.5Å; G934-Y938 PolarHBondContact O-N 2.78Å
935	R	94.9	Very high	94.8	Very high	9 Å²	9	10.8 Å²	10.8	3%	0.034	5%	0.047	C	C	.	.	H	α-helix	trans	-60.2	-49.8	176	-165	-171.6	76.5	-98.1	-6.1	111.4	L930 L931 S937 Y938 I939 D1000 S1006 L1012 Y1013	L930-R935 PolarHBondContact O-N 3.12Å; L930-R935 VanDerWaalsContact O-N 3.09Å; L931-R935 WeakPolarHBondContact O-CB 3.21Å; L931-R935 PolarHBondContact O-NH1 3.19Å; R935-S937 PolarHBondContact O-N 3.1Å; R935-Y938 PolarHBondContact O-N 2.97Å; R935-I939 HydrophobicContact CG-CD1 3.81Å; R935-I939 HydrophobicContact CG-CG1 4.42Å; R935-I939 WeakPolarHBondContact O-CG1 3.21Å; R935-I939 PolarHBondContact O-N 3.45Å; R935-D1000 IonicContact CZ-OD1 3.74Å; R935-D1000 IonicContact CZ-OD2 2.78Å; R935-D1000 IonicContact NE-OD1 2.74Å; R935-D1000 IonicContact NE-OD2 3.75Å; R935-D1000 PolarHBondContact NE-OD2 2.94Å; R935-D1000 IonicContact NH2-OD1 3.89Å; R935-D1000 PolarHBondContact NH2-OD1 3.03Å; R935-D1000 IonicContact NH2-OD2 3.92Å; R935-S1006 PolarHBondContact NH1-OG 3.46Å; R935-L1012 VanDerWaalsContact CD-O 3.3Å; R935-L1012 WeakPolarHBondContact CD-O 3.38Å; R935-Y1013 HydrophobicContact CB-CD2 4.35Å
936	W	95.7	Very high	94.6	Very high	18 Å²	18	12.5 Å²	12.5	7%	0.068	5%	0.053	C	C	.	.	H	α-helix	trans	-59.8	-45.9	178.6	-75.1	-19.5	0	0	0	112.1	V932 Y938 I939 R940 Q999 D1000 V1001 D1003	V932-W936 HydrophobicContact CG1-CD2 3.92Å; V932-W936 HydrophobicContact CG1-CE3 3.53Å; V932-W936 HydrophobicContact CG1-CH2 3.52Å; V932-W936 HydrophobicContact CG1-CZ2 3.88Å; V932-W936 HydrophobicContact CG1-CZ3 3.32Å; V932-W936 VanDerWaalsContact O-CB 3.31Å; V932-W936 WeakPolarHBondContact O-CB 3.28Å; V932-W936 VanDerWaalsContact O-CG 3.26Å; V932-W936 PolarHBondContact O-N 2.93Å; W936-Y938 VanDerWaalsContact C-N 3.32Å; W936-Y938 PolarHBondContact O-N 3.3Å; W936-I939 PolarHBondContact O-N 3.19Å; W936-R940 WeakPolarHBondContact O-CB 3.27Å; W936-R940 WeakPolarHBondContact O-CD 3.29Å; W936-R940 WeakPolarHBondContact O-CG 3.3Å; W936-R940 PolarHBondContact O-N 3.4Å; W936-Q999 HydrophobicContact CD2-CG 4.42Å; W936-Q999 HydrophobicContact CH2-CG 4.45Å; W936-Q999 HydrophobicContact CZ2-CG 4.05Å; W936-D1000 VanDerWaalsContact CD1-OD1 3.25Å; W936-D1000 PolarHBondContact NE1-OD1 3.09Å; W936-V1001 WeakPolarHBondContact CZ2-O 3.4Å; W936-V1001 PolarHBondContact NE1-O 3.09Å; W936-D1003 HydrophobicContact CH2-CB 3.78Å; W936-D1003 HydrophobicContact CZ2-CB 4.12Å
937	S	95.2	Very high	94.3	Very high	2 Å²	2	12.8 Å²	12.8	1%	0.014	6%	0.055	C	C	.	.	H	α-helix	trans	-60.7	-42.1	179.8	-60.4	0	0	0	0	111.7	N438 H933 G934 R935 M941	N438-S937 WeakPolarHBondContact O-CB 3.15Å; H933-S937 WeakPolarHBondContact O-CB 3.12Å; H933-S937 PolarHBondContact O-N 3.13Å; H933-S937 PolarHBondContact O-OG 2.87Å; G934-S937 PolarHBondContact O-N 3.24Å; R935-S937 PolarHBondContact O-N 3.1Å; S937-M941 VanDerWaalsContact O-CB 3.3Å; S937-M941 WeakPolarHBondContact O-CB 3.4Å; S937-M941 PolarHBondContact O-N 3.08Å
938	Y	94.6	Very high	94.1	Very high	3 Å²	3	11.3 Å²	11.3	1%	0.012	5%	0.048	C	C	.	.	H	α-helix	trans	-62.4	-52.8	174.7	178.1	-105.8	0	0	0	112.3	I329 Q443 G934 R935 W936 R940 M941 C942 G1016 G1019 L1021	I329-Y938 HydrophobicContact CD1-CD2 3.94Å; I329-Y938 HydrophobicContact CD1-CE2 3.95Å; Q443-Y938 HydrophobicContact CG-CD2 3.66Å; Q443-Y938 HydrophobicContact CG-CE2 3.76Å; Q443-Y938 HydrophobicContact CG-CG 4.34Å; G934-Y938 WeakPolarHBondContact O-CB 3.5Å; G934-Y938 PolarHBondContact O-N 2.78Å; R935-Y938 PolarHBondContact O-N 2.97Å; W936-Y938 VanDerWaalsContact C-N 3.32Å; W936-Y938 PolarHBondContact O-N 3.3Å; Y938-R940 PolarHBondContact O-N 3.41Å; Y938-M941 PolarHBondContact O-N 2.88Å; Y938-C942 VanDerWaalsContact CE2-SG 3.54Å; Y938-C942 PolarHBondContact O-N 3.43Å; Y938-C942 PolarHBondContact O-SG 3.41Å; Y938-G1016 VanDerWaalsContact CE1-CA 3.41Å; Y938-G1019 WeakPolarHBondContact OH-CA 3.49Å; Y938-L1021 HydrophobicContact CD1-CD1 4.11Å; Y938-L1021 HydrophobicContact CE1-CB 3.97Å; Y938-L1021 HydrophobicContact CE1-CD1 3.74Å; Y938-L1021 HydrophobicContact CE1-CG 4.08Å
939	I	93.5	Very high	93.8	Very high	20 Å²	20	10.4 Å²	10.4	10%	0.103	4%	0.044	C	C	.	.	H	α-helix	trans	-60.7	-46.4	-178.9	-67.4	173.6	0	0	0	111.1	R935 W936 M941 C942 K943 D1000 L1021	R935-I939 HydrophobicContact CG-CD1 3.81Å; R935-I939 HydrophobicContact CG-CG1 4.42Å; R935-I939 WeakPolarHBondContact O-CG1 3.21Å; R935-I939 PolarHBondContact O-N 3.45Å; W936-I939 PolarHBondContact O-N 3.19Å; I939-M941 VanDerWaalsContact C-N 3.34Å; I939-M941 PolarHBondContact O-N 3.22Å; I939-C942 PolarHBondContact O-N 2.91Å; I939-K943 HydrophobicContact CG2-CD 4.17Å; I939-K943 HydrophobicContact CG2-CG 4.42Å; I939-K943 WeakPolarHBondContact O-CG 3.44Å; I939-K943 PolarHBondContact O-N 3.22Å; I939-D1000 HydrophobicContact CD1-CB 4.31Å; I939-D1000 WeakPolarHBondContact CD1-OD2 3.45Å; I939-L1021 HydrophobicContact CB-CD1 4.45Å; I939-L1021 HydrophobicContact CG1-CD1 3.65Å
940	R	94.6	Very high	93.6	Very high	9 Å²	9	10.6 Å²	10.6	3%	0.034	5%	0.045	C	C	.	.	H	α-helix	trans	-57.5	-46.9	177.4	-75.3	168.2	-174.7	161	6.9	111.4	W936 Y938 K943 F944 G995 L996 D998	W936-R940 WeakPolarHBondContact O-CB 3.27Å; W936-R940 WeakPolarHBondContact O-CD 3.29Å; W936-R940 WeakPolarHBondContact O-CG 3.3Å; W936-R940 PolarHBondContact O-N 3.4Å; Y938-R940 PolarHBondContact O-N 3.41Å; R940-K943 PolarHBondContact O-N 2.93Å; R940-F944 WeakPolarHBondContact O-CB 3.23Å; R940-F944 PolarHBondContact O-N 3.38Å; R940-G995 WeakPolarHBondContact CB-O 3.45Å; R940-G995 WeakPolarHBondContact CD-O 3.16Å; R940-L996 PolarHBondContact NE-O 3.25Å; R940-L996 PolarHBondContact NH1-O 3.05Å; R940-D998 HydrophobicContact CG-CB 4.35Å; R940-D998 VanDerWaalsContact CZ-O 3.28Å; R940-D998 PolarHBondContact NE-O 3.35Å; R940-D998 PolarHBondContact NH2-O 3.01Å
941	M	93.5	Very high	93.3	Very high	0 Å²	0	10.6 Å²	10.6	0%	0	5%	0.045	C	C	.	.	H	α-helix	trans	-64.2	-43.8	178.5	-171.2	59.9	70.8	0	0	111.5	I329 V404 I407 R408 E439 S937 Y938 I939 F944 L945	I329-M941 HydrophobicContact CD1-CG 4.21Å; I329-M941 HydrophobicContact CG2-CG 4.24Å; V404-M941 HydrophobicContact CG1-CE 3.92Å; V404-M941 HydrophobicContact CG1-SD 4.21Å; V404-M941 HydrophobicContact CG2-SD 4.08Å; I407-M941 HydrophobicContact CB-CE 4.41Å; I407-M941 HydrophobicContact CG2-CE 3.85Å; R408-M941 HydrophobicContact CG-CE 4.16Å; E439-M941 HydrophobicContact CB-CB 4.01Å; E439-M941 HydrophobicContact CB-CG 4.31Å; E439-M941 HydrophobicContact CG-CB 4.49Å; E439-M941 HydrophobicContact CG-CG 4.26Å; S937-M941 VanDerWaalsContact O-CB 3.3Å; S937-M941 WeakPolarHBondContact O-CB 3.4Å; S937-M941 PolarHBondContact O-N 3.08Å; Y938-M941 PolarHBondContact O-N 2.88Å; I939-M941 VanDerWaalsContact C-N 3.34Å; I939-M941 PolarHBondContact O-N 3.22Å; M941-F944 PolarHBondContact O-N 2.89Å; M941-F944 HydrophobicContact SD-CD1 4.05Å; M941-L945 HydrophobicContact CG-CD1 4.17Å; M941-L945 HydrophobicContact CG-CG 4.48Å; M941-L945 WeakPolarHBondContact O-CB 3.3Å; M941-L945 VanDerWaalsContact O-CG 3.3Å; M941-L945 WeakPolarHBondContact O-CG 3.48Å; M941-L945 PolarHBondContact O-N 3.45Å; M941-L945 HydrophobicContact SD-CG 4.37Å
942	C	92.1	Very high	93	Very high	5 Å²	5	10.5 Å²	10.5	3%	0.034	4%	0.044	C	C	.	.	H	α-helix	trans	-61.7	-45.5	177	-65.7	0	0	0	0	112.5	Y938 I939 R946 L1021 F1022	Y938-C942 VanDerWaalsContact CE2-SG 3.54Å; Y938-C942 PolarHBondContact O-N 3.43Å; Y938-C942 PolarHBondContact O-SG 3.41Å; I939-C942 PolarHBondContact O-N 2.91Å; C942-R946 WeakPolarHBondContact O-CB 3.48Å; C942-R946 PolarHBondContact O-N 3.39Å; C942-L1021 HydrophobicContact CB-CB 3.98Å; C942-F1022 HydrophobicContact CB-CB 3.9Å; C942-F1022 WeakPolarHBondContact SG-CB 3.46Å
943	K	91.4	Very high	92.9	Very high	64 Å²	64	10.5 Å²	10.5	28%	0.278	4%	0.044	S	C	.	.	H	α-helix	trans	-64	-45.9	176.3	-74.5	-177	-177.7	-179.1	0	111.3	I939 R940 L945 R946 F947 V994 D998	I939-K943 HydrophobicContact CG2-CD 4.17Å; I939-K943 HydrophobicContact CG2-CG 4.42Å; I939-K943 WeakPolarHBondContact O-CG 3.44Å; I939-K943 PolarHBondContact O-N 3.22Å; R940-K943 PolarHBondContact O-N 2.93Å; K943-L945 PolarHBondContact O-N 2.81Å; K943-R946 PolarHBondContact O-N 3.05Å; K943-F947 HydrophobicContact CB-CD2 4.44Å; K943-F947 HydrophobicContact CB-CE2 4.4Å; K943-F947 WeakPolarHBondContact O-CD2 3.36Å; K943-F947 PolarHBondContact O-N 3.2Å; K943-V994 HydrophobicContact CB-CG1 4.15Å; K943-D998 WeakPolarHBondContact CD-OD2 3.3Å; K943-D998 WeakPolarHBondContact CE-OD2 3.15Å; K943-D998 IonicContact NZ-OD2 2.78Å; K943-D998 PolarHBondContact NZ-OD2 3.03Å
944	F	93	Very high	92.7	Very high	1 Å²	1	10 Å²	10	0%	0.004	4%	0.042	C	C	.	.	H	α-helix	trans	-52.8	-55.8	175	166.7	-95	0	0	0	110.7	L400 S403 V404 I407 R940 M941 R946 F947 F948 V991	L400-F944 HydrophobicContact CD1-CE1 3.94Å; L400-F944 HydrophobicContact CD1-CZ 4.38Å; S403-F944 VanDerWaalsContact CB-CZ 3.42Å; V404-F944 HydrophobicContact CG2-CD1 4.26Å; V404-F944 HydrophobicContact CG2-CE1 3.6Å; V404-F944 HydrophobicContact CG2-CZ 4.45Å; I407-F944 HydrophobicContact CD1-CB 4.17Å; I407-F944 HydrophobicContact CD1-CD1 3.87Å; I407-F944 HydrophobicContact CD1-CD2 3.23Å; I407-F944 HydrophobicContact CD1-CE1 4.14Å; I407-F944 HydrophobicContact CD1-CE2 3.54Å; I407-F944 HydrophobicContact CD1-CG 3.45Å; I407-F944 VanDerWaalsContact CD1-CG 3.45Å; I407-F944 HydrophobicContact CD1-CZ 4.02Å; R940-F944 WeakPolarHBondContact O-CB 3.23Å; R940-F944 PolarHBondContact O-N 3.38Å; M941-F944 PolarHBondContact O-N 2.89Å; M941-F944 HydrophobicContact SD-CD1 4.05Å; F944-R946 VanDerWaalsContact C-N 3.34Å; F944-R946 PolarHBondContact O-N 2.73Å; F944-F947 PolarHBondContact O-N 3.2Å; F944-F948 HydrophobicContact CE1-CB 4.39Å; F944-F948 HydrophobicContact CE1-CD2 4.44Å; F944-F948 HydrophobicContact CE1-CG 4.44Å; F944-F948 HydrophobicContact CE2-CB 4.45Å; F944-F948 AromaticContact CE2-CD2 3.79Å; F944-F948 HydrophobicContact CE2-CD2 3.79Å; F944-F948 HydrophobicContact CE2-CG 4.42Å; F944-F948 HydrophobicContact CZ-CB 4.18Å; F944-F948 AromaticContact CZ-CD2 3.53Å; F944-F948 HydrophobicContact CZ-CD2 3.53Å; F944-F948 HydrophobicContact CZ-CE2 4.12Å; F944-F948 AromaticContact CZ-CG 3.94Å; F944-F948 HydrophobicContact CZ-CG 3.94Å; F944-F948 WeakPolarHBondContact O-CB 3.44Å; F944-F948 PolarHBondContact O-N 3.17Å; F944-V991 HydrophobicContact CD2-CG1 3.58Å; F944-V991 HydrophobicContact CE2-CG1 3.78Å; F944-V991 HydrophobicContact CG-CG1 4.49Å
945	L	91.3	Very high	92.6	Very high	0 Å²	0	10 Å²	10	0%	0	4%	0.042	C	C	.	.	H	α-helix	trans	-60	-42.8	-178.8	-69	173.7	0	0	0	111.8	I329 L400 V404 M941 K943 F948 F949 F1022	I329-L945 HydrophobicContact CG2-CD1 3.62Å; L400-L945 HydrophobicContact CD1-CD2 3.71Å; V404-L945 HydrophobicContact CG2-CD2 4.3Å; M941-L945 HydrophobicContact CG-CD1 4.17Å; M941-L945 HydrophobicContact CG-CG 4.48Å; M941-L945 WeakPolarHBondContact O-CB 3.3Å; M941-L945 VanDerWaalsContact O-CG 3.3Å; M941-L945 WeakPolarHBondContact O-CG 3.48Å; M941-L945 PolarHBondContact O-N 3.45Å; M941-L945 HydrophobicContact SD-CG 4.37Å; K943-L945 PolarHBondContact O-N 2.81Å; L945-F948 PolarHBondContact O-N 3.31Å; L945-F949 HydrophobicContact CB-CE2 4.46Å; L945-F949 HydrophobicContact CD2-CE2 4.46Å; L945-F949 WeakPolarHBondContact O-CD2 3.39Å; L945-F949 PolarHBondContact O-N 3.04Å; L945-F1022 HydrophobicContact CB-CD2 4.14Å; L945-F1022 HydrophobicContact CB-CE1 4.38Å; L945-F1022 HydrophobicContact CB-CE2 3.54Å; L945-F1022 HydrophobicContact CB-CZ 3.69Å; L945-F1022 HydrophobicContact CD1-CD1 3.97Å; L945-F1022 HydrophobicContact CD1-CE1 3.6Å; L945-F1022 HydrophobicContact CD1-CE2 4.26Å; L945-F1022 HydrophobicContact CD1-CG 4.46Å; L945-F1022 HydrophobicContact CD1-CZ 3.76Å; L945-F1022 HydrophobicContact CG-CZ 4.3Å
946	R	90.3	Very high	92.5	Very high	66 Å²	66	9.7 Å²	9.7	25%	0.249	4%	0.041	C	C	.	.	H	α-helix	trans	-57.5	-53.7	177.1	-167.5	-171	78.1	132.4	2.3	111.7	C942 K943 F944 F948 F950 S1030 K1086	C942-R946 WeakPolarHBondContact O-CB 3.48Å; C942-R946 PolarHBondContact O-N 3.39Å; K943-R946 PolarHBondContact O-N 3.05Å; F944-R946 VanDerWaalsContact C-N 3.34Å; F944-R946 PolarHBondContact O-N 2.73Å; R946-F948 VanDerWaalsContact C-N 3.31Å; R946-F948 PolarHBondContact O-N 3.19Å; R946-F950 WeakPolarHBondContact O-CB 3.39Å; R946-F950 PolarHBondContact O-N 3.34Å; R946-S1030 VanDerWaalsContact CG-OG 3.28Å; R946-S1030 WeakPolarHBondContact CG-OG 3.24Å; R946-K1086 PolarHBondContact NH1-OXT 3.23Å; R946-K1086 PolarHBondContact NH2-O 3.35Å; R946-K1086 PolarHBondContact NH2-OXT 3.25Å; R946-K1086 VanDerWaalsContact NH2-OXT 3.09Å
947	F	90.6	Very high	92.4	Very high	6 Å²	6	9.9 Å²	9.9	3%	0.026	4%	0.044	C	C	.	.	H	α-helix	trans	-67.3	-34.9	-179.6	-73	-58.7	0	0	0	112.3	K943 F944 F950 K951 V991 V994 Q1081 V1082	K943-F947 HydrophobicContact CB-CD2 4.44Å; K943-F947 HydrophobicContact CB-CE2 4.4Å; K943-F947 WeakPolarHBondContact O-CD2 3.36Å; K943-F947 PolarHBondContact O-N 3.2Å; F944-F947 PolarHBondContact O-N 3.2Å; F947-F950 PolarHBondContact O-N 3.04Å; F947-K951 PolarHBondContact O-N 3.47Å; F947-V991 HydrophobicContact CB-CG1 4.12Å; F947-V994 HydrophobicContact CD2-CG1 4.49Å; F947-Q1081 HydrophobicContact CE1-CG 4.32Å; F947-V1082 HydrophobicContact CB-CG2 4.34Å; F947-V1082 HydrophobicContact CD1-CG2 4.19Å; F947-V1082 HydrophobicContact CG-CG2 4.25Å
948	F	91.3	Very high	92.4	Very high	1 Å²	1	9.8 Å²	9.8	0%	0.004	4%	0.043	C	C	.	.	H	α-helix	trans	-68.8	-40.7	179.7	-165.4	-82.6	0	0	0	112	P397 S399 L400 F944 L945 R946 K951 N952 V991	P397-F948 HydrophobicContact CB-CD1 4.43Å; P397-F948 HydrophobicContact CB-CE1 3.41Å; P397-F948 VanDerWaalsContact CB-CE1 3.41Å; P397-F948 HydrophobicContact CB-CZ 3.97Å; P397-F948 HydrophobicContact CG-CD1 4.15Å; P397-F948 HydrophobicContact CG-CE1 3.46Å; P397-F948 VanDerWaalsContact CG-CE1 3.46Å; P397-F948 HydrophobicContact CG-CZ 4.44Å; S399-F948 WeakPolarHBondContact OG-CZ 3.47Å; L400-F948 HydrophobicContact CB-CD1 4.27Å; L400-F948 HydrophobicContact CB-CE1 3.54Å; L400-F948 HydrophobicContact CB-CZ 3.97Å; L400-F948 HydrophobicContact CD1-CD1 3.57Å; L400-F948 HydrophobicContact CD1-CE1 3.73Å; L400-F948 HydrophobicContact CD1-CG 4.13Å; L400-F948 HydrophobicContact CD1-CZ 4.45Å; L400-F948 HydrophobicContact CG-CD1 4.41Å; L400-F948 HydrophobicContact CG-CE1 4.16Å; F944-F948 HydrophobicContact CE1-CB 4.39Å; F944-F948 HydrophobicContact CE1-CD2 4.44Å; F944-F948 HydrophobicContact CE1-CG 4.44Å; F944-F948 HydrophobicContact CE2-CB 4.45Å; F944-F948 AromaticContact CE2-CD2 3.79Å; F944-F948 HydrophobicContact CE2-CD2 3.79Å; F944-F948 HydrophobicContact CE2-CG 4.42Å; F944-F948 HydrophobicContact CZ-CB 4.18Å; F944-F948 AromaticContact CZ-CD2 3.53Å; F944-F948 HydrophobicContact CZ-CD2 3.53Å; F944-F948 HydrophobicContact CZ-CE2 4.12Å; F944-F948 AromaticContact CZ-CG 3.94Å; F944-F948 HydrophobicContact CZ-CG 3.94Å; F944-F948 WeakPolarHBondContact O-CB 3.44Å; F944-F948 PolarHBondContact O-N 3.17Å; L945-F948 PolarHBondContact O-N 3.31Å; R946-F948 VanDerWaalsContact C-N 3.31Å; R946-F948 PolarHBondContact O-N 3.19Å; F948-K951 WeakPolarHBondContact O-CG 3.39Å; F948-N952 WeakPolarHBondContact CD1-ND2 3.43Å; F948-N952 WeakPolarHBondContact CE1-ND2 3.31Å; F948-N952 PolarHBondContact O-N 3.23Å; F948-N952 PolarHBondContact O-ND2 2.97Å; F948-V991 HydrophobicContact CB-CG1 4.23Å; F948-V991 HydrophobicContact CD2-CG1 4.34Å
949	F	90.3	Very high	92.3	Very high	1 Å²	1	9.8 Å²	9.8	0%	0.004	4%	0.043	C	C	.	.	H	α-helix	trans	-68.7	-44.9	172	-75.1	-60.3	0	0	0	111.7	M336 I340 L400 L945 K951 N952 F953 F1022 F1027	M336-F949 HydrophobicContact CB-CZ 4.49Å; M336-F949 HydrophobicContact SD-CE2 4.11Å; I340-F949 HydrophobicContact CD1-CD1 3.88Å; I340-F949 HydrophobicContact CD1-CE1 3.56Å; L400-F949 HydrophobicContact CD2-CE1 4.22Å; L400-F949 HydrophobicContact CD2-CZ 3.92Å; L945-F949 HydrophobicContact CB-CE2 4.46Å; L945-F949 HydrophobicContact CD2-CE2 4.46Å; L945-F949 WeakPolarHBondContact O-CD2 3.39Å; L945-F949 PolarHBondContact O-N 3.04Å; F949-K951 PolarHBondContact O-N 3.02Å; F949-N952 PolarHBondContact O-N 2.93Å; F949-F953 HydrophobicContact CB-CD2 4.3Å; F949-F953 HydrophobicContact CB-CE2 3.83Å; F949-F953 HydrophobicContact CB-CZ 4.47Å; F949-F953 HydrophobicContact CD1-CZ 4.36Å; F949-F953 WeakPolarHBondContact O-CD2 3.46Å; F949-F953 WeakPolarHBondContact O-CG 3.3Å; F949-F953 PolarHBondContact O-N 2.92Å; F949-F1022 HydrophobicContact CD2-CZ 4.41Å; F949-F1022 HydrophobicContact CE2-CZ 4.05Å; F949-F1027 HydrophobicContact CD1-CE2 4.07Å; F949-F1027 HydrophobicContact CD2-CD2 4.15Å; F949-F1027 HydrophobicContact CD2-CE2 4.43Å; F949-F1027 HydrophobicContact CE1-CE2 4.32Å; F949-F1027 HydrophobicContact CE2-CD2 4.46Å; F949-F1027 HydrophobicContact CG-CD2 4.23Å; F949-F1027 HydrophobicContact CG-CE2 4.14Å
950	F	91.6	Very high	92.3	Very high	4 Å²	4	10.8 Å²	10.8	2%	0.018	5%	0.047	C	C	.	.	H	α-helix	trans	-53.1	-51.1	177.6	162.8	-104.5	0	0	0	112.6	R946 F947 N952 F953 A954 H1033 V1037 V1078 Q1081	R946-F950 WeakPolarHBondContact O-CB 3.39Å; R946-F950 PolarHBondContact O-N 3.34Å; F947-F950 PolarHBondContact O-N 3.04Å; F950-N952 VanDerWaalsContact C-N 3.32Å; F950-N952 PolarHBondContact O-N 3.41Å; F950-F953 PolarHBondContact O-N 3.44Å; F950-A954 WeakPolarHBondContact O-CB 3.32Å; F950-A954 PolarHBondContact O-N 3.15Å; F950-H1033 HydrophobicContact CD2-CB 4.08Å; F950-H1033 AromaticContact CD2-CG 3.75Å; F950-H1033 AromaticContact CD2-ND1 3.5Å; F950-H1033 WeakPolarHBondContact CD2-ND1 3.46Å; F950-H1033 HydrophobicContact CE2-CB 4.31Å; F950-H1033 AromaticContact CE2-CD2 3.83Å; F950-H1033 AromaticContact CE2-CE1 3.57Å; F950-H1033 AromaticContact CE2-CG 3.61Å; F950-H1033 AromaticContact CE2-ND1 3.45Å; F950-H1033 WeakPolarHBondContact CE2-ND1 3.28Å; F950-H1033 AromaticContact CE2-NE2 3.81Å; F950-H1033 AromaticContact CZ-CE1 3.91Å; F950-V1037 HydrophobicContact CE2-CB 4.1Å; F950-V1037 HydrophobicContact CE2-CG1 4.48Å; F950-V1037 HydrophobicContact CE2-CG2 3.82Å; F950-V1037 HydrophobicContact CZ-CB 4.3Å; F950-V1037 HydrophobicContact CZ-CG1 4.22Å; F950-V1037 HydrophobicContact CZ-CG2 3.98Å; F950-V1078 HydrophobicContact CE1-CG2 4.34Å; F950-Q1081 HydrophobicContact CE1-CB 4.1Å; F950-Q1081 HydrophobicContact CE1-CG 3.91Å; F950-Q1081 HydrophobicContact CZ-CG 4.23Å
951	K	91.2	Very high	92.3	Very high	0 Å²	0	12.5 Å²	12.5	0%	0	5%	0.053	C	C	.	.	H	α-helix	trans	-62.6	-39.1	-178.3	80.7	-170.7	-174.7	77.5	0	112.3	F947 F948 F949 A954 F955 Y982 N983 S987 V991 V1078	F947-K951 PolarHBondContact O-N 3.47Å; F948-K951 WeakPolarHBondContact O-CG 3.39Å; F949-K951 PolarHBondContact O-N 3.02Å; K951-A954 PolarHBondContact O-N 3.44Å; K951-F955 WeakPolarHBondContact O-CB 3.37Å; K951-F955 PolarHBondContact O-N 3.5Å; K951-Y982 PolarHBondContact O-OH 2.92Å; K951-N983 PolarHBondContact NZ-OD1 3.34Å; K951-S987 PolarHBondContact NZ-OG 3.27Å; K951-V991 HydrophobicContact CD-CG2 3.99Å; K951-V1078 HydrophobicContact CB-CG1 3.58Å; K951-V1078 HydrophobicContact CB-CG2 4.18Å
952	N	90.8	Very high	92.2	Very high	0 Å²	0	13.7 Å²	13.7	0%	0	6%	0.058	C	C	.	.	H	α-helix	trans	-68.9	-39.3	179.5	-79.7	-62.4	0	0	0	111.8	P397 F948 F949 F950 T956 N983	P397-N952 WeakPolarHBondContact CB-ND2 3.39Å; F948-N952 WeakPolarHBondContact CD1-ND2 3.43Å; F948-N952 WeakPolarHBondContact CE1-ND2 3.31Å; F948-N952 PolarHBondContact O-N 3.23Å; F948-N952 PolarHBondContact O-ND2 2.97Å; F949-N952 PolarHBondContact O-N 2.93Å; F950-N952 VanDerWaalsContact C-N 3.32Å; F950-N952 PolarHBondContact O-N 3.41Å; N952-T956 VanDerWaalsContact O-CB 3.32Å; N952-T956 WeakPolarHBondContact O-CB 3.48Å; N952-T956 PolarHBondContact O-N 3.49Å; N952-T956 PolarHBondContact O-OG1 2.98Å; N952-N983 VanDerWaalsContact OD1-CG 3.29Å; N952-N983 PolarHBondContact OD1-ND2 3.06Å; N952-N983 PolarHBondContact OD1-OD1 3.42Å
953	F	92.6	Very high	92.3	Very high	0 Å²	0	13.5 Å²	13.5	0%	0	6%	0.057	C	C	.	.	H	α-helix	trans	-67	-44.7	173.8	-63.6	-40.8	0	0	0	111.8	I340 M395 F949 F950 F955 T956 L957 F1027 L1031	I340-F953 HydrophobicContact CD1-CE1 4.32Å; I340-F953 HydrophobicContact CD1-CZ 4.08Å; I340-F953 HydrophobicContact CG1-CE1 4.32Å; I340-F953 HydrophobicContact CG1-CZ 4.18Å; M395-F953 HydrophobicContact CE-CD1 3.86Å; M395-F953 HydrophobicContact CE-CE1 3.67Å; M395-F953 HydrophobicContact CG-CD1 4.1Å; M395-F953 HydrophobicContact CG-CE1 3.96Å; F949-F953 HydrophobicContact CB-CD2 4.3Å; F949-F953 HydrophobicContact CB-CE2 3.83Å; F949-F953 HydrophobicContact CB-CZ 4.47Å; F949-F953 HydrophobicContact CD1-CZ 4.36Å; F949-F953 WeakPolarHBondContact O-CD2 3.46Å; F949-F953 WeakPolarHBondContact O-CG 3.3Å; F949-F953 PolarHBondContact O-N 2.92Å; F950-F953 PolarHBondContact O-N 3.44Å; F953-F955 VanDerWaalsContact C-N 3.29Å; F953-F955 PolarHBondContact O-N 3.44Å; F953-T956 PolarHBondContact O-N 3.41Å; F953-L957 HydrophobicContact CB-CD1 4.26Å; F953-L957 VanDerWaalsContact O-CB 3.26Å; F953-L957 WeakPolarHBondContact O-CB 3.22Å; F953-L957 WeakPolarHBondContact O-CD1 3.31Å; F953-L957 VanDerWaalsContact O-CG 3.24Å; F953-L957 WeakPolarHBondContact O-CG 3.29Å; F953-L957 PolarHBondContact O-N 3.16Å; F953-F1027 AromaticContact CE2-CE2 3.97Å; F953-F1027 HydrophobicContact CE2-CE2 3.97Å; F953-F1027 HydrophobicContact CE2-CZ 4.23Å; F953-F1027 AromaticContact CZ-CE2 3.7Å; F953-F1027 HydrophobicContact CZ-CE2 3.7Å; F953-F1027 AromaticContact CZ-CZ 3.72Å; F953-F1027 HydrophobicContact CZ-CZ 3.72Å; F953-L1031 HydrophobicContact CB-CD1 4.41Å; F953-L1031 HydrophobicContact CD1-CD1 3.77Å; F953-L1031 HydrophobicContact CD2-CB 4.08Å; F953-L1031 HydrophobicContact CD2-CD1 3.79Å; F953-L1031 HydrophobicContact CE1-CD1 3.9Å; F953-L1031 HydrophobicContact CE2-CB 3.91Å; F953-L1031 HydrophobicContact CE2-CD1 3.89Å; F953-L1031 HydrophobicContact CG-CD1 3.73Å; F953-L1031 HydrophobicContact CZ-CD1 3.95Å
954	A	93.6	Very high	92.3	Very high	0 Å²	0	14.9 Å²	14.9	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-59.1	-40.5	177.1	0	0	0	0	0	112.2	F950 K951 V958 V1037 S1038 L1074	F950-A954 WeakPolarHBondContact O-CB 3.32Å; F950-A954 PolarHBondContact O-N 3.15Å; K951-A954 PolarHBondContact O-N 3.44Å; A954-V958 WeakPolarHBondContact O-CG2 3.5Å; A954-V1037 HydrophobicContact CB-CG1 4.18Å; A954-S1038 WeakPolarHBondContact O-CB 3.44Å; A954-L1074 HydrophobicContact CB-CD1 3.91Å
955	F	93.3	Very high	92.1	Very high	1 Å²	1	19 Å²	19	0%	0.004	8%	0.081	C	C	.	.	H	α-helix	trans	-66.4	-55.9	174.2	174.2	-92.9	0	0	0	112.2	T394 K951 F953 L957 V958 Y974 F978 I979 Y982 L1074	T394-F955 HydrophobicContact CG2-CE1 3.8Å; T394-F955 WeakPolarHBondContact OG1-CE1 2.94Å; K951-F955 WeakPolarHBondContact O-CB 3.37Å; K951-F955 PolarHBondContact O-N 3.5Å; F953-F955 VanDerWaalsContact C-N 3.29Å; F953-F955 PolarHBondContact O-N 3.44Å; F955-L957 PolarHBondContact O-N 3.3Å; F955-V958 PolarHBondContact O-N 3.11Å; F955-Y974 HydrophobicContact CD2-CD2 4.14Å; F955-Y974 AromaticContact CD2-CE2 3.76Å; F955-Y974 HydrophobicContact CD2-CE2 3.76Å; F955-Y974 AromaticContact CE2-CD2 3.55Å; F955-Y974 HydrophobicContact CE2-CD2 3.55Å; F955-Y974 AromaticContact CE2-CE2 3.68Å; F955-Y974 HydrophobicContact CE2-CE2 3.68Å; F955-Y974 HydrophobicContact CE2-CG 4.47Å; F955-Y974 HydrophobicContact CG-CE2 4.4Å; F955-Y974 AromaticContact CZ-CD2 3.89Å; F955-Y974 HydrophobicContact CZ-CD2 3.89Å; F955-Y974 HydrophobicContact CZ-CE2 4.26Å; F955-F978 HydrophobicContact CD2-CE1 4.21Å; F955-F978 HydrophobicContact CE2-CD1 4.09Å; F955-F978 AromaticContact CE2-CE1 3.79Å; F955-F978 HydrophobicContact CE2-CE1 3.79Å; F955-I979 HydrophobicContact CZ-CB 4.21Å; F955-I979 HydrophobicContact CZ-CG1 4.02Å; F955-I979 HydrophobicContact CZ-CG2 4.1Å; F955-Y982 HydrophobicContact CB-CD1 4.09Å; F955-Y982 HydrophobicContact CB-CE1 3.5Å; F955-Y982 HydrophobicContact CD1-CD1 4.34Å; F955-Y982 AromaticContact CD2-CD1 3.44Å; F955-Y982 HydrophobicContact CD2-CD1 3.44Å; F955-Y982 VanDerWaalsContact CD2-CD1 3.44Å; F955-Y982 AromaticContact CD2-CD2 3.95Å; F955-Y982 HydrophobicContact CD2-CD2 3.95Å; F955-Y982 AromaticContact CD2-CE1 3.69Å; F955-Y982 HydrophobicContact CD2-CE1 3.69Å; F955-Y982 HydrophobicContact CD2-CE2 4.16Å; F955-Y982 AromaticContact CD2-CG 3.58Å; F955-Y982 HydrophobicContact CD2-CG 3.58Å; F955-Y982 AromaticContact CE2-CD1 3.92Å; F955-Y982 HydrophobicContact CE2-CD1 3.92Å; F955-Y982 HydrophobicContact CE2-CD2 4.37Å; F955-Y982 AromaticContact CE2-CG 3.8Å; F955-Y982 HydrophobicContact CE2-CG 3.8Å; F955-Y982 AromaticContact CG-CD1 3.69Å; F955-Y982 HydrophobicContact CG-CD1 3.69Å; F955-Y982 AromaticContact CG-CE1 3.65Å; F955-Y982 HydrophobicContact CG-CE1 3.65Å; F955-Y982 HydrophobicContact CG-CG 4.31Å; F955-L1074 HydrophobicContact CB-CD2 3.82Å; F955-L1074 HydrophobicContact CD2-CD2 3.53Å; F955-L1074 HydrophobicContact CG-CD2 4.14Å
956	T	91.8	Very high	92	Very high	3 Å²	3	20 Å²	20	2%	0.018	9%	0.086	C	C	.	.	H	α-helix	trans	-71.4	-34.5	-167.4	-49	0	0	0	0	112.1	L392 T394 M395 N952 F953 V958 H959	L392-T956 HydrophobicContact CB-CG2 4.1Å; L392-T956 HydrophobicContact CD2-CG2 3.71Å; T394-T956 PolarHBondContact OG1-OG1 3.1Å; M395-T956 HydrophobicContact CB-CG2 4.07Å; M395-T956 PolarHBondContact N-OG1 2.93Å; N952-T956 VanDerWaalsContact O-CB 3.32Å; N952-T956 WeakPolarHBondContact O-CB 3.48Å; N952-T956 PolarHBondContact O-N 3.49Å; N952-T956 PolarHBondContact O-OG1 2.98Å; F953-T956 PolarHBondContact O-N 3.41Å; T956-V958 PolarHBondContact O-N 2.96Å; T956-H959 WeakPolarHBondContact O-CB 3.45Å; T956-H959 PolarHBondContact O-N 2.91Å
957	L	93.9	Very high	91.8	Very high	22 Å²	22	17.1 Å²	17.1	12%	0.115	8%	0.077	C	C	.	.	H	α-helix	trans	-71.1	-16	-177.8	-69.6	170.2	0	0	0	113.6	F953 F955 H959 F960 W961 I1035 S1038	F953-L957 HydrophobicContact CB-CD1 4.26Å; F953-L957 VanDerWaalsContact O-CB 3.26Å; F953-L957 WeakPolarHBondContact O-CB 3.22Å; F953-L957 WeakPolarHBondContact O-CD1 3.31Å; F953-L957 VanDerWaalsContact O-CG 3.24Å; F953-L957 WeakPolarHBondContact O-CG 3.29Å; F953-L957 PolarHBondContact O-N 3.16Å; F955-L957 PolarHBondContact O-N 3.3Å; L957-H959 VanDerWaalsContact C-N 3.28Å; L957-H959 PolarHBondContact O-N 3.41Å; L957-F960 HydrophobicContact CD2-CB 4.35Å; L957-F960 WeakPolarHBondContact O-CB 3.31Å; L957-F960 PolarHBondContact O-N 3.13Å; L957-F960 VanDerWaalsContact O-N 3.14Å; L957-W961 PolarHBondContact O-N 3.44Å; L957-W961 PolarHBondContact O-NE1 3.24Å; L957-I1035 HydrophobicContact CD1-CB 4.12Å; L957-I1035 HydrophobicContact CD1-CG1 3.39Å; L957-S1038 VanDerWaalsContact CB-OG 3.29Å; L957-S1038 WeakPolarHBondContact CB-OG 3.43Å
958	V	94.6	Very high	91.9	Very high	0 Å²	0	19 Å²	19	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-62.8	-37.6	170.8	172.7	0	0	0	0	111	A954 F955 T956 F960 W961 Y962 A973 Y974 I1041 F1042 T1070	A954-V958 WeakPolarHBondContact O-CG2 3.5Å; F955-V958 PolarHBondContact O-N 3.11Å; T956-V958 PolarHBondContact O-N 2.96Å; V958-F960 VanDerWaalsContact C-N 3.31Å; V958-F960 PolarHBondContact O-N 3.38Å; V958-W961 PolarHBondContact O-N 3.06Å; V958-Y962 WeakPolarHBondContact O-CB 3.38Å; V958-Y962 PolarHBondContact O-N 3.2Å; V958-A973 HydrophobicContact CG1-CB 4.12Å; V958-Y974 HydrophobicContact CB-CE2 4.19Å; V958-Y974 WeakPolarHBondContact CB-OH 3.46Å; V958-Y974 HydrophobicContact CG1-CE1 4.35Å; V958-Y974 HydrophobicContact CG1-CE2 4.25Å; V958-Y974 WeakPolarHBondContact CG1-OH 3.43Å; V958-Y974 WeakPolarHBondContact CG2-OH 3.45Å; V958-I1041 HydrophobicContact CG2-CB 4.4Å; V958-I1041 HydrophobicContact CG2-CG2 3.89Å; V958-F1042 HydrophobicContact CG1-CB 4.47Å; V958-F1042 HydrophobicContact CG1-CD2 4.03Å; V958-T1070 HydrophobicContact CG1-CG2 3.85Å
959	H	92.8	Very high	91.7	Very high	2 Å²	2	21.7 Å²	21.7	1%	0.009	10%	0.104	C	C	.	.	H	α-helix	trans	-62.7	-38.6	172.6	-64.9	-75.3	0	0	0	112.1	V391 L392 T956 L957 Y962 S963 A973 Y974	V391-H959 HydrophobicContact CG1-CB 3.75Å; L392-H959 HydrophobicContact CD2-CB 3.95Å; T956-H959 WeakPolarHBondContact O-CB 3.45Å; T956-H959 PolarHBondContact O-N 2.91Å; L957-H959 VanDerWaalsContact C-N 3.28Å; L957-H959 PolarHBondContact O-N 3.41Å; H959-Y962 PolarHBondContact O-N 2.65Å; H959-S963 PolarHBondContact O-N 3.32Å; H959-S963 VanDerWaalsContact O-N 3.08Å; H959-S963 PolarHBondContact O-OG 3.42Å; H959-A973 PolarHBondContact CE1-N 3.08Å; H959-A973 PolarHBondContact ND1-N 3.04Å; H959-A973 VanDerWaalsContact ND1-N 3.1Å; H959-Y974 AromaticContact CE1-CD2 3.71Å; H959-Y974 AromaticContact NE2-CD2 3.38Å; H959-Y974 WeakPolarHBondContact NE2-CD2 3.19Å; H959-Y974 AromaticContact NE2-CE2 3.94Å
960	F	93.7	Very high	91.6	Very high	41 Å²	41	21.8 Å²	21.8	18%	0.18	10%	0.104	C	C	.	.	H	α-helix	trans	-61	-47.4	174.9	172.9	-97	0	0	0	111.4	V347 L351 L957 V958 S963 F964	V347-F960 HydrophobicContact CG1-CD2 3.55Å; V347-F960 HydrophobicContact CG1-CE2 3.85Å; L351-F960 HydrophobicContact CD1-CD2 3.94Å; L351-F960 HydrophobicContact CD2-CD2 3.94Å; L351-F960 HydrophobicContact CD2-CE2 3.83Å; L351-F960 HydrophobicContact CG-CD2 4.17Å; L351-F960 HydrophobicContact CG-CE2 4.24Å; L957-F960 HydrophobicContact CD2-CB 4.35Å; L957-F960 WeakPolarHBondContact O-CB 3.31Å; L957-F960 PolarHBondContact O-N 3.13Å; L957-F960 VanDerWaalsContact O-N 3.14Å; V958-F960 VanDerWaalsContact C-N 3.31Å; V958-F960 PolarHBondContact O-N 3.38Å; F960-S963 VanDerWaalsContact O-CB 3.3Å; F960-S963 WeakPolarHBondContact O-CB 3.4Å; F960-S963 PolarHBondContact O-N 3.35Å; F960-F964 HydrophobicContact CD1-CE2 4.11Å; F960-F964 AromaticContact CE1-CE2 3.65Å; F960-F964 HydrophobicContact CE1-CE2 3.65Å; F960-F964 HydrophobicContact CE1-CZ 4.14Å; F960-F964 HydrophobicContact CE2-CE2 4.17Å; F960-F964 HydrophobicContact CE2-CZ 4.3Å; F960-F964 AromaticContact CZ-CE2 3.67Å; F960-F964 HydrophobicContact CZ-CE2 3.67Å; F960-F964 AromaticContact CZ-CZ 3.76Å; F960-F964 HydrophobicContact CZ-CZ 3.76Å; F960-F964 WeakPolarHBondContact O-CD2 2.95Å; F960-F964 WeakPolarHBondContact O-CE2 3.46Å
961	W	94.2	Very high	91.5	Very high	45 Å²	45	25.7 Å²	25.7	17%	0.17	12%	0.122	C	C	.	.	H	α-helix	trans	-65	-40.7	177.4	-57	126	0	0	0	112.6	L957 V958 S963 F964 F965 I1035 S1038 F1042 F1043	L957-W961 PolarHBondContact O-N 3.44Å; L957-W961 PolarHBondContact O-NE1 3.24Å; V958-W961 PolarHBondContact O-N 3.06Å; W961-S963 PolarHBondContact O-N 3.1Å; W961-F964 HydrophobicContact CE3-CE2 4.25Å; W961-F964 PolarHBondContact O-N 3.36Å; W961-F965 WeakPolarHBondContact O-CD2 3.15Å; W961-I1035 HydrophobicContact CZ2-CG2 4.17Å; W961-S1038 PolarHBondContact NE1-OG 2.9Å; W961-F1042 HydrophobicContact CB-CB 4.13Å; W961-F1042 HydrophobicContact CB-CD1 3.62Å; W961-F1042 HydrophobicContact CB-CD2 4.24Å; W961-F1042 HydrophobicContact CB-CE1 4.11Å; W961-F1042 HydrophobicContact CB-CG 3.7Å; W961-F1042 HydrophobicContact CG-CB 4.5Å; W961-F1043 HydrophobicContact CD2-CE2 4.4Å; W961-F1043 HydrophobicContact CE3-CE2 4.4Å; W961-F1043 HydrophobicContact CG-CE2 4.44Å
962	Y	92.8	Very high	91.5	Very high	25 Å²	25	26.5 Å²	26.5	10%	0.098	13%	0.127	C	C	.	.	H	α-helix	trans	-61.9	-29.5	177.4	-175.3	-123.1	0	0	0	113.1	V958 H959 F964 F965 N966 Q971 T972 A973 F1042 Y1063	V958-Y962 WeakPolarHBondContact O-CB 3.38Å; V958-Y962 PolarHBondContact O-N 3.2Å; H959-Y962 PolarHBondContact O-N 2.65Å; Y962-F964 PolarHBondContact O-N 2.91Å; Y962-F965 PolarHBondContact O-N 2.96Å; Y962-N966 VanDerWaalsContact CD1-ND2 3.32Å; Y962-N966 WeakPolarHBondContact CD1-ND2 3.35Å; Y962-N966 HydrophobicContact CE1-CB 4.07Å; Y962-N966 WeakPolarHBondContact CE1-ND2 3.13Å; Y962-N966 PolarHBondContact O-N 3.46Å; Y962-Q971 WeakPolarHBondContact CD1-O 3.49Å; Y962-Q971 HydrophobicContact CE1-CB 4.16Å; Y962-Q971 HydrophobicContact CE1-CG 4.16Å; Y962-Q971 PolarHBondContact OH-OE1 3.18Å; Y962-T972 WeakPolarHBondContact CE1-O 3.25Å; Y962-A973 HydrophobicContact CD1-CB 3.77Å; Y962-A973 HydrophobicContact CG-CB 3.87Å; Y962-F1042 AromaticContact CD2-CE2 3.79Å; Y962-F1042 HydrophobicContact CD2-CE2 3.79Å; Y962-F1042 HydrophobicContact CD2-CZ 4.13Å; Y962-F1042 HydrophobicContact CG-CE2 4.19Å; Y962-Y1063 AromaticContact CE1-CE2 3.99Å; Y962-Y1063 HydrophobicContact CE1-CE2 3.99Å; Y962-Y1063 HydrophobicContact CE2-CE2 4.36Å; Y962-Y1063 AromaticContact CZ-CE2 3.6Å; Y962-Y1063 VanDerWaalsContact OH-CD2 3.3Å; Y962-Y1063 WeakPolarHBondContact OH-CD2 3.44Å; Y962-Y1063 WeakPolarHBondContact OH-CE2 3.33Å
963	S	92.5	Very high	91.4	Very high	2 Å²	2	26.5 Å²	26.5	1%	0.014	13%	0.128	C	C	.	.	H	α-helix	trans	-59.6	-29.1	-180	-57.4	0	0	0	0	113.4	Y388 H959 F960 W961 F965 N966 Y968	Y388-S963 VanDerWaalsContact CE1-OG 3.24Å; Y388-S963 WeakPolarHBondContact CE1-OG 3.42Å; Y388-S963 WeakPolarHBondContact OH-CB 2.8Å; Y388-S963 PolarHBondContact OH-OG 3.37Å; H959-S963 PolarHBondContact O-N 3.32Å; H959-S963 VanDerWaalsContact O-N 3.08Å; H959-S963 PolarHBondContact O-OG 3.42Å; F960-S963 VanDerWaalsContact O-CB 3.3Å; F960-S963 WeakPolarHBondContact O-CB 3.4Å; F960-S963 PolarHBondContact O-N 3.35Å; W961-S963 PolarHBondContact O-N 3.1Å; S963-F965 PolarHBondContact O-N 3.37Å; S963-N966 WeakPolarHBondContact CA-OD1 3.36Å; S963-N966 PolarHBondContact O-OD1 3.23Å; S963-N966 VanDerWaalsContact O-OD1 3.06Å; S963-Y968 WeakPolarHBondContact O-CA 3.34Å; S963-Y968 PolarHBondContact O-N 2.94Å; S963-Y968 VanDerWaalsContact O-N 3.09Å
964	F	92.4	Very high	91.4	Very high	92 Å²	92	26.5 Å²	26.5	40%	0.404	13%	0.128	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-17.7	176.7	-66.3	-86.1	0	0	0	113.3	F960 W961 Y962 Y968	F960-F964 HydrophobicContact CD1-CE2 4.11Å; F960-F964 AromaticContact CE1-CE2 3.65Å; F960-F964 HydrophobicContact CE1-CE2 3.65Å; F960-F964 HydrophobicContact CE1-CZ 4.14Å; F960-F964 HydrophobicContact CE2-CE2 4.17Å; F960-F964 HydrophobicContact CE2-CZ 4.3Å; F960-F964 AromaticContact CZ-CE2 3.67Å; F960-F964 HydrophobicContact CZ-CE2 3.67Å; F960-F964 AromaticContact CZ-CZ 3.76Å; F960-F964 HydrophobicContact CZ-CZ 3.76Å; F960-F964 WeakPolarHBondContact O-CD2 2.95Å; F960-F964 WeakPolarHBondContact O-CE2 3.46Å; W961-F964 HydrophobicContact CE3-CE2 4.25Å; W961-F964 PolarHBondContact O-N 3.36Å; Y962-F964 PolarHBondContact O-N 2.91Å; F964-Y968 AromaticContact CD1-CE1 3.95Å; F964-Y968 HydrophobicContact CD1-CE1 3.95Å; F964-Y968 AromaticContact CD1-CZ 3.84Å; F964-Y968 WeakPolarHBondContact CD1-OH 3.32Å; F964-Y968 HydrophobicContact CE1-CE1 4.1Å; F964-Y968 WeakPolarHBondContact CE1-OH 3.39Å; F964-Y968 HydrophobicContact CG-CE1 4.43Å
965	F	89.3	Confident	91.2	Very high	87 Å²	87	31.3 Å²	31.3	38%	0.382	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-110.3	-8.6	-174.8	-61.1	-84.6	0	0	0	113.4	W961 Y962 S963 F1042 F1043 Y1046	W961-F965 WeakPolarHBondContact O-CD2 3.15Å; Y962-F965 PolarHBondContact O-N 2.96Å; S963-F965 PolarHBondContact O-N 3.37Å; F965-F1042 AromaticContact CD2-CE1 3.6Å; F965-F1042 HydrophobicContact CD2-CE1 3.6Å; F965-F1042 AromaticContact CD2-CZ 3.57Å; F965-F1042 HydrophobicContact CD2-CZ 3.57Å; F965-F1042 AromaticContact CE2-CE1 3.45Å; F965-F1042 HydrophobicContact CE2-CE1 3.45Å; F965-F1042 VanDerWaalsContact CE2-CE1 3.45Å; F965-F1042 AromaticContact CE2-CZ 3.95Å; F965-F1042 HydrophobicContact CE2-CZ 3.95Å; F965-F1042 HydrophobicContact CG-CZ 4.37Å; F965-F1042 HydrophobicContact CZ-CE1 4.36Å; F965-F1043 HydrophobicContact CE2-CE1 4.06Å; F965-F1043 HydrophobicContact CE2-CZ 4.18Å; F965-F1043 AromaticContact CZ-CE1 3.82Å; F965-F1043 HydrophobicContact CZ-CE1 3.82Å; F965-F1043 HydrophobicContact CZ-CZ 4.31Å; F965-Y1046 HydrophobicContact CD1-CE1 4.08Å; F965-Y1046 HydrophobicContact CD1-CE2 4.18Å; F965-Y1046 AromaticContact CD1-CZ 3.6Å; F965-Y1046 VanDerWaalsContact CD1-OH 3.28Å; F965-Y1046 WeakPolarHBondContact CD1-OH 3.23Å; F965-Y1046 AromaticContact CE1-CE1 3.7Å; F965-Y1046 HydrophobicContact CE1-CE1 3.7Å; F965-Y1046 AromaticContact CE1-CZ 3.72Å; F965-Y1046 HydrophobicContact CG-CE2 4.46Å; F965-Y1046 HydrophobicContact CZ-CE1 4.21Å
966	N	87.9	Confident	90.9	Very high	21 Å²	21	33.3 Å²	33.3	11%	0.112	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.7	19.2	-179	71.4	15	0	0	0	113.5	Y962 S963 Y968 S969 Q971	Y962-N966 VanDerWaalsContact CD1-ND2 3.32Å; Y962-N966 WeakPolarHBondContact CD1-ND2 3.35Å; Y962-N966 HydrophobicContact CE1-CB 4.07Å; Y962-N966 WeakPolarHBondContact CE1-ND2 3.13Å; Y962-N966 PolarHBondContact O-N 3.46Å; S963-N966 WeakPolarHBondContact CA-OD1 3.36Å; S963-N966 PolarHBondContact O-OD1 3.23Å; S963-N966 VanDerWaalsContact O-OD1 3.06Å; N966-Y968 PolarHBondContact O-N 3.38Å; N966-Y968 WeakPolarHBondContact OD1-CA 3.28Å; N966-Y968 PolarHBondContact OD1-N 3.39Å; N966-S969 WeakPolarHBondContact O-CB 3.11Å; N966-S969 PolarHBondContact O-N 3.3Å; N966-S969 PolarHBondContact O-OG 3.21Å; N966-S969 PolarHBondContact OD1-N 3.23Å; N966-Q971 PolarHBondContact ND2-O 3.02Å
967	G	87.6	Confident	90.8	Very high	6 Å²	6	40 Å²	40	6%	0.062	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	67.5	22.9	-176.7	0	0	0	0	0	113.7	H355 S969	H355-G967 PolarHBondContact CD2-O 3.18Å; G967-S969 PolarHBondContact O-N 3.1Å
968	Y	91.3	Very high	90.6	Very high	47 Å²	47	40 Å²	40	18%	0.184	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.6	26.1	-173.8	-53	-90.5	0	0	0	114.6	L351 H355 W358 Y388 S963 F964 N966 S970	L351-Y968 HydrophobicContact CD2-CD1 3.94Å; L351-Y968 HydrophobicContact CD2-CE1 4.02Å; H355-Y968 PolarHBondContact CD2-O 3.46Å; H355-Y968 VanDerWaalsContact CD2-O 3.25Å; W358-Y968 HydrophobicContact CB-CD2 4.05Å; W358-Y968 HydrophobicContact CB-CE2 4.5Å; W358-Y968 HydrophobicContact CG-CD2 4.41Å; Y388-Y968 WeakPolarHBondContact CE2-O 3.38Å; Y388-Y968 WeakPolarHBondContact OH-CA 3.3Å; Y388-Y968 PolarHBondContact OH-O 2.99Å; S963-Y968 WeakPolarHBondContact O-CA 3.34Å; S963-Y968 PolarHBondContact O-N 2.94Å; S963-Y968 VanDerWaalsContact O-N 3.09Å; F964-Y968 AromaticContact CD1-CE1 3.95Å; F964-Y968 HydrophobicContact CD1-CE1 3.95Å; F964-Y968 AromaticContact CD1-CZ 3.84Å; F964-Y968 WeakPolarHBondContact CD1-OH 3.32Å; F964-Y968 HydrophobicContact CE1-CE1 4.1Å; F964-Y968 WeakPolarHBondContact CE1-OH 3.39Å; F964-Y968 HydrophobicContact CG-CE1 4.43Å; N966-Y968 PolarHBondContact O-N 3.38Å; N966-Y968 WeakPolarHBondContact OD1-CA 3.28Å; N966-Y968 PolarHBondContact OD1-N 3.39Å; Y968-S970 PolarHBondContact O-N 3.2Å
969	S	86.9	Confident	90.3	Very high	57 Å²	57	40.6 Å²	40.6	40%	0.399	19%	0.188	S	C	.	.			trans	-70.7	3.8	-177	56.3	0	0	0	0	115.2	N966 G967 Q971	N966-S969 WeakPolarHBondContact O-CB 3.11Å; N966-S969 PolarHBondContact O-N 3.3Å; N966-S969 PolarHBondContact O-OG 3.21Å; N966-S969 PolarHBondContact OD1-N 3.23Å; G967-S969 PolarHBondContact O-N 3.1Å; S969-Q971 PolarHBondContact O-N 2.78Å
970	S	88.9	Confident	89.9	Confident	3 Å²	3	40.7 Å²	40.7	2%	0.021	19%	0.189	C	C	.	.			trans	61.2	22.6	-174.8	-42.3	0	0	0	0	113.9	S384 Y388 V391 Y968	S384-S970 PolarHBondContact OG-OG 3.03Å; Y388-S970 VanDerWaalsContact CD2-OG 3.29Å; Y388-S970 WeakPolarHBondContact CD2-OG 3.29Å; Y388-S970 WeakPolarHBondContact CE2-OG 3.05Å; Y388-S970 PolarHBondContact OH-N 3.27Å; V391-S970 WeakPolarHBondContact CG2-O 3.15Å; Y968-S970 PolarHBondContact O-N 3.2Å
971	Q	89.6	Confident	89.6	Confident	85 Å²	85	41 Å²	41	40%	0.397	19%	0.192	S	C	.	.			trans	-66	136.4	172.2	-171.9	179.7	0.4	0	0	110.4	Y962 N966 S969	Y962-Q971 WeakPolarHBondContact CD1-O 3.49Å; Y962-Q971 HydrophobicContact CE1-CB 4.16Å; Y962-Q971 HydrophobicContact CE1-CG 4.16Å; Y962-Q971 PolarHBondContact OH-OE1 3.18Å; N966-Q971 PolarHBondContact ND2-O 3.02Å; S969-Q971 PolarHBondContact O-N 2.78Å
972	T	90.6	Very high	89.3	Confident	17 Å²	17	38.8 Å²	38.8	10%	0.104	18%	0.184	C	C	.	.			trans	-66.5	152.7	177.3	55.1	0	0	0	0	110.5	L135 V391 Y962 Y974 I979 Y1063	L135-T972 HydrophobicContact CD2-CG2 3.54Å; L135-T972 HydrophobicContact CG-CG2 4.12Å; V391-T972 HydrophobicContact CG2-CG2 4.22Å; Y962-T972 WeakPolarHBondContact CE1-O 3.25Å; T972-Y974 PolarHBondContact OG1-O 3.28Å; T972-I979 HydrophobicContact CG2-CD1 4.18Å; T972-Y1063 PolarHBondContact O-OH 3.31Å
973	A	90.1	Very high	88.7	Confident	1 Å²	1	38.5 Å²	38.5	1%	0.008	18%	0.184	C	C	.	.	S	Bend	trans	-97.2	-13.8	176.2	0	0	0	0	0	112.1	V958 H959 Y962 A1067	V958-A973 HydrophobicContact CG1-CB 4.12Å; H959-A973 PolarHBondContact CE1-N 3.08Å; H959-A973 PolarHBondContact ND1-N 3.04Å; H959-A973 VanDerWaalsContact ND1-N 3.1Å; Y962-A973 HydrophobicContact CD1-CB 3.77Å; Y962-A973 HydrophobicContact CG-CB 3.87Å; A973-A1067 WeakPolarHBondContact O-CB 3.49Å
974	Y	91.4	Very high	88.1	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	20%	0.197	C	C	.	.	S	Bend	trans	-124	157.5	-177.1	-62.7	-52.1	0	0	0	109.7	F955 V958 H959 T972 F978 T1070 A1071 L1074	F955-Y974 HydrophobicContact CD2-CD2 4.14Å; F955-Y974 AromaticContact CD2-CE2 3.76Å; F955-Y974 HydrophobicContact CD2-CE2 3.76Å; F955-Y974 AromaticContact CE2-CD2 3.55Å; F955-Y974 HydrophobicContact CE2-CD2 3.55Å; F955-Y974 AromaticContact CE2-CE2 3.68Å; F955-Y974 HydrophobicContact CE2-CE2 3.68Å; F955-Y974 HydrophobicContact CE2-CG 4.47Å; F955-Y974 HydrophobicContact CG-CE2 4.4Å; F955-Y974 AromaticContact CZ-CD2 3.89Å; F955-Y974 HydrophobicContact CZ-CD2 3.89Å; F955-Y974 HydrophobicContact CZ-CE2 4.26Å; V958-Y974 HydrophobicContact CB-CE2 4.19Å; V958-Y974 WeakPolarHBondContact CB-OH 3.46Å; V958-Y974 HydrophobicContact CG1-CE1 4.35Å; V958-Y974 HydrophobicContact CG1-CE2 4.25Å; V958-Y974 WeakPolarHBondContact CG1-OH 3.43Å; V958-Y974 WeakPolarHBondContact CG2-OH 3.45Å; H959-Y974 AromaticContact CE1-CD2 3.71Å; H959-Y974 AromaticContact NE2-CD2 3.38Å; H959-Y974 WeakPolarHBondContact NE2-CD2 3.19Å; H959-Y974 AromaticContact NE2-CE2 3.94Å; T972-Y974 PolarHBondContact OG1-O 3.28Å; Y974-F978 HydrophobicContact CD1-CD1 4.07Å; Y974-F978 HydrophobicContact CD1-CE1 4.08Å; Y974-F978 HydrophobicContact CD2-CD1 4.31Å; Y974-F978 HydrophobicContact CD2-CE1 4.31Å; Y974-F978 HydrophobicContact CE1-CE1 4.27Å; Y974-F978 AromaticContact CG-CD1 3.85Å; Y974-F978 HydrophobicContact CG-CD1 3.85Å; Y974-F978 HydrophobicContact CG-CE1 4.1Å; Y974-T1070 HydrophobicContact CE1-CG2 3.83Å; Y974-A1071 HydrophobicContact CD1-CB 3.93Å; Y974-A1071 HydrophobicContact CE1-CB 4.05Å; Y974-L1074 HydrophobicContact CE2-CD2 4.48Å
975	E	90.4	Very high	87.6	Confident	100 Å²	100	39.1 Å²	39.1	47%	0.467	20%	0.198	S	C	.	.			trans	-72.3	148.1	173.7	-174.1	-81.5	147	0	0	111.4	W977 F978 I979	E975-W977 VanDerWaalsContact CD-N 3.34Å; E975-W977 PolarHBondContact O-N 3.3Å; E975-W977 PolarHBondContact OE1-N 2.97Å; E975-W977 VanDerWaalsContact OE1-N 3.13Å; E975-W977 WeakPolarHBondContact OE2-CB 3.48Å; E975-W977 PolarHBondContact OE2-N 2.89Å; E975-W977 VanDerWaalsContact OE2-N 3.13Å; E975-F978 WeakPolarHBondContact O-CB 3.34Å; E975-F978 PolarHBondContact O-N 2.82Å; E975-F978 VanDerWaalsContact O-N 3.08Å; E975-F978 PolarHBondContact OE2-N 2.76Å; E975-I979 WeakPolarHBondContact O-CG1 3.28Å; E975-I979 PolarHBondContact O-N 2.74Å
976	D	87.3	Confident	87.6	Confident	43 Å²	43	40 Å²	40	23%	0.23	20%	0.199	C	C	.	.	H	α-helix	trans	-62.7	-39.4	-167.3	-64	-18.8	0	0	0	113.6	P136 Y138 F978 I979 T980	P136-D976 WeakPolarHBondContact CG-OD2 3.36Å; Y138-D976 HydrophobicContact CE2-CB 4.46Å; D976-F978 VanDerWaalsContact C-N 3.35Å; D976-I979 PolarHBondContact O-N 2.91Å; D976-T980 PolarHBondContact O-N 3.38Å; D976-T980 VanDerWaalsContact O-N 3.14Å; D976-T980 PolarHBondContact O-OG1 3.05Å
977	W	88.5	Confident	87.5	Confident	143 Å²	143	39 Å²	39	54%	0.542	19%	0.194	S	C	.	.	H	α-helix	trans	-67.9	-36.8	175.2	-73.8	107.9	0	0	0	111.6	E975 T980 L981	E975-W977 VanDerWaalsContact CD-N 3.34Å; E975-W977 PolarHBondContact O-N 3.3Å; E975-W977 PolarHBondContact OE1-N 2.97Å; E975-W977 VanDerWaalsContact OE1-N 3.13Å; E975-W977 WeakPolarHBondContact OE2-CB 3.48Å; E975-W977 PolarHBondContact OE2-N 2.89Å; E975-W977 VanDerWaalsContact OE2-N 3.13Å; W977-T980 PolarHBondContact O-N 3.04Å; W977-L981 VanDerWaalsContact O-CB 3.31Å; W977-L981 WeakPolarHBondContact O-CB 3.41Å; W977-L981 VanDerWaalsContact O-CG 3.32Å; W977-L981 WeakPolarHBondContact O-CG 3.27Å; W977-L981 PolarHBondContact O-N 3.46Å
978	F	90.3	Very high	87.4	Confident	24 Å²	24	39.7 Å²	39.7	11%	0.105	20%	0.198	C	C	.	.	H	α-helix	trans	-61	-45.5	173.4	-176	-100.2	0	0	0	112.1	F955 Y974 E975 D976 T980 L981 Y982 Y986 A1071 L1074 V1075	F955-F978 HydrophobicContact CD2-CE1 4.21Å; F955-F978 HydrophobicContact CE2-CD1 4.09Å; F955-F978 AromaticContact CE2-CE1 3.79Å; F955-F978 HydrophobicContact CE2-CE1 3.79Å; Y974-F978 HydrophobicContact CD1-CD1 4.07Å; Y974-F978 HydrophobicContact CD1-CE1 4.08Å; Y974-F978 HydrophobicContact CD2-CD1 4.31Å; Y974-F978 HydrophobicContact CD2-CE1 4.31Å; Y974-F978 HydrophobicContact CE1-CE1 4.27Å; Y974-F978 AromaticContact CG-CD1 3.85Å; Y974-F978 HydrophobicContact CG-CD1 3.85Å; Y974-F978 HydrophobicContact CG-CE1 4.1Å; E975-F978 WeakPolarHBondContact O-CB 3.34Å; E975-F978 PolarHBondContact O-N 2.82Å; E975-F978 VanDerWaalsContact O-N 3.08Å; E975-F978 PolarHBondContact OE2-N 2.76Å; D976-F978 VanDerWaalsContact C-N 3.35Å; F978-T980 VanDerWaalsContact C-N 3.3Å; F978-T980 PolarHBondContact O-N 3.39Å; F978-L981 PolarHBondContact O-N 3.25Å; F978-Y982 HydrophobicContact CE1-CD2 4.14Å; F978-Y982 HydrophobicContact CE2-CD2 4.42Å; F978-Y982 AromaticContact CZ-CD2 3.74Å; F978-Y982 HydrophobicContact CZ-CD2 3.74Å; F978-Y982 HydrophobicContact CZ-CE2 4.46Å; F978-Y982 WeakPolarHBondContact O-CB 3.47Å; F978-Y982 PolarHBondContact O-N 3.24Å; F978-Y986 AromaticContact CD2-CD2 3.89Å; F978-Y986 HydrophobicContact CD2-CD2 3.89Å; F978-Y986 AromaticContact CD2-CE2 3.76Å; F978-Y986 HydrophobicContact CD2-CE2 3.76Å; F978-Y986 AromaticContact CE2-CD2 3.86Å; F978-Y986 HydrophobicContact CE2-CD2 3.86Å; F978-Y986 HydrophobicContact CE2-CE2 4.16Å; F978-A1071 HydrophobicContact CD1-CB 3.88Å; F978-A1071 HydrophobicContact CD2-CB 4Å; F978-A1071 HydrophobicContact CE1-CB 3.59Å; F978-A1071 HydrophobicContact CE2-CB 3.76Å; F978-A1071 HydrophobicContact CG-CB 4.06Å; F978-A1071 HydrophobicContact CZ-CB 3.53Å; F978-L1074 HydrophobicContact CE1-CD2 4.47Å; F978-V1075 HydrophobicContact CE2-CG2 3.7Å; F978-V1075 HydrophobicContact CZ-CG2 3.78Å
979	I	87.8	Confident	87.2	Confident	11 Å²	11	42.5 Å²	42.5	6%	0.056	22%	0.216	C	C	.	.	H	α-helix	trans	-57.7	-45.4	177.3	-62.5	172.9	0	0	0	110.6	L135 T394 F955 T972 E975 D976	L135-I979 HydrophobicContact CD2-CD1 3.62Å; T394-I979 HydrophobicContact CG2-CG2 4.25Å; F955-I979 HydrophobicContact CZ-CB 4.21Å; F955-I979 HydrophobicContact CZ-CG1 4.02Å; F955-I979 HydrophobicContact CZ-CG2 4.1Å; T972-I979 HydrophobicContact CG2-CD1 4.18Å; E975-I979 WeakPolarHBondContact O-CG1 3.28Å; E975-I979 PolarHBondContact O-N 2.74Å; D976-I979 PolarHBondContact O-N 2.91Å
980	T	85.4	Confident	87.3	Confident	5 Å²	5	41.7 Å²	41.7	3%	0.031	21%	0.209	C	C	.	.	H	α-helix	trans	-66.1	-43.9	-179.6	-52.1	0	0	0	0	112.1	T139 F142 P143 D976 W977 F978	T139-T980 WeakPolarHBondContact CA-OG1 3.37Å; T139-T980 WeakPolarHBondContact CG2-OG1 3.42Å; F142-T980 HydrophobicContact CD1-CG2 4.15Å; P143-T980 HydrophobicContact CG-CG2 4.43Å; D976-T980 PolarHBondContact O-N 3.38Å; D976-T980 VanDerWaalsContact O-N 3.14Å; D976-T980 PolarHBondContact O-OG1 3.05Å; W977-T980 PolarHBondContact O-N 3.04Å; F978-T980 VanDerWaalsContact C-N 3.3Å; F978-T980 PolarHBondContact O-N 3.39Å
981	L	87.3	Confident	87.4	Confident	46 Å²	46	41.6 Å²	41.6	24%	0.241	21%	0.208	C	C	.	.	H	α-helix	trans	-86	-19.2	-173.9	-67.1	175.3	0	0	0	113.9	W977 F978 N983 L984 A985 Y986	W977-L981 VanDerWaalsContact O-CB 3.31Å; W977-L981 WeakPolarHBondContact O-CB 3.41Å; W977-L981 VanDerWaalsContact O-CG 3.32Å; W977-L981 WeakPolarHBondContact O-CG 3.27Å; W977-L981 PolarHBondContact O-N 3.46Å; F978-L981 PolarHBondContact O-N 3.25Å; L981-N983 PolarHBondContact O-N 2.76Å; L981-L984 PolarHBondContact O-N 3.46Å; L981-A985 PolarHBondContact O-N 3.32Å; L981-Y986 HydrophobicContact CB-CD2 3.95Å; L981-Y986 HydrophobicContact CB-CE2 3.56Å; L981-Y986 HydrophobicContact CD1-CE2 4.31Å; L981-Y986 PolarHBondContact O-N 2.98Å; L981-Y986 VanDerWaalsContact O-N 3.14Å
982	Y	87.7	Confident	87.5	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	20%	0.198	C	C	.	.	I	π-helix	trans	-57	-49.9	-176.9	176.5	-100	0	0	0	112.6	K951 F955 F978 S987 L1074 V1075	K951-Y982 PolarHBondContact O-OH 2.92Å; F955-Y982 HydrophobicContact CB-CD1 4.09Å; F955-Y982 HydrophobicContact CB-CE1 3.5Å; F955-Y982 HydrophobicContact CD1-CD1 4.34Å; F955-Y982 AromaticContact CD2-CD1 3.44Å; F955-Y982 HydrophobicContact CD2-CD1 3.44Å; F955-Y982 VanDerWaalsContact CD2-CD1 3.44Å; F955-Y982 AromaticContact CD2-CD2 3.95Å; F955-Y982 HydrophobicContact CD2-CD2 3.95Å; F955-Y982 AromaticContact CD2-CE1 3.69Å; F955-Y982 HydrophobicContact CD2-CE1 3.69Å; F955-Y982 HydrophobicContact CD2-CE2 4.16Å; F955-Y982 AromaticContact CD2-CG 3.58Å; F955-Y982 HydrophobicContact CD2-CG 3.58Å; F955-Y982 AromaticContact CE2-CD1 3.92Å; F955-Y982 HydrophobicContact CE2-CD1 3.92Å; F955-Y982 HydrophobicContact CE2-CD2 4.37Å; F955-Y982 AromaticContact CE2-CG 3.8Å; F955-Y982 HydrophobicContact CE2-CG 3.8Å; F955-Y982 AromaticContact CG-CD1 3.69Å; F955-Y982 HydrophobicContact CG-CD1 3.69Å; F955-Y982 AromaticContact CG-CE1 3.65Å; F955-Y982 HydrophobicContact CG-CE1 3.65Å; F955-Y982 HydrophobicContact CG-CG 4.31Å; F978-Y982 HydrophobicContact CE1-CD2 4.14Å; F978-Y982 HydrophobicContact CE2-CD2 4.42Å; F978-Y982 AromaticContact CZ-CD2 3.74Å; F978-Y982 HydrophobicContact CZ-CD2 3.74Å; F978-Y982 HydrophobicContact CZ-CE2 4.46Å; F978-Y982 WeakPolarHBondContact O-CB 3.47Å; F978-Y982 PolarHBondContact O-N 3.24Å; Y982-S987 PolarHBondContact O-N 2.85Å; Y982-S987 VanDerWaalsContact O-N 3.13Å; Y982-S987 PolarHBondContact O-OG 3.19Å; Y982-L1074 HydrophobicContact CD2-CD2 4.22Å; Y982-L1074 HydrophobicContact CE2-CD2 3.57Å; Y982-L1074 HydrophobicContact CE2-CG 3.91Å; Y982-V1075 HydrophobicContact CD2-CG2 4.39Å; Y982-V1075 HydrophobicContact CE2-CG2 4.42Å
983	N	79.9	Confident	87.5	Confident	19 Å²	19	42 Å²	42	10%	0.102	21%	0.212	C	C	.	.	I	π-helix	trans	-84.3	-14.6	-177	-88.3	-29	0	0	0	114.3	S399 K951 N952 L981	S399-N983 PolarHBondContact OG-O 2.84Å; K951-N983 PolarHBondContact NZ-OD1 3.34Å; N952-N983 VanDerWaalsContact OD1-CG 3.29Å; N952-N983 PolarHBondContact OD1-ND2 3.06Å; N952-N983 PolarHBondContact OD1-OD1 3.42Å; L981-N983 PolarHBondContact O-N 2.76Å
984	L	79.1	Confident	87.6	Confident	56 Å²	56	43.1 Å²	43.1	29%	0.293	22%	0.218	S	C	.	.	I	π-helix	trans	-97.7	-40.6	-179.3	-175.9	65.4	0	0	0	112.9	F142 I146 L981 S988	F142-L984 HydrophobicContact CD1-CD2 4.05Å; F142-L984 HydrophobicContact CE1-CD2 3.48Å; F142-L984 VanDerWaalsContact CE1-CD2 3.48Å; F142-L984 HydrophobicContact CZ-CD2 4.49Å; I146-L984 HydrophobicContact CD1-CD1 4.35Å; I146-L984 HydrophobicContact CD1-CD2 3.74Å; I146-L984 HydrophobicContact CG2-CD1 4.36Å; L981-L984 PolarHBondContact O-N 3.46Å; L984-S988 VanDerWaalsContact C-OG 3.23Å; L984-S988 WeakPolarHBondContact O-CB 3.2Å; L984-S988 PolarHBondContact O-OG 3.43Å
985	A	83.3	Confident	87.6	Confident	50 Å²	50	43.1 Å²	43.1	41%	0.413	22%	0.218	S	C	.	.	I	π-helix	trans	-123.7	-56.8	-171.2	0	0	0	0	0	113.2	L981 S987 S988	L981-A985 PolarHBondContact O-N 3.32Å; A985-S987 VanDerWaalsContact C-N 3.35Å; A985-S987 PolarHBondContact O-N 3.09Å; A985-S988 PolarHBondContact O-OG 3.03Å
986	Y	87.6	Confident	87.7	Confident	106 Å²	106	39.5 Å²	39.5	42%	0.416	20%	0.202	S	C	.	.	I	π-helix	trans	-68.1	-29.7	-166.2	-62.5	-47.5	0	0	0	114.9	F978 L981 N1079	F978-Y986 AromaticContact CD2-CD2 3.89Å; F978-Y986 HydrophobicContact CD2-CD2 3.89Å; F978-Y986 AromaticContact CD2-CE2 3.76Å; F978-Y986 HydrophobicContact CD2-CE2 3.76Å; F978-Y986 AromaticContact CE2-CD2 3.86Å; F978-Y986 HydrophobicContact CE2-CD2 3.86Å; F978-Y986 HydrophobicContact CE2-CE2 4.16Å; L981-Y986 HydrophobicContact CB-CD2 3.95Å; L981-Y986 HydrophobicContact CB-CE2 3.56Å; L981-Y986 HydrophobicContact CD1-CE2 4.31Å; L981-Y986 PolarHBondContact O-N 2.98Å; L981-Y986 VanDerWaalsContact O-N 3.14Å; Y986-N1079 PolarHBondContact O-ND2 3.44Å
987	S	86.6	Confident	88	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-125.3	-0.5	-176.2	70.4	0	0	0	0	114.4	K951 Y982 A985 V991	K951-S987 PolarHBondContact NZ-OG 3.27Å; Y982-S987 PolarHBondContact O-N 2.85Å; Y982-S987 VanDerWaalsContact O-N 3.13Å; Y982-S987 PolarHBondContact O-OG 3.19Å; A985-S987 VanDerWaalsContact C-N 3.35Å; A985-S987 PolarHBondContact O-N 3.09Å; S987-V991 VanDerWaalsContact O-CG2 3.31Å; S987-V991 WeakPolarHBondContact O-CG2 3.26Å
988	S	84.8	Confident	88.2	Confident	21 Å²	21	37.6 Å²	37.6	15%	0.147	20%	0.202	C	C	.	.	H	α-helix	trans	-80.9	-48.4	-174.3	59.1	0	0	0	0	112.1	L984 A985 V991 L992	L984-S988 VanDerWaalsContact C-OG 3.23Å; L984-S988 WeakPolarHBondContact O-CB 3.2Å; L984-S988 PolarHBondContact O-OG 3.43Å; A985-S988 PolarHBondContact O-OG 3.03Å; S988-V991 PolarHBondContact O-N 3.45Å; S988-L992 VanDerWaalsContact O-CB 3.31Å; S988-L992 WeakPolarHBondContact O-CB 3.45Å; S988-L992 PolarHBondContact O-N 3.17Å
989	L	88	Confident	88.3	Confident	106 Å²	106	41.4 Å²	41.4	56%	0.555	22%	0.22	S	C	*	.	H	α-helix	trans	-61.5	-47.9	-172.8	-179.5	66.6	0	0	0	113.1	V991 L992 L993	L989-V991 VanDerWaalsContact C-N 3.32Å; L989-V991 PolarHBondContact O-N 3.15Å; L989-L992 PolarHBondContact O-N 2.88Å; L989-L993 HydrophobicContact CD1-CD1 4.36Å; L989-L993 HydrophobicContact CD1-CG 4.17Å; L989-L993 HydrophobicContact CG-CD1 4.14Å; L989-L993 HydrophobicContact CG-CG 4.37Å; L989-L993 WeakPolarHBondContact O-CG 3.45Å; L989-L993 PolarHBondContact O-N 3.02Å
990	P	89.9	Confident	88.4	Confident	40 Å²	40	43.9 Å²	43.9	26%	0.26	23%	0.234	S	C	.	.	H	α-helix	trans	-60.9	-40.8	180	-26.3	38	0	0	0	112.9	L993 V994 V1082	P990-L993 PolarHBondContact O-N 3.4Å; P990-V994 WeakPolarHBondContact O-CG2 3.36Å; P990-V994 PolarHBondContact O-N 2.97Å; P990-V994 VanDerWaalsContact O-N 3.09Å; P990-V1082 HydrophobicContact CB-CG1 4.12Å
991	V	90.1	Very high	88.8	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-69.6	-37.9	179.9	-172.4	0	0	0	0	110.5	F944 F947 F948 K951 S987 S988 L989 V994 G995 V1082	F944-V991 HydrophobicContact CD2-CG1 3.58Å; F944-V991 HydrophobicContact CE2-CG1 3.78Å; F944-V991 HydrophobicContact CG-CG1 4.49Å; F947-V991 HydrophobicContact CB-CG1 4.12Å; F948-V991 HydrophobicContact CB-CG1 4.23Å; F948-V991 HydrophobicContact CD2-CG1 4.34Å; K951-V991 HydrophobicContact CD-CG2 3.99Å; S987-V991 VanDerWaalsContact O-CG2 3.31Å; S987-V991 WeakPolarHBondContact O-CG2 3.26Å; S988-V991 PolarHBondContact O-N 3.45Å; L989-V991 VanDerWaalsContact C-N 3.32Å; L989-V991 PolarHBondContact O-N 3.15Å; V991-V994 PolarHBondContact O-N 3.14Å; V991-G995 PolarHBondContact O-N 3.06Å; V991-V1082 HydrophobicContact CG2-CG2 3.85Å
992	L	91	Very high	89.2	Confident	34 Å²	34	47 Å²	47	18%	0.178	25%	0.251	C	S	.	.	H	α-helix	trans	-65.3	-41.1	174.9	-169.1	150.9	0	0	0	111.8	V406 I407 S988 L989 V994 G995 L996	V406-L992 HydrophobicContact CB-CD1 4.41Å; V406-L992 HydrophobicContact CG1-CD1 3.99Å; V406-L992 HydrophobicContact CG1-CD2 4.42Å; I407-L992 HydrophobicContact CG1-CG 4.48Å; S988-L992 VanDerWaalsContact O-CB 3.31Å; S988-L992 WeakPolarHBondContact O-CB 3.45Å; S988-L992 PolarHBondContact O-N 3.17Å; L989-L992 PolarHBondContact O-N 2.88Å; L992-V994 VanDerWaalsContact C-N 3.34Å; L992-V994 PolarHBondContact O-N 2.87Å; L992-G995 CarbonylContact O-C 3.57Å; L992-G995 WeakPolarHBondContact O-CA 3.28Å; L992-G995 PolarHBondContact O-N 3.47Å; L992-G995 VanDerWaalsContact O-N 3.09Å; L992-L996 HydrophobicContact CD2-CD1 3.47Å; L992-L996 VanDerWaalsContact CD2-CD1 3.47Å; L992-L996 HydrophobicContact CD2-CG 4.16Å; L992-L996 PolarHBondContact O-N 3.21Å
993	L	92.1	Very high	89.5	Confident	77 Å²	77	48.7 Å²	48.7	40%	0.403	26%	0.26	S	S	.	.	H	α-helix	trans	-62.8	-39.5	175.2	-71.3	174.4	0	0	0	112	L989 P990 G995 L996 L997	L989-L993 HydrophobicContact CD1-CD1 4.36Å; L989-L993 HydrophobicContact CD1-CG 4.17Å; L989-L993 HydrophobicContact CG-CD1 4.14Å; L989-L993 HydrophobicContact CG-CG 4.37Å; L989-L993 WeakPolarHBondContact O-CG 3.45Å; L989-L993 PolarHBondContact O-N 3.02Å; P990-L993 PolarHBondContact O-N 3.4Å; L993-G995 VanDerWaalsContact C-N 3.31Å; L993-G995 PolarHBondContact O-N 3.45Å; L993-L996 PolarHBondContact O-N 3.02Å; L993-L997 HydrophobicContact CD2-CD1 3.97Å; L993-L997 PolarHBondContact O-N 3.38Å
994	V	91.8	Very high	90.1	Very high	24 Å²	24	53 Å²	53	15%	0.145	28%	0.28	C	S	.	.	H	α-helix	trans	-61.9	-40.4	171.5	171	0	0	0	0	111.1	K943 F947 P990 V991 L992 L996 D998 V1082	K943-V994 HydrophobicContact CB-CG1 4.15Å; F947-V994 HydrophobicContact CD2-CG1 4.49Å; P990-V994 WeakPolarHBondContact O-CG2 3.36Å; P990-V994 PolarHBondContact O-N 2.97Å; P990-V994 VanDerWaalsContact O-N 3.09Å; V991-V994 PolarHBondContact O-N 3.14Å; L992-V994 VanDerWaalsContact C-N 3.34Å; L992-V994 PolarHBondContact O-N 2.87Å; V994-L996 VanDerWaalsContact C-N 3.27Å; V994-L996 PolarHBondContact O-N 3.01Å; V994-D998 HydrophobicContact CG1-CB 4.19Å; V994-D998 WeakPolarHBondContact O-CB 3.46Å; V994-V1082 HydrophobicContact CG2-CG1 3.62Å
995	G	90.9	Very high	90.8	Very high	0 Å²	0	54 Å²	54	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-65.6	-25	175.8	0	0	0	0	0	114.8	I407 Q411 R940 V991 L992 L993	I407-G995 VanDerWaalsContact CG2-O 3.32Å; I407-G995 WeakPolarHBondContact CG2-O 3.09Å; Q411-G995 PolarHBondContact NE2-O 2.97Å; Q411-G995 VanDerWaalsContact NE2-O 3.14Å; R940-G995 WeakPolarHBondContact CB-O 3.45Å; R940-G995 WeakPolarHBondContact CD-O 3.16Å; V991-G995 PolarHBondContact O-N 3.06Å; L992-G995 CarbonylContact O-C 3.57Å; L992-G995 WeakPolarHBondContact O-CA 3.28Å; L992-G995 PolarHBondContact O-N 3.47Å; L992-G995 VanDerWaalsContact O-N 3.09Å; L993-G995 VanDerWaalsContact C-N 3.31Å; L993-G995 PolarHBondContact O-N 3.45Å
996	L	93	Very high	91.3	Very high	25 Å²	25	51.7 Å²	51.7	13%	0.131	27%	0.266	C	S	.	.	H	α-helix	trans	-98.3	-48.8	-177.8	-75.8	179.9	0	0	0	113.9	I407 R940 L992 L993 V994	I407-L996 HydrophobicContact CB-CD2 4.47Å; I407-L996 HydrophobicContact CG1-CG 4.4Å; I407-L996 WeakPolarHBondContact O-CD2 3.31Å; R940-L996 PolarHBondContact NE-O 3.25Å; R940-L996 PolarHBondContact NH1-O 3.05Å; L992-L996 HydrophobicContact CD2-CD1 3.47Å; L992-L996 VanDerWaalsContact CD2-CD1 3.47Å; L992-L996 HydrophobicContact CD2-CG 4.16Å; L992-L996 PolarHBondContact O-N 3.21Å; L993-L996 PolarHBondContact O-N 3.02Å; V994-L996 VanDerWaalsContact C-N 3.27Å; V994-L996 PolarHBondContact O-N 3.01Å
997	L	93.5	Very high	91.6	Very high	100 Å²	100	48.6 Å²	48.6	52%	0.524	26%	0.257	S	S	.	.	H	α-helix	trans	-108.7	-13.8	-162.3	-58.5	-179.7	0	0	0	114.1	F414 L993	F414-L997 HydrophobicContact CE2-CD2 4.07Å; F414-L997 HydrophobicContact CZ-CD2 3.71Å; L993-L997 HydrophobicContact CD2-CD1 3.97Å; L993-L997 PolarHBondContact O-N 3.38Å
998	D	92.7	Very high	91.9	Very high	46 Å²	46	55.8 Å²	55.8	25%	0.246	29%	0.288	C	S	.	.			trans	-63.5	141.4	-173.6	-170.9	43	0	0	0	112.3	R940 K943 V994	R940-D998 HydrophobicContact CG-CB 4.35Å; R940-D998 VanDerWaalsContact CZ-O 3.28Å; R940-D998 PolarHBondContact NE-O 3.35Å; R940-D998 PolarHBondContact NH2-O 3.01Å; K943-D998 WeakPolarHBondContact CD-OD2 3.3Å; K943-D998 WeakPolarHBondContact CE-OD2 3.15Å; K943-D998 IonicContact NZ-OD2 2.78Å; K943-D998 PolarHBondContact NZ-OD2 3.03Å; V994-D998 HydrophobicContact CG1-CB 4.19Å; V994-D998 WeakPolarHBondContact O-CB 3.46Å
999	Q	92	Very high	92.4	Very high	103 Å²	103	57.5 Å²	57.5	48%	0.481	30%	0.297	S	S	.	.			trans	-136.4	123.5	177.6	-67.9	179.5	17.2	0	0	108.3	W936	W936-Q999 HydrophobicContact CD2-CG 4.42Å; W936-Q999 HydrophobicContact CH2-CG 4.45Å; W936-Q999 HydrophobicContact CZ2-CG 4.05Å
1000	D	90.8	Very high	92.7	Very high	64 Å²	64	52.9 Å²	52.9	34%	0.342	27%	0.274	S	S	.	.	S	Bend	trans	-71.4	-46	174.9	61.9	-32.3	0	0	0	111.1	R935 W936 I939	R935-D1000 IonicContact CZ-OD1 3.74Å; R935-D1000 IonicContact CZ-OD2 2.78Å; R935-D1000 IonicContact NE-OD1 2.74Å; R935-D1000 IonicContact NE-OD2 3.75Å; R935-D1000 PolarHBondContact NE-OD2 2.94Å; R935-D1000 IonicContact NH2-OD1 3.89Å; R935-D1000 PolarHBondContact NH2-OD1 3.03Å; R935-D1000 IonicContact NH2-OD2 3.92Å; W936-D1000 VanDerWaalsContact CD1-OD1 3.25Å; W936-D1000 PolarHBondContact NE1-OD1 3.09Å; I939-D1000 HydrophobicContact CD1-CB 4.31Å; I939-D1000 WeakPolarHBondContact CD1-OD2 3.45Å
1001	V	93.8	Very high	92.9	Very high	37 Å²	37	54.6 Å²	54.6	22%	0.224	28%	0.283	C	S	.	.	S	Bend	trans	-141.6	160	174.4	-58.6	0	0	0	0	109.4	W936 L1005 L1012	W936-V1001 WeakPolarHBondContact CZ2-O 3.4Å; W936-V1001 PolarHBondContact NE1-O 3.09Å; V1001-L1005 HydrophobicContact CB-CB 4.49Å; V1001-L1005 HydrophobicContact CB-CD2 3.76Å; V1001-L1005 HydrophobicContact CG1-CD2 3.7Å; V1001-L1005 HydrophobicContact CG2-CD2 4.23Å; V1001-L1012 HydrophobicContact CG2-CD1 4.03Å
1002	N	94.5	Very high	93.2	Very high	78 Å²	78	57.6 Å²	57.6	42%	0.417	30%	0.299	S	S	.	.			trans	-67.2	166.4	176.3	70.8	-5.8	0	0	0	112.2	L1005 S1006	N1002-L1005 WeakPolarHBondContact OD1-CB 3.48Å; N1002-L1005 PolarHBondContact OD1-N 3.04Å; N1002-S1006 VanDerWaalsContact O-CB 3.3Å; N1002-S1006 WeakPolarHBondContact O-CB 3.34Å; N1002-S1006 PolarHBondContact O-N 2.88Å; N1002-S1006 VanDerWaalsContact O-N 3.11Å
1003	D	93.5	Very high	93.3	Very high	36 Å²	36	56.1 Å²	56.1	19%	0.193	29%	0.291	C	S	.	.	H	α-helix	trans	-66.7	-35.5	-178.1	61.5	-28.3	0	0	0	113	Q420 R928 V932 W936 S1006 L1007	Q420-D1003 PolarHBondContact NE2-OD2 3.03Å; R928-D1003 IonicContact CZ-OD2 3.44Å; R928-D1003 IonicContact NH1-OD2 2.65Å; R928-D1003 PolarHBondContact NH1-OD2 3.45Å; R928-D1003 IonicContact NH2-OD2 3.76Å; R928-D1003 PolarHBondContact NH2-OD2 2.54Å; R928-D1003 VanDerWaalsContact NH2-OD2 3.07Å; V932-D1003 HydrophobicContact CG1-CB 3.74Å; V932-D1003 HydrophobicContact CG2-CB 4.13Å; W936-D1003 HydrophobicContact CH2-CB 3.78Å; W936-D1003 HydrophobicContact CZ2-CB 4.12Å; D1003-S1006 VanDerWaalsContact O-CB 3.29Å; D1003-S1006 WeakPolarHBondContact O-CB 3.43Å; D1003-S1006 PolarHBondContact O-N 3.27Å; D1003-L1007 PolarHBondContact O-N 3.47Å; D1003-L1007 VanDerWaalsContact O-N 3.13Å
1004	E	93.6	Very high	93.4	Very high	111 Å²	111	55.4 Å²	55.4	52%	0.519	29%	0.287	S	S	.	.	H	α-helix	trans	-63.7	-47.2	175.5	-68.6	-170.8	-167.4	0	0	113.1	S1006 L1007 K1008	E1004-S1006 VanDerWaalsContact C-N 3.28Å; E1004-S1006 PolarHBondContact O-N 3.45Å; E1004-L1007 PolarHBondContact O-N 2.86Å; E1004-K1008 WeakPolarHBondContact O-CG 3.5Å; E1004-K1008 PolarHBondContact O-N 3.09Å; E1004-K1008 IonicContact OE2-NZ 3.1Å; E1004-K1008 PolarHBondContact OE2-NZ 3.33Å
1005	L	94.4	Very high	93.3	Very high	77 Å²	77	56.5 Å²	56.5	40%	0.403	30%	0.295	S	S	.	.	H	α-helix	trans	-67.6	-35.5	179.9	-165.6	94	0	0	0	110.6	V1001 N1002 L1007 K1008 V1009	V1001-L1005 HydrophobicContact CB-CB 4.49Å; V1001-L1005 HydrophobicContact CB-CD2 3.76Å; V1001-L1005 HydrophobicContact CG1-CD2 3.7Å; V1001-L1005 HydrophobicContact CG2-CD2 4.23Å; N1002-L1005 WeakPolarHBondContact OD1-CB 3.48Å; N1002-L1005 PolarHBondContact OD1-N 3.04Å; L1005-L1007 VanDerWaalsContact C-N 3.31Å; L1005-L1007 PolarHBondContact O-N 2.94Å; L1005-K1008 PolarHBondContact O-N 2.87Å; L1005-V1009 PolarHBondContact O-N 3.4Å
1006	S	93.5	Very high	93.3	Very high	1 Å²	1	56.7 Å²	56.7	1%	0.007	30%	0.297	C	S	.	.	H	α-helix	trans	-54.7	-43.9	172	163.3	0	0	0	0	112.6	L931 V932 R935 N1002 D1003 E1004	L931-S1006 PolarHBondContact O-OG 3.33Å; V932-S1006 WeakPolarHBondContact CG2-OG 3.16Å; R935-S1006 PolarHBondContact NH1-OG 3.46Å; N1002-S1006 VanDerWaalsContact O-CB 3.3Å; N1002-S1006 WeakPolarHBondContact O-CB 3.34Å; N1002-S1006 PolarHBondContact O-N 2.88Å; N1002-S1006 VanDerWaalsContact O-N 3.11Å; D1003-S1006 VanDerWaalsContact O-CB 3.29Å; D1003-S1006 WeakPolarHBondContact O-CB 3.43Å; D1003-S1006 PolarHBondContact O-N 3.27Å; E1004-S1006 VanDerWaalsContact C-N 3.28Å; E1004-S1006 PolarHBondContact O-N 3.45Å
1007	L	93.2	Very high	93.1	Very high	41 Å²	41	56.8 Å²	56.8	22%	0.215	30%	0.297	C	S	.	.	H	α-helix	trans	-76.9	-35.8	177.1	-69	171.8	0	0	0	112.5	Q927 L931 V932 D1003 E1004 L1005 V1009	Q927-L1007 HydrophobicContact CB-CD2 4.5Å; L931-L1007 HydrophobicContact CB-CD2 4.29Å; L931-L1007 HydrophobicContact CD1-CD2 4.23Å; V932-L1007 HydrophobicContact CG2-CD1 4.43Å; V932-L1007 HydrophobicContact CG2-CD2 4.13Å; V932-L1007 HydrophobicContact CG2-CG 3.96Å; D1003-L1007 PolarHBondContact O-N 3.47Å; D1003-L1007 VanDerWaalsContact O-N 3.13Å; E1004-L1007 PolarHBondContact O-N 2.86Å; L1005-L1007 VanDerWaalsContact C-N 3.31Å; L1005-L1007 PolarHBondContact O-N 2.94Å; L1007-V1009 VanDerWaalsContact C-N 3.32Å; L1007-V1009 PolarHBondContact O-N 3.42Å
1008	K	93.5	Very high	92.8	Very high	151 Å²	151	59 Å²	59	66%	0.657	31%	0.305	S	S	*	.	H	α-helix	trans	-67.3	-30.6	177.3	-74.3	171.1	-178.3	163.1	0	113	E1004 L1005 P1010	E1004-K1008 WeakPolarHBondContact O-CG 3.5Å; E1004-K1008 PolarHBondContact O-N 3.09Å; E1004-K1008 IonicContact OE2-NZ 3.1Å; E1004-K1008 PolarHBondContact OE2-NZ 3.33Å; L1005-K1008 PolarHBondContact O-N 2.87Å; K1008-P1010 WeakPolarHBondContact O-CD 3.32Å
1009	V	95	Very high	92.5	Very high	57 Å²	57	57.7 Å²	57.7	35%	0.345	30%	0.302	S	S	.	.			trans	-123.9	75.7	-178	-168.1	0	0	0	0	110.9	L1005 L1007 T1011 L1012	L1005-V1009 PolarHBondContact O-N 3.4Å; L1007-V1009 VanDerWaalsContact C-N 3.32Å; L1007-V1009 PolarHBondContact O-N 3.42Å; V1009-T1011 WeakPolarHBondContact CG1-OG1 3.19Å; V1009-T1011 PolarHBondContact O-N 3.5Å; V1009-T1011 VanDerWaalsContact O-N 3.1Å; V1009-L1012 HydrophobicContact CB-CD1 4.21Å; V1009-L1012 HydrophobicContact CB-CG 4.32Å; V1009-L1012 HydrophobicContact CG1-CD1 4.43Å; V1009-L1012 HydrophobicContact CG1-CG 4.05Å; V1009-L1012 PolarHBondContact O-N 3.04Å
1010	P	94.5	Very high	92	Very high	9 Å²	9	55 Å²	55	6%	0.058	30%	0.295	C	S	.	.	G	3₁₀ helix	trans	-62.2	-20.5	-177.2	-23.5	34	0	0	0	114.6	N717 K720 A721 L931 K1008 L1012 Y1013	N717-P1010 HydrophobicContact CB-CG 4.26Å; N717-P1010 VanDerWaalsContact O-CB 3.29Å; N717-P1010 WeakPolarHBondContact O-CB 3.39Å; K720-P1010 HydrophobicContact CB-CB 4.15Å; K720-P1010 HydrophobicContact CB-CG 4.26Å; A721-P1010 WeakPolarHBondContact CA-O 3.33Å; A721-P1010 HydrophobicContact CB-CB 3.87Å; A721-P1010 WeakPolarHBondContact CB-O 3.3Å; L931-P1010 HydrophobicContact CD1-CB 4.02Å; L931-P1010 HydrophobicContact CD1-CG 4.26Å; L931-P1010 HydrophobicContact CD2-CB 4.4Å; K1008-P1010 WeakPolarHBondContact O-CD 3.32Å; P1010-L1012 PolarHBondContact O-N 3.48Å; P1010-L1012 VanDerWaalsContact O-N 3.13Å; P1010-Y1013 VanDerWaalsContact O-CB 3.27Å; P1010-Y1013 WeakPolarHBondContact O-CB 3.35Å; P1010-Y1013 PolarHBondContact O-N 3.32Å; P1010-Y1013 VanDerWaalsContact O-N 3.09Å
1011	T	94.4	Very high	91.7	Very high	75 Å²	75	55.4 Å²	55.4	46%	0.46	30%	0.297	S	S	.	.	G	3₁₀ helix	trans	-62.7	-18.3	178.7	54.7	0	0	0	0	113.5	V1009 Y1013 L1014	V1009-T1011 WeakPolarHBondContact CG1-OG1 3.19Å; V1009-T1011 PolarHBondContact O-N 3.5Å; V1009-T1011 VanDerWaalsContact O-N 3.1Å; T1011-Y1013 PolarHBondContact O-N 3.46Å; T1011-Y1013 VanDerWaalsContact O-N 3.09Å; T1011-L1014 WeakPolarHBondContact O-CG 3.48Å; T1011-L1014 PolarHBondContact O-N 3.32Å
1012	L	94.4	Very high	91.1	Very high	64 Å²	64	54.1 Å²	54.1	34%	0.335	29%	0.288	S	S	.	.	G	3₁₀ helix	trans	-62.3	-12.1	172.7	-67.2	176.6	0	0	0	113.4	R935 V1001 V1009 P1010 P1015	R935-L1012 VanDerWaalsContact CD-O 3.3Å; R935-L1012 WeakPolarHBondContact CD-O 3.38Å; V1001-L1012 HydrophobicContact CG2-CD1 4.03Å; V1009-L1012 HydrophobicContact CB-CD1 4.21Å; V1009-L1012 HydrophobicContact CB-CG 4.32Å; V1009-L1012 HydrophobicContact CG1-CD1 4.43Å; V1009-L1012 HydrophobicContact CG1-CG 4.05Å; V1009-L1012 PolarHBondContact O-N 3.04Å; P1010-L1012 PolarHBondContact O-N 3.48Å; P1010-L1012 VanDerWaalsContact O-N 3.13Å; L1012-P1015 VanDerWaalsContact O-CD 3.29Å; L1012-P1015 WeakPolarHBondContact O-CD 3.32Å
1013	Y	94.9	Very high	90.7	Very high	3 Å²	3	52.7 Å²	52.7	1%	0.012	28%	0.28	C	S	.	.	G	3₁₀ helix	trans	-77.4	-25.9	177.4	-168.1	-95.1	0	0	0	113.7	L441 G442 Q443 I444 A721 I723 L930 L931 R935 P1010 T1011 G1016 Q1017	L441-Y1013 PolarHBondContact O-OH 3.06Å; G442-Y1013 VanDerWaalsContact C-OH 3.22Å; Q443-Y1013 PolarHBondContact N-OH 2.9Å; I444-Y1013 WeakPolarHBondContact CB-OH 3.46Å; I444-Y1013 PolarHBondContact N-OH 3.19Å; I444-Y1013 WeakPolarHBondContact O-CE1 3.14Å; A721-Y1013 HydrophobicContact CB-CD1 4.42Å; A721-Y1013 HydrophobicContact CB-CG 4.4Å; I723-Y1013 HydrophobicContact CD1-CD1 4.14Å; I723-Y1013 HydrophobicContact CD1-CE1 3.84Å; I723-Y1013 HydrophobicContact CG1-CD1 4.25Å; I723-Y1013 HydrophobicContact CG1-CE1 4.01Å; L930-Y1013 HydrophobicContact CB-CE2 4.44Å; L930-Y1013 WeakPolarHBondContact O-CE2 3.11Å; L931-Y1013 HydrophobicContact CD2-CD2 4.01Å; L931-Y1013 HydrophobicContact CD2-CG 4.13Å; R935-Y1013 HydrophobicContact CB-CD2 4.35Å; P1010-Y1013 VanDerWaalsContact O-CB 3.27Å; P1010-Y1013 WeakPolarHBondContact O-CB 3.35Å; P1010-Y1013 PolarHBondContact O-N 3.32Å; P1010-Y1013 VanDerWaalsContact O-N 3.09Å; T1011-Y1013 PolarHBondContact O-N 3.46Å; T1011-Y1013 VanDerWaalsContact O-N 3.09Å; Y1013-G1016 PolarHBondContact O-N 3.43Å; Y1013-Q1017 HydrophobicContact CD1-CG 3.83Å; Y1013-Q1017 HydrophobicContact CE1-CG 3.64Å
1014	L	92.8	Very high	90.4	Very high	61 Å²	61	55.3 Å²	55.3	32%	0.319	29%	0.288	S	S	.	.	H	α-helix	trans	-54.2	-39.5	-174.8	-66.1	170.4	0	0	0	115.5	A721 T1011 G1016 Q1017 Q1018	A721-L1014 WeakPolarHBondContact O-CD2 3.33Å; T1011-L1014 WeakPolarHBondContact O-CG 3.48Å; T1011-L1014 PolarHBondContact O-N 3.32Å; L1014-G1016 PolarHBondContact O-N 3.16Å; L1014-Q1017 PolarHBondContact O-N 2.88Å; L1014-Q1018 WeakPolarHBondContact O-CG 3.42Å; L1014-Q1018 PolarHBondContact O-N 3.42Å
1015	P	91.1	Very high	90.1	Very high	47 Å²	47	57.4 Å²	57.4	31%	0.305	30%	0.295	S	S	.	.	H	α-helix	trans	-58.5	-30.5	177.2	-25.3	36.2	0	0	0	113.7	L1012 G1019 S1020	L1012-P1015 VanDerWaalsContact O-CD 3.29Å; L1012-P1015 WeakPolarHBondContact O-CD 3.32Å; P1015-G1019 PolarHBondContact O-N 3.41Å; P1015-S1020 PolarHBondContact O-N 3.18Å; P1015-S1020 PolarHBondContact O-OG 2.94Å
1016	G	89.7	Confident	89.7	Confident	5 Å²	5	55.6 Å²	55.6	5%	0.052	29%	0.286	C	S	.	.	H	α-helix	trans	-69.1	-45.6	177.4	0	0	0	0	0	112.8	G442 Q443 Y938 Y1013 L1014 Q1018 G1019	G442-G1016 CarbonylContact O-C 3.59Å; G442-G1016 VanDerWaalsContact O-CA 3.3Å; G442-G1016 WeakPolarHBondContact O-CA 3.32Å; Q443-G1016 PolarHBondContact NE2-O 3.37Å; Y938-G1016 VanDerWaalsContact CE1-CA 3.41Å; Y1013-G1016 PolarHBondContact O-N 3.43Å; L1014-G1016 PolarHBondContact O-N 3.16Å; G1016-Q1018 VanDerWaalsContact C-N 3.28Å; G1016-Q1018 PolarHBondContact O-N 3.15Å; G1016-G1019 PolarHBondContact O-N 3.49Å
1017	Q	89.3	Confident	89.5	Confident	26 Å²	26	55.7 Å²	55.7	12%	0.121	29%	0.286	C	S	.	.	H	α-helix	trans	-61.2	-36.6	176.5	-64.4	-178.4	-26.8	0	0	112.8	I444 Q445 G722 Y1013 L1014 G1019	I444-Q1017 WeakPolarHBondContact O-CG 3.36Å; I444-Q1017 PolarHBondContact O-NE2 3.48Å; Q445-Q1017 HydrophobicContact CG-CB 4.08Å; Q445-Q1017 HydrophobicContact CG-CG 4.08Å; Q445-Q1017 PolarHBondContact NE2-O 2.79Å; Q445-Q1017 VanDerWaalsContact NE2-O 3.11Å; G722-Q1017 PolarHBondContact O-NE2 3.09Å; Y1013-Q1017 HydrophobicContact CD1-CG 3.83Å; Y1013-Q1017 HydrophobicContact CE1-CG 3.64Å; L1014-Q1017 PolarHBondContact O-N 2.88Å; Q1017-G1019 VanDerWaalsContact C-N 3.33Å
1018	Q	87.2	Confident	89.3	Confident	147 Å²	147	57.9 Å²	57.9	69%	0.687	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.4	-12.3	-179.6	-66.5	175.9	0.9	0	0	113.5	L1014 G1016 S1020	L1014-Q1018 WeakPolarHBondContact O-CG 3.42Å; L1014-Q1018 PolarHBondContact O-N 3.42Å; G1016-Q1018 VanDerWaalsContact C-N 3.28Å; G1016-Q1018 PolarHBondContact O-N 3.15Å; Q1018-S1020 VanDerWaalsContact C-N 3.25Å; Q1018-S1020 PolarHBondContact O-N 2.76Å
1019	G	85.4	Confident	89.1	Confident	18 Å²	18	54.9 Å²	54.9	19%	0.186	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	65.7	27.5	-175.5	0	0	0	0	0	113.3	Y938 P1015 G1016 Q1017 N1023	Y938-G1019 WeakPolarHBondContact OH-CA 3.49Å; P1015-G1019 PolarHBondContact O-N 3.41Å; G1016-G1019 PolarHBondContact O-N 3.49Å; Q1017-G1019 VanDerWaalsContact C-N 3.33Å; G1019-N1023 PolarHBondContact O-ND2 3.5Å
1020	S	83.4	Confident	88.9	Confident	48 Å²	48	52.4 Å²	52.4	34%	0.336	27%	0.27	S	S	.	.			trans	-74.4	-31	-171.1	63.5	0	0	0	0	113.2	P1015 Q1018 N1023 N1026	P1015-S1020 PolarHBondContact O-N 3.18Å; P1015-S1020 PolarHBondContact O-OG 2.94Å; Q1018-S1020 VanDerWaalsContact C-N 3.25Å; Q1018-S1020 PolarHBondContact O-N 2.76Å; S1020-N1023 PolarHBondContact O-ND2 3.36Å; S1020-N1023 VanDerWaalsContact O-ND2 3.15Å; S1020-N1026 PolarHBondContact O-ND2 3.47Å
1021	L	83.7	Confident	88.7	Confident	72 Å²	72	52.7 Å²	52.7	38%	0.377	27%	0.271	S	S	.	.	S	Bend	trans	-76.4	-30.2	-175.2	-62.2	-177	0	0	0	113.8	Y938 I939 C942 N1026	Y938-L1021 HydrophobicContact CD1-CD1 4.11Å; Y938-L1021 HydrophobicContact CE1-CB 3.97Å; Y938-L1021 HydrophobicContact CE1-CD1 3.74Å; Y938-L1021 HydrophobicContact CE1-CG 4.08Å; I939-L1021 HydrophobicContact CB-CD1 4.45Å; I939-L1021 HydrophobicContact CG1-CD1 3.65Å; C942-L1021 HydrophobicContact CB-CB 3.98Å; L1021-N1026 VanDerWaalsContact C-ND2 3.25Å; L1021-N1026 PolarHBondContact O-ND2 3.08Å
1022	F	80.9	Confident	88.6	Confident	10 Å²	10	55.6 Å²	55.6	4%	0.044	28%	0.277	C	S	.	.	S	Bend	trans	-141.1	111.1	178.4	-166.6	-105.6	0	0	0	111.4	L332 M336 C942 L945 F949	L332-F1022 HydrophobicContact CD2-CD1 3.49Å; L332-F1022 VanDerWaalsContact CD2-CD1 3.49Å; L332-F1022 HydrophobicContact CD2-CE1 3.69Å; L332-F1022 HydrophobicContact CG-CD1 4.43Å; L332-F1022 HydrophobicContact CG-CE1 4.16Å; M336-F1022 HydrophobicContact CE-CD1 4.35Å; M336-F1022 HydrophobicContact CE-CE1 3.58Å; M336-F1022 HydrophobicContact CE-CE2 4.33Å; M336-F1022 HydrophobicContact CE-CZ 3.57Å; M336-F1022 HydrophobicContact SD-CE1 3.68Å; M336-F1022 HydrophobicContact SD-CE2 4.42Å; M336-F1022 HydrophobicContact SD-CZ 3.39Å; M336-F1022 WeakPolarHBondContact SD-CZ 3.39Å; C942-F1022 HydrophobicContact CB-CB 3.9Å; C942-F1022 WeakPolarHBondContact SG-CB 3.46Å; L945-F1022 HydrophobicContact CB-CD2 4.14Å; L945-F1022 HydrophobicContact CB-CE1 4.38Å; L945-F1022 HydrophobicContact CB-CE2 3.54Å; L945-F1022 HydrophobicContact CB-CZ 3.69Å; L945-F1022 HydrophobicContact CD1-CD1 3.97Å; L945-F1022 HydrophobicContact CD1-CE1 3.6Å; L945-F1022 HydrophobicContact CD1-CE2 4.26Å; L945-F1022 HydrophobicContact CD1-CG 4.46Å; L945-F1022 HydrophobicContact CD1-CZ 3.76Å; L945-F1022 HydrophobicContact CG-CZ 4.3Å; F949-F1022 HydrophobicContact CD2-CZ 4.41Å; F949-F1022 HydrophobicContact CE2-CZ 4.05Å
1023	N	86.6	Confident	88.5	Confident	47 Å²	47	55.3 Å²	55.3	25%	0.251	27%	0.274	S	S	.	.	S	Bend	trans	-152.6	175.9	-179.1	55.6	52.6	0	0	0	109	G1019 S1020 K1025 N1026 F1027	G1019-N1023 PolarHBondContact O-ND2 3.5Å; S1020-N1023 PolarHBondContact O-ND2 3.36Å; S1020-N1023 VanDerWaalsContact O-ND2 3.15Å; N1023-K1025 PolarHBondContact O-N 3.25Å; N1023-K1025 WeakPolarHBondContact OD1-CA 3.41Å; N1023-K1025 VanDerWaalsContact OD1-CB 3.26Å; N1023-K1025 WeakPolarHBondContact OD1-CB 3.37Å; N1023-K1025 PolarHBondContact OD1-N 3.36Å; N1023-N1026 PolarHBondContact O-N 3.29Å; N1023-N1026 VanDerWaalsContact O-N 3.16Å; N1023-N1026 PolarHBondContact OD1-N 3.06Å; N1023-F1027 PolarHBondContact O-N 3.27Å; N1023-F1027 VanDerWaalsContact O-N 3.09Å
1024	Y	86.1	Confident	88.4	Confident	91 Å²	91	55.2 Å²	55.2	36%	0.357	27%	0.274	S	S	.	.	H	α-helix	trans	-56.4	-35.4	178.8	-89.2	-80.3	0	0	0	114	L332 Y335 F1027 F1028	L332-Y1024 HydrophobicContact CD1-CD2 3.78Å; L332-Y1024 HydrophobicContact CD1-CE2 3.69Å; Y335-Y1024 VanDerWaalsContact CB-OH 3.31Å; Y335-Y1024 WeakPolarHBondContact CB-OH 3.41Å; Y1024-F1027 WeakPolarHBondContact O-CB 3.36Å; Y1024-F1027 PolarHBondContact O-N 3.28Å; Y1024-F1028 HydrophobicContact CD1-CE2 4.4Å; Y1024-F1028 WeakPolarHBondContact O-CD2 3.39Å; Y1024-F1028 PolarHBondContact O-N 3.02Å
1025	K	88.3	Confident	88.5	Confident	156 Å²	156	54.9 Å²	54.9	68%	0.678	27%	0.272	S	S	*	.	H	α-helix	trans	-63	-46.3	177.7	-174.3	-174.2	178.2	-176.6	0	110.9	N1023 F1027 F1028 I1029	N1023-K1025 PolarHBondContact O-N 3.25Å; N1023-K1025 WeakPolarHBondContact OD1-CA 3.41Å; N1023-K1025 VanDerWaalsContact OD1-CB 3.26Å; N1023-K1025 WeakPolarHBondContact OD1-CB 3.37Å; N1023-K1025 PolarHBondContact OD1-N 3.36Å; K1025-F1027 VanDerWaalsContact C-N 3.29Å; K1025-F1027 PolarHBondContact O-N 3.42Å; K1025-F1028 PolarHBondContact O-N 3.45Å; K1025-I1029 HydrophobicContact CG-CD1 4.26Å; K1025-I1029 WeakPolarHBondContact O-CG1 3.33Å; K1025-I1029 PolarHBondContact O-N 3.14Å
1026	N	86.8	Confident	88.7	Confident	38 Å²	38	58.9 Å²	58.9	20%	0.203	28%	0.284	C	S	.	.	H	α-helix	trans	-66.9	-31.6	178.2	-66.2	-19.3	0	0	0	112.6	S1020 L1021 N1023 I1029 S1030	S1020-N1026 PolarHBondContact O-ND2 3.47Å; L1021-N1026 VanDerWaalsContact C-ND2 3.25Å; L1021-N1026 PolarHBondContact O-ND2 3.08Å; N1023-N1026 PolarHBondContact O-N 3.29Å; N1023-N1026 VanDerWaalsContact O-N 3.16Å; N1023-N1026 PolarHBondContact OD1-N 3.06Å; N1026-I1029 PolarHBondContact O-N 3.06Å; N1026-S1030 PolarHBondContact O-N 2.73Å; N1026-S1030 PolarHBondContact O-OG 3.46Å
1027	F	87.3	Confident	88.9	Confident	3 Å²	3	59.2 Å²	59.2	1%	0.013	29%	0.286	C	S	.	.	H	α-helix	trans	-61.8	-49.2	170.8	170.4	-95.7	0	0	0	111.9	M336 T339 I340 F949 F953 N1023 Y1024 K1025 I1029 S1030 L1031	M336-F1027 HydrophobicContact CB-CD2 4.36Å; M336-F1027 HydrophobicContact CB-CE2 4.27Å; M336-F1027 HydrophobicContact CE-CB 3.56Å; M336-F1027 HydrophobicContact CE-CD2 4.42Å; M336-F1027 HydrophobicContact CE-CG 4.15Å; M336-F1027 HydrophobicContact CG-CD2 4.08Å; M336-F1027 HydrophobicContact CG-CE2 4.46Å; M336-F1027 HydrophobicContact CG-CG 4.2Å; M336-F1027 HydrophobicContact SD-CB 4.04Å; M336-F1027 HydrophobicContact SD-CD2 3.75Å; M336-F1027 HydrophobicContact SD-CG 4.05Å; T339-F1027 HydrophobicContact CG2-CE1 4.45Å; I340-F1027 HydrophobicContact CD1-CE2 4Å; I340-F1027 HydrophobicContact CD1-CZ 4.09Å; I340-F1027 HydrophobicContact CG1-CE2 4.15Å; I340-F1027 HydrophobicContact CG1-CZ 3.71Å; F949-F1027 HydrophobicContact CD1-CE2 4.07Å; F949-F1027 HydrophobicContact CD2-CD2 4.15Å; F949-F1027 HydrophobicContact CD2-CE2 4.43Å; F949-F1027 HydrophobicContact CE1-CE2 4.32Å; F949-F1027 HydrophobicContact CE2-CD2 4.46Å; F949-F1027 HydrophobicContact CG-CD2 4.23Å; F949-F1027 HydrophobicContact CG-CE2 4.14Å; F953-F1027 AromaticContact CE2-CE2 3.97Å; F953-F1027 HydrophobicContact CE2-CE2 3.97Å; F953-F1027 HydrophobicContact CE2-CZ 4.23Å; F953-F1027 AromaticContact CZ-CE2 3.7Å; F953-F1027 HydrophobicContact CZ-CE2 3.7Å; F953-F1027 AromaticContact CZ-CZ 3.72Å; F953-F1027 HydrophobicContact CZ-CZ 3.72Å; N1023-F1027 PolarHBondContact O-N 3.27Å; N1023-F1027 VanDerWaalsContact O-N 3.09Å; Y1024-F1027 WeakPolarHBondContact O-CB 3.36Å; Y1024-F1027 PolarHBondContact O-N 3.28Å; K1025-F1027 VanDerWaalsContact C-N 3.29Å; K1025-F1027 PolarHBondContact O-N 3.42Å; F1027-I1029 VanDerWaalsContact C-N 3.32Å; F1027-I1029 PolarHBondContact O-N 2.93Å; F1027-S1030 WeakPolarHBondContact O-CA 3.29Å; F1027-S1030 WeakPolarHBondContact O-CB 3.28Å; F1027-S1030 PolarHBondContact O-N 3.31Å; F1027-L1031 PolarHBondContact O-N 3.12Å
1028	F	90.4	Very high	89.2	Confident	88 Å²	88	58 Å²	58	39%	0.386	28%	0.28	S	S	.	.	H	α-helix	trans	-63.8	-36.7	176	-78.8	-70.6	0	0	0	112.6	Y1024 K1025 S1030 L1031 F1032	Y1024-F1028 HydrophobicContact CD1-CE2 4.4Å; Y1024-F1028 WeakPolarHBondContact O-CD2 3.39Å; Y1024-F1028 PolarHBondContact O-N 3.02Å; K1025-F1028 PolarHBondContact O-N 3.45Å; F1028-S1030 VanDerWaalsContact C-N 3.27Å; F1028-S1030 PolarHBondContact O-N 3.45Å; F1028-L1031 HydrophobicContact CD1-CD2 4.09Å; F1028-L1031 HydrophobicContact CE1-CD2 4.37Å; F1028-L1031 WeakPolarHBondContact O-CB 3.26Å; F1028-L1031 PolarHBondContact O-N 2.75Å; F1028-F1032 HydrophobicContact CB-CD2 4.5Å; F1028-F1032 HydrophobicContact CB-CE2 4.4Å; F1028-F1032 WeakPolarHBondContact O-CD2 3.24Å; F1028-F1032 PolarHBondContact O-N 2.93Å
1029	I	89.8	Confident	89.6	Confident	87 Å²	87	54.4 Å²	54.4	45%	0.446	27%	0.265	S	S	.	.	H	α-helix	trans	-58.2	-42.9	171.5	-68.9	166.9	0	0	0	110.6	K1025 N1026 F1027 L1031 F1032 H1033	K1025-I1029 HydrophobicContact CG-CD1 4.26Å; K1025-I1029 WeakPolarHBondContact O-CG1 3.33Å; K1025-I1029 PolarHBondContact O-N 3.14Å; N1026-I1029 PolarHBondContact O-N 3.06Å; F1027-I1029 VanDerWaalsContact C-N 3.32Å; F1027-I1029 PolarHBondContact O-N 2.93Å; I1029-L1031 VanDerWaalsContact C-N 3.34Å; I1029-F1032 PolarHBondContact O-N 2.86Å; I1029-H1033 VanDerWaalsContact O-CB 3.29Å; I1029-H1033 WeakPolarHBondContact O-CB 3.45Å; I1029-H1033 PolarHBondContact O-N 3.46Å
1030	S	89.7	Confident	90	Very high	5 Å²	5	56.3 Å²	56.3	4%	0.035	27%	0.27	C	S	.	.	H	α-helix	trans	-65.9	-37	177.4	-52.2	0	0	0	0	112.1	R946 N1026 F1027 F1028 G1034	R946-S1030 VanDerWaalsContact CG-OG 3.28Å; R946-S1030 WeakPolarHBondContact CG-OG 3.24Å; N1026-S1030 PolarHBondContact O-N 2.73Å; N1026-S1030 PolarHBondContact O-OG 3.46Å; F1027-S1030 WeakPolarHBondContact O-CA 3.29Å; F1027-S1030 WeakPolarHBondContact O-CB 3.28Å; F1027-S1030 PolarHBondContact O-N 3.31Å; F1028-S1030 VanDerWaalsContact C-N 3.27Å; F1028-S1030 PolarHBondContact O-N 3.45Å; S1030-G1034 PolarHBondContact O-N 2.86Å
1031	L	90.8	Very high	90.6	Very high	15 Å²	15	54.2 Å²	54.2	8%	0.079	26%	0.255	C	S	.	.	H	α-helix	trans	-63.7	-51.3	173.4	179	63.7	0	0	0	111.6	L343 M395 F953 F1027 F1028 I1029 H1033 G1034 I1035	L343-L1031 HydrophobicContact CD2-CD1 4.4Å; L343-L1031 HydrophobicContact CD2-CD2 4.05Å; M395-L1031 HydrophobicContact CE-CD1 4.44Å; F953-L1031 HydrophobicContact CB-CD1 4.41Å; F953-L1031 HydrophobicContact CD1-CD1 3.77Å; F953-L1031 HydrophobicContact CD2-CB 4.08Å; F953-L1031 HydrophobicContact CD2-CD1 3.79Å; F953-L1031 HydrophobicContact CE1-CD1 3.9Å; F953-L1031 HydrophobicContact CE2-CB 3.91Å; F953-L1031 HydrophobicContact CE2-CD1 3.89Å; F953-L1031 HydrophobicContact CG-CD1 3.73Å; F953-L1031 HydrophobicContact CZ-CD1 3.95Å; F1027-L1031 PolarHBondContact O-N 3.12Å; F1028-L1031 HydrophobicContact CD1-CD2 4.09Å; F1028-L1031 HydrophobicContact CE1-CD2 4.37Å; F1028-L1031 WeakPolarHBondContact O-CB 3.26Å; F1028-L1031 PolarHBondContact O-N 2.75Å; I1029-L1031 VanDerWaalsContact C-N 3.34Å; L1031-H1033 VanDerWaalsContact C-N 3.29Å; L1031-H1033 PolarHBondContact O-N 2.92Å; L1031-G1034 PolarHBondContact O-N 3.41Å; L1031-G1034 VanDerWaalsContact O-N 3.15Å; L1031-I1035 HydrophobicContact CD1-CD1 4.41Å; L1031-I1035 HydrophobicContact CG-CD1 4.1Å; L1031-I1035 WeakPolarHBondContact O-CG1 3.45Å; L1031-I1035 PolarHBondContact O-N 3.35Å
1032	F	92.9	Very high	91.1	Very high	136 Å²	136	50.8 Å²	50.8	60%	0.596	24%	0.237	S	C	*	.	H	α-helix	trans	-60.9	-39.5	177.2	-76.9	-64.6	0	0	0	112.3	F1028 I1029 I1035 F1036	F1028-F1032 HydrophobicContact CB-CD2 4.5Å; F1028-F1032 HydrophobicContact CB-CE2 4.4Å; F1028-F1032 WeakPolarHBondContact O-CD2 3.24Å; F1028-F1032 PolarHBondContact O-N 2.93Å; I1029-F1032 PolarHBondContact O-N 2.86Å; F1032-I1035 HydrophobicContact CD1-CD1 4.31Å; F1032-I1035 PolarHBondContact O-N 3.39Å; F1032-F1036 PolarHBondContact O-N 3.43Å
1033	H	92.1	Very high	91.7	Very high	59 Å²	59	54.1 Å²	54.1	27%	0.273	25%	0.252	S	S	.	.	H	α-helix	trans	-63.7	-43.2	174.8	-171.4	-160	0	0	0	111.5	F950 I1029 L1031 F1036 V1037	F950-H1033 HydrophobicContact CD2-CB 4.08Å; F950-H1033 AromaticContact CD2-CG 3.75Å; F950-H1033 AromaticContact CD2-ND1 3.5Å; F950-H1033 WeakPolarHBondContact CD2-ND1 3.46Å; F950-H1033 HydrophobicContact CE2-CB 4.31Å; F950-H1033 AromaticContact CE2-CD2 3.83Å; F950-H1033 AromaticContact CE2-CE1 3.57Å; F950-H1033 AromaticContact CE2-CG 3.61Å; F950-H1033 AromaticContact CE2-ND1 3.45Å; F950-H1033 WeakPolarHBondContact CE2-ND1 3.28Å; F950-H1033 AromaticContact CE2-NE2 3.81Å; F950-H1033 AromaticContact CZ-CE1 3.91Å; I1029-H1033 VanDerWaalsContact O-CB 3.29Å; I1029-H1033 WeakPolarHBondContact O-CB 3.45Å; I1029-H1033 PolarHBondContact O-N 3.46Å; L1031-H1033 VanDerWaalsContact C-N 3.29Å; L1031-H1033 PolarHBondContact O-N 2.92Å; H1033-F1036 PolarHBondContact O-N 3.15Å; H1033-V1037 WeakPolarHBondContact O-CB 3.5Å; H1033-V1037 WeakPolarHBondContact O-CG2 3.29Å; H1033-V1037 PolarHBondContact O-N 2.87Å
1034	G	93.1	Very high	92	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-61	-42.5	173.7	0	0	0	0	0	112.9	S1030 L1031 V1037 S1038	S1030-G1034 PolarHBondContact O-N 2.86Å; L1031-G1034 PolarHBondContact O-N 3.41Å; L1031-G1034 VanDerWaalsContact O-N 3.15Å; G1034-V1037 PolarHBondContact O-N 3.09Å; G1034-S1038 VanDerWaalsContact O-CB 3.28Å; G1034-S1038 WeakPolarHBondContact O-CB 3.23Å; G1034-S1038 PolarHBondContact O-N 2.86Å; G1034-S1038 PolarHBondContact O-OG 3.29Å; G1034-S1038 VanDerWaalsContact O-OG 3.12Å
1035	I	94	Very high	92.1	Very high	54 Å²	54	53.3 Å²	53.3	28%	0.277	25%	0.253	S	S	.	.	H	α-helix	trans	-57	-53.2	174	-70	165.5	0	0	0	110.3	L957 W961 L1031 F1032 V1037 S1038 L1039	L957-I1035 HydrophobicContact CD1-CB 4.12Å; L957-I1035 HydrophobicContact CD1-CG1 3.39Å; W961-I1035 HydrophobicContact CZ2-CG2 4.17Å; L1031-I1035 HydrophobicContact CD1-CD1 4.41Å; L1031-I1035 HydrophobicContact CG-CD1 4.1Å; L1031-I1035 WeakPolarHBondContact O-CG1 3.45Å; L1031-I1035 PolarHBondContact O-N 3.35Å; F1032-I1035 HydrophobicContact CD1-CD1 4.31Å; F1032-I1035 PolarHBondContact O-N 3.39Å; I1035-V1037 PolarHBondContact O-N 2.9Å; I1035-S1038 PolarHBondContact O-N 3.02Å; I1035-S1038 PolarHBondContact O-OG 3.16Å; I1035-L1039 WeakPolarHBondContact O-CB 3.3Å; I1035-L1039 PolarHBondContact O-N 3.48Å
1036	F	94.8	Very high	92.1	Very high	131 Å²	131	49.3 Å²	49.3	58%	0.575	23%	0.234	S	C	*	.	H	α-helix	trans	-60.1	-46	-178.8	-179.6	-102.6	0	0	0	112.4	F1032 H1033 L1039 I1040	F1032-F1036 PolarHBondContact O-N 3.43Å; H1033-F1036 PolarHBondContact O-N 3.15Å; F1036-L1039 WeakPolarHBondContact O-CB 3.47Å; F1036-L1039 PolarHBondContact O-N 3.44Å; F1036-I1040 HydrophobicContact CD1-CD1 3.93Å; F1036-I1040 HydrophobicContact CE1-CD1 3.36Å; F1036-I1040 HydrophobicContact CE2-CD1 4.3Å; F1036-I1040 HydrophobicContact CZ-CD1 3.58Å; F1036-I1040 PolarHBondContact O-N 2.86Å
1037	V	94.4	Very high	92.1	Very high	13 Å²	13	48.9 Å²	48.9	8%	0.079	24%	0.239	C	C	.	.	H	α-helix	trans	-67.4	-41.8	179.9	170.3	0	0	0	0	111.6	F950 A954 H1033 G1034 I1035 L1039 I1040 I1041 I1077	F950-V1037 HydrophobicContact CE2-CB 4.1Å; F950-V1037 HydrophobicContact CE2-CG1 4.48Å; F950-V1037 HydrophobicContact CE2-CG2 3.82Å; F950-V1037 HydrophobicContact CZ-CB 4.3Å; F950-V1037 HydrophobicContact CZ-CG1 4.22Å; F950-V1037 HydrophobicContact CZ-CG2 3.98Å; A954-V1037 HydrophobicContact CB-CG1 4.18Å; H1033-V1037 WeakPolarHBondContact O-CB 3.5Å; H1033-V1037 WeakPolarHBondContact O-CG2 3.29Å; H1033-V1037 PolarHBondContact O-N 2.87Å; G1034-V1037 PolarHBondContact O-N 3.09Å; I1035-V1037 PolarHBondContact O-N 2.9Å; V1037-L1039 VanDerWaalsContact C-N 3.28Å; V1037-L1039 PolarHBondContact O-N 3.4Å; V1037-I1040 PolarHBondContact O-N 2.96Å; V1037-I1041 HydrophobicContact CG1-CD1 3.51Å; V1037-I1041 HydrophobicContact CG1-CG1 4.24Å; V1037-I1041 WeakPolarHBondContact O-CB 3.34Å; V1037-I1041 VanDerWaalsContact O-CG1 3.27Å; V1037-I1041 WeakPolarHBondContact O-CG1 3.35Å; V1037-I1041 PolarHBondContact O-N 3.17Å; V1037-I1077 HydrophobicContact CG1-CG2 3.8Å
1038	S	95.4	Very high	92	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-61.9	-35.5	176.3	67.7	0	0	0	0	112.9	A954 L957 W961 G1034 I1035 I1041 F1042	A954-S1038 WeakPolarHBondContact O-CB 3.44Å; L957-S1038 VanDerWaalsContact CB-OG 3.29Å; L957-S1038 WeakPolarHBondContact CB-OG 3.43Å; W961-S1038 PolarHBondContact NE1-OG 2.9Å; G1034-S1038 VanDerWaalsContact O-CB 3.28Å; G1034-S1038 WeakPolarHBondContact O-CB 3.23Å; G1034-S1038 PolarHBondContact O-N 2.86Å; G1034-S1038 PolarHBondContact O-OG 3.29Å; G1034-S1038 VanDerWaalsContact O-OG 3.12Å; I1035-S1038 PolarHBondContact O-N 3.02Å; I1035-S1038 PolarHBondContact O-OG 3.16Å; S1038-I1041 PolarHBondContact O-N 3.41Å; S1038-F1042 WeakPolarHBondContact O-CB 3.09Å; S1038-F1042 PolarHBondContact O-N 3.46Å
1039	L	95.1	Very high	91.6	Very high	71 Å²	71	48.6 Å²	48.6	37%	0.372	25%	0.246	S	C	.	.	H	α-helix	trans	-63.4	-49	176.4	-169.3	162.4	0	0	0	110	I1035 F1036 V1037 I1041 F1042 F1043	I1035-L1039 WeakPolarHBondContact O-CB 3.3Å; I1035-L1039 PolarHBondContact O-N 3.48Å; F1036-L1039 WeakPolarHBondContact O-CB 3.47Å; F1036-L1039 PolarHBondContact O-N 3.44Å; V1037-L1039 VanDerWaalsContact C-N 3.28Å; V1037-L1039 PolarHBondContact O-N 3.4Å; L1039-I1041 PolarHBondContact O-N 2.92Å; L1039-F1042 PolarHBondContact O-N 3.35Å; L1039-F1043 HydrophobicContact CD2-CD2 3.7Å; L1039-F1043 HydrophobicContact CD2-CE2 4.36Å; L1039-F1043 HydrophobicContact CD2-CG 4.4Å; L1039-F1043 HydrophobicContact CG-CD2 3.71Å; L1039-F1043 HydrophobicContact CG-CE2 4Å; L1039-F1043 WeakPolarHBondContact O-CB 3.22Å; L1039-F1043 WeakPolarHBondContact O-CD2 3.45Å; L1039-F1043 PolarHBondContact O-N 3.43Å
1040	I	94.8	Very high	91	Very high	59 Å²	59	50.2 Å²	50.2	30%	0.303	26%	0.255	S	S	.	.	H	α-helix	trans	-59.7	-48	176.8	-68.8	176.4	0	0	0	111.1	F1036 V1037 F1042 I1044	F1036-I1040 HydrophobicContact CD1-CD1 3.93Å; F1036-I1040 HydrophobicContact CE1-CD1 3.36Å; F1036-I1040 HydrophobicContact CE2-CD1 4.3Å; F1036-I1040 HydrophobicContact CZ-CD1 3.58Å; F1036-I1040 PolarHBondContact O-N 2.86Å; V1037-I1040 PolarHBondContact O-N 2.96Å; I1040-F1042 PolarHBondContact O-N 3.06Å; I1040-I1044 HydrophobicContact CG2-CD1 3.57Å; I1040-I1044 HydrophobicContact CG2-CG1 4.27Å; I1040-I1044 WeakPolarHBondContact O-CB 3.38Å; I1040-I1044 WeakPolarHBondContact O-CG1 3.25Å; I1040-I1044 PolarHBondContact O-N 3.28Å; I1040-I1044 VanDerWaalsContact O-N 3.13Å
1041	I	94.6	Very high	90.1	Very high	3 Å²	3	58.3 Å²	58.3	2%	0.015	29%	0.292	C	S	.	.	H	α-helix	trans	-60.5	-34.9	-178.4	-74.2	169.9	0	0	0	111.7	V958 V1037 S1038 L1039 P1045 T1070 L1074 I1077	V958-I1041 HydrophobicContact CG2-CB 4.4Å; V958-I1041 HydrophobicContact CG2-CG2 3.89Å; V1037-I1041 HydrophobicContact CG1-CD1 3.51Å; V1037-I1041 HydrophobicContact CG1-CG1 4.24Å; V1037-I1041 WeakPolarHBondContact O-CB 3.34Å; V1037-I1041 VanDerWaalsContact O-CG1 3.27Å; V1037-I1041 WeakPolarHBondContact O-CG1 3.35Å; V1037-I1041 PolarHBondContact O-N 3.17Å; S1038-I1041 PolarHBondContact O-N 3.41Å; L1039-I1041 PolarHBondContact O-N 2.92Å; I1041-P1045 WeakPolarHBondContact O-CD 3.33Å; I1041-P1045 WeakPolarHBondContact O-CG 3.33Å; I1041-T1070 HydrophobicContact CG2-CG2 3.54Å; I1041-L1074 HydrophobicContact CD1-CB 4.07Å; I1041-L1074 HydrophobicContact CD1-CD1 3.51Å; I1041-L1074 HydrophobicContact CD1-CG 4.39Å; I1041-L1074 HydrophobicContact CG2-CB 4.35Å; I1041-I1077 HydrophobicContact CD1-CD1 4.02Å; I1041-I1077 HydrophobicContact CG1-CD1 3.65Å
1042	F	94.4	Very high	88.9	Confident	1 Å²	1	60.6 Å²	60.6	0%	0.004	31%	0.307	C	S	.	.	H	α-helix	trans	-83.1	-53.8	178.8	-178.8	-96.9	0	0	0	112.5	V958 W961 Y962 F965 S1038 L1039 I1040 Y1046 F1066	V958-F1042 HydrophobicContact CG1-CB 4.47Å; V958-F1042 HydrophobicContact CG1-CD2 4.03Å; W961-F1042 HydrophobicContact CB-CB 4.13Å; W961-F1042 HydrophobicContact CB-CD1 3.62Å; W961-F1042 HydrophobicContact CB-CD2 4.24Å; W961-F1042 HydrophobicContact CB-CE1 4.11Å; W961-F1042 HydrophobicContact CB-CG 3.7Å; W961-F1042 HydrophobicContact CG-CB 4.5Å; Y962-F1042 AromaticContact CD2-CE2 3.79Å; Y962-F1042 HydrophobicContact CD2-CE2 3.79Å; Y962-F1042 HydrophobicContact CD2-CZ 4.13Å; Y962-F1042 HydrophobicContact CG-CE2 4.19Å; F965-F1042 AromaticContact CD2-CE1 3.6Å; F965-F1042 HydrophobicContact CD2-CE1 3.6Å; F965-F1042 AromaticContact CD2-CZ 3.57Å; F965-F1042 HydrophobicContact CD2-CZ 3.57Å; F965-F1042 AromaticContact CE2-CE1 3.45Å; F965-F1042 HydrophobicContact CE2-CE1 3.45Å; F965-F1042 VanDerWaalsContact CE2-CE1 3.45Å; F965-F1042 AromaticContact CE2-CZ 3.95Å; F965-F1042 HydrophobicContact CE2-CZ 3.95Å; F965-F1042 HydrophobicContact CG-CZ 4.37Å; F965-F1042 HydrophobicContact CZ-CE1 4.36Å; S1038-F1042 WeakPolarHBondContact O-CB 3.09Å; S1038-F1042 PolarHBondContact O-N 3.46Å; L1039-F1042 PolarHBondContact O-N 3.35Å; I1040-F1042 PolarHBondContact O-N 3.06Å; F1042-Y1046 HydrophobicContact CE1-CG 4.47Å; F1042-Y1046 WeakPolarHBondContact O-CB 3.28Å; F1042-Y1046 PolarHBondContact O-N 3.02Å; F1042-Y1046 VanDerWaalsContact O-N 3.07Å; F1042-F1066 HydrophobicContact CD2-CE1 4.4Å; F1042-F1066 AromaticContact CD2-CZ 3.82Å; F1042-F1066 HydrophobicContact CD2-CZ 3.82Å; F1042-F1066 AromaticContact CE2-CE1 3.98Å; F1042-F1066 HydrophobicContact CE2-CE1 3.98Å; F1042-F1066 AromaticContact CE2-CZ 3.61Å; F1042-F1066 HydrophobicContact CE2-CZ 3.61Å; F1042-F1066 HydrophobicContact CZ-CZ 4.35Å
1043	F	93.6	Very high	87.3	Confident	79 Å²	79	61.1 Å²	61.1	35%	0.346	31%	0.313	S	S	.	.	H	α-helix	trans	-75.3	-29.6	-168.4	-78.7	-79.6	0	0	0	114.2	W961 F965 L1039 G1047	W961-F1043 HydrophobicContact CD2-CE2 4.4Å; W961-F1043 HydrophobicContact CE3-CE2 4.4Å; W961-F1043 HydrophobicContact CG-CE2 4.44Å; F965-F1043 HydrophobicContact CE2-CE1 4.06Å; F965-F1043 HydrophobicContact CE2-CZ 4.18Å; F965-F1043 AromaticContact CZ-CE1 3.82Å; F965-F1043 HydrophobicContact CZ-CE1 3.82Å; F965-F1043 HydrophobicContact CZ-CZ 4.31Å; L1039-F1043 HydrophobicContact CD2-CD2 3.7Å; L1039-F1043 HydrophobicContact CD2-CE2 4.36Å; L1039-F1043 HydrophobicContact CD2-CG 4.4Å; L1039-F1043 HydrophobicContact CG-CD2 3.71Å; L1039-F1043 HydrophobicContact CG-CE2 4Å; L1039-F1043 WeakPolarHBondContact O-CB 3.22Å; L1039-F1043 WeakPolarHBondContact O-CD2 3.45Å; L1039-F1043 PolarHBondContact O-N 3.43Å; F1043-G1047 PolarHBondContact O-N 3.2Å
1044	I	92.6	Very high	85.9	Confident	112 Å²	112	59.7 Å²	59.7	57%	0.574	31%	0.314	S	S	*	.	H	α-helix	trans	-68.4	-53.7	177.8	-66.5	-176	0	0	0	111.1	I1040 Y1046 G1047 A1048	I1040-I1044 HydrophobicContact CG2-CD1 3.57Å; I1040-I1044 HydrophobicContact CG2-CG1 4.27Å; I1040-I1044 WeakPolarHBondContact O-CB 3.38Å; I1040-I1044 WeakPolarHBondContact O-CG1 3.25Å; I1040-I1044 PolarHBondContact O-N 3.28Å; I1040-I1044 VanDerWaalsContact O-N 3.13Å; I1044-Y1046 VanDerWaalsContact C-N 3.29Å; I1044-Y1046 PolarHBondContact O-N 3.27Å; I1044-G1047 PolarHBondContact O-N 3.47Å; I1044-A1048 WeakPolarHBondContact O-CB 3.34Å; I1044-A1048 PolarHBondContact O-N 2.77Å
1045	P	89.8	Confident	84.2	Confident	10 Å²	10	69.5 Å²	69.5	7%	0.065	36%	0.36	C	S	.	.	H	α-helix	trans	-57.3	-43.7	172	-26.7	37.7	0	0	0	111.6	I1041 G1047 A1048 F1049 F1066 V1069	I1041-P1045 WeakPolarHBondContact O-CD 3.33Å; I1041-P1045 WeakPolarHBondContact O-CG 3.33Å; P1045-G1047 PolarHBondContact O-N 3.42Å; P1045-A1048 PolarHBondContact O-N 2.98Å; P1045-A1048 VanDerWaalsContact O-N 3.11Å; P1045-F1049 VanDerWaalsContact O-CD2 3.27Å; P1045-F1049 WeakPolarHBondContact O-CD2 3.31Å; P1045-F1049 PolarHBondContact O-N 3.47Å; P1045-F1066 HydrophobicContact CB-CD2 4.2Å; P1045-F1066 HydrophobicContact CB-CE2 3.91Å; P1045-V1069 HydrophobicContact CB-CG1 4.09Å; P1045-V1069 HydrophobicContact CG-CG1 4.21Å
1046	Y	87.9	Confident	82.6	Confident	72 Å²	72	74.3 Å²	74.3	28%	0.282	39%	0.386	S	S	.	.	H	α-helix	trans	-58.5	-46.8	-179.1	-178.6	-104.6	0	0	0	112	F965 F1042 I1044 A1048 F1049 L1050 F1066	F965-Y1046 HydrophobicContact CD1-CE1 4.08Å; F965-Y1046 HydrophobicContact CD1-CE2 4.18Å; F965-Y1046 AromaticContact CD1-CZ 3.6Å; F965-Y1046 VanDerWaalsContact CD1-OH 3.28Å; F965-Y1046 WeakPolarHBondContact CD1-OH 3.23Å; F965-Y1046 AromaticContact CE1-CE1 3.7Å; F965-Y1046 HydrophobicContact CE1-CE1 3.7Å; F965-Y1046 AromaticContact CE1-CZ 3.72Å; F965-Y1046 HydrophobicContact CG-CE2 4.46Å; F965-Y1046 HydrophobicContact CZ-CE1 4.21Å; F1042-Y1046 HydrophobicContact CE1-CG 4.47Å; F1042-Y1046 WeakPolarHBondContact O-CB 3.28Å; F1042-Y1046 PolarHBondContact O-N 3.02Å; F1042-Y1046 VanDerWaalsContact O-N 3.07Å; I1044-Y1046 VanDerWaalsContact C-N 3.29Å; I1044-Y1046 PolarHBondContact O-N 3.27Å; Y1046-A1048 PolarHBondContact O-N 3.41Å; Y1046-F1049 PolarHBondContact O-N 3.22Å; Y1046-L1050 HydrophobicContact CD1-CD1 3.94Å; Y1046-L1050 HydrophobicContact CE1-CD1 3.49Å; Y1046-L1050 VanDerWaalsContact CE1-CD1 3.49Å; Y1046-L1050 HydrophobicContact CE1-CG 4.37Å; Y1046-L1050 WeakPolarHBondContact O-CG 3.45Å; Y1046-L1050 PolarHBondContact O-N 2.9Å; Y1046-L1050 VanDerWaalsContact O-N 3.12Å; Y1046-F1066 HydrophobicContact CD2-CE2 4.5Å
1047	G	87	Confident	81	Confident	28 Å²	28	70.9 Å²	70.9	29%	0.289	39%	0.388	S	S	.	.	H	α-helix	trans	-64.2	-38.4	175.2	0	0	0	0	0	113.4	F1043 I1044 P1045 L1050 Q1051	F1043-G1047 PolarHBondContact O-N 3.2Å; I1044-G1047 PolarHBondContact O-N 3.47Å; P1045-G1047 PolarHBondContact O-N 3.42Å; G1047-L1050 PolarHBondContact O-N 3.34Å; G1047-Q1051 PolarHBondContact O-N 3.17Å
1048	A	85.6	Confident	79.4	Confident	46 Å²	46	77.7 Å²	77.7	38%	0.38	42%	0.419	S	S	.	.	H	α-helix	trans	-64.1	-45.4	177.4	0	0	0	0	0	111.8	I1044 P1045 Y1046 L1050 Q1051 T1052	I1044-A1048 WeakPolarHBondContact O-CB 3.34Å; I1044-A1048 PolarHBondContact O-N 2.77Å; P1045-A1048 PolarHBondContact O-N 2.98Å; P1045-A1048 VanDerWaalsContact O-N 3.11Å; Y1046-A1048 PolarHBondContact O-N 3.41Å; A1048-L1050 VanDerWaalsContact C-N 3.3Å; A1048-L1050 PolarHBondContact O-N 3.46Å; A1048-Q1051 PolarHBondContact O-N 2.79Å; A1048-Q1051 VanDerWaalsContact O-N 3.14Å; A1048-T1052 WeakPolarHBondContact O-CB 3.24Å; A1048-T1052 PolarHBondContact O-N 3.37Å; A1048-T1052 PolarHBondContact O-OG1 2.99Å
1049	F	82.3	Confident	77.7	Confident	40 Å²	40	79.9 Å²	79.9	18%	0.175	44%	0.437	C	S	.	.	H	α-helix	trans	-68.7	-25.5	178.5	-85	-96.1	0	0	0	113.1	P1045 Y1046 Q1051 T1052 P1060 F1066 V1069	P1045-F1049 VanDerWaalsContact O-CD2 3.27Å; P1045-F1049 WeakPolarHBondContact O-CD2 3.31Å; P1045-F1049 PolarHBondContact O-N 3.47Å; Y1046-F1049 PolarHBondContact O-N 3.22Å; F1049-Q1051 VanDerWaalsContact C-N 3.31Å; F1049-T1052 WeakPolarHBondContact CA-OG1 3.39Å; F1049-P1060 VanDerWaalsContact CE1-O 3.29Å; F1049-P1060 WeakPolarHBondContact CE1-O 3.43Å; F1049-F1066 HydrophobicContact CD2-CD2 4.25Å; F1049-V1069 HydrophobicContact CE2-CB 4.05Å; F1049-V1069 HydrophobicContact CE2-CG1 4.22Å; F1049-V1069 HydrophobicContact CE2-CG2 3.93Å; F1049-V1069 HydrophobicContact CZ-CB 4.39Å; F1049-V1069 HydrophobicContact CZ-CG2 3.88Å
1050	L	76.9	Confident	75.9	Confident	120 Å²	120	79.1 Å²	79.1	63%	0.628	44%	0.436	S	S	*	.	H	α-helix	trans	-70.9	-25.1	171.1	-75.4	173.5	0	0	0	113.4	Y1046 G1047 A1048	Y1046-L1050 HydrophobicContact CD1-CD1 3.94Å; Y1046-L1050 HydrophobicContact CE1-CD1 3.49Å; Y1046-L1050 VanDerWaalsContact CE1-CD1 3.49Å; Y1046-L1050 HydrophobicContact CE1-CG 4.37Å; Y1046-L1050 WeakPolarHBondContact O-CG 3.45Å; Y1046-L1050 PolarHBondContact O-N 2.9Å; Y1046-L1050 VanDerWaalsContact O-N 3.12Å; G1047-L1050 PolarHBondContact O-N 3.34Å; A1048-L1050 VanDerWaalsContact C-N 3.3Å; A1048-L1050 PolarHBondContact O-N 3.46Å
1051	Q	70.5	Confident	74.5	Confident	175 Å²	175	80.1 Å²	80.1	82%	0.818	45%	0.448	S	S	*	.	H	α-helix	trans	-108.8	-8.8	-173.2	-67.2	-174.4	-9.7	0	0	114.2	G1047 A1048 F1049	G1047-Q1051 PolarHBondContact O-N 3.17Å; A1048-Q1051 PolarHBondContact O-N 2.79Å; A1048-Q1051 VanDerWaalsContact O-N 3.14Å; F1049-Q1051 VanDerWaalsContact C-N 3.31Å
1052	T	65.4	Low	73.8	Confident	64 Å²	64	84 Å²	84	39%	0.393	47%	0.469	S	S	.	.			trans	-94.1	131.2	-175.1	31.6	0	0	0	0	112.4	A1048 F1049 P1060	A1048-T1052 WeakPolarHBondContact O-CB 3.24Å; A1048-T1052 PolarHBondContact O-N 3.37Å; A1048-T1052 PolarHBondContact O-OG1 2.99Å; F1049-T1052 WeakPolarHBondContact CA-OG1 3.39Å; T1052-P1060 WeakPolarHBondContact O-CD 3.04Å
1053	M	59.3	Low	73.2	Confident	146 Å²	146	87.3 Å²	87.3	72%	0.719	48%	0.482	S	S	*	.			trans	-107.3	135	163.1	-68	-70	176.1	0	0	107.5	A1059	M1053-A1059 HydrophobicContact SD-CB 4.13Å
1054	G	62.1	Low	72.8	Confident	29 Å²	29	90 Å²	90	30%	0.299	50%	0.496	S	S	.	.			trans	-67.2	166.2	179.4	0	0	0	0	0	112.2	D1056 G1057 E1058	G1054-D1056 PolarHBondContact O-N 3.02Å; G1054-G1057 PolarHBondContact O-N 3.48Å; G1054-G1057 VanDerWaalsContact O-N 3.09Å; G1054-E1058 WeakPolarHBondContact CA-O 3.2Å; G1054-E1058 PolarHBondContact N-O 2.96Å
1055	Q	58.5	Low	72.5	Confident	206 Å²	206	87.2 Å²	87.2	96%	0.963	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-24.1	175.4	-72.6	-175.8	-16.9	0	0	112.6	G1057	Q1055-G1057 VanDerWaalsContact C-N 3.31Å
1056	D	60.4	Low	72.4	Confident	155 Å²	155	87.6 Å²	87.6	83%	0.829	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.3	1.9	178.2	-56	-40.2	0	0	0	113.3	G1054 E1058	G1054-D1056 PolarHBondContact O-N 3.02Å; D1056-E1058 PolarHBondContact O-N 2.74Å
1057	G	60.2	Low	72.5	Confident	59 Å²	59	84.4 Å²	84.4	61%	0.608	48%	0.475	S	S	*	.	S	Bend	trans	79.8	-5.4	-177.4	0	0	0	0	0	114.8	G1054 Q1055	G1054-G1057 PolarHBondContact O-N 3.48Å; G1054-G1057 VanDerWaalsContact O-N 3.09Å; Q1055-G1057 VanDerWaalsContact C-N 3.31Å
1058	E	61.4	Low	72.7	Confident	156 Å²	156	87.2 Å²	87.2	73%	0.729	49%	0.487	S	S	*	.	S	Bend	trans	-86.9	139.8	169.9	-67.2	-170.2	163.6	0	0	111	G1054 D1056 P1060	G1054-E1058 WeakPolarHBondContact CA-O 3.2Å; G1054-E1058 PolarHBondContact N-O 2.96Å; D1056-E1058 PolarHBondContact O-N 2.74Å; E1058-P1060 WeakPolarHBondContact O-CD 3.27Å
1059	A	58.4	Low	72.9	Confident	46 Å²	46	87.8 Å²	87.8	38%	0.38	49%	0.486	S	S	.	.			trans	-67.9	124.8	172.8	0	0	0	0	0	108.8	M1053 S1061	M1053-A1059 HydrophobicContact SD-CB 4.13Å; A1059-S1061 PolarHBondContact O-N 2.94Å
1060	P	57.8	Low	73.4	Confident	55 Å²	55	85.9 Å²	85.9	36%	0.357	48%	0.477	S	S	.	.			trans	-73.5	28.3	176.9	31.5	-33.9	0	0	0	112.3	F1049 T1052 E1058 D1062	F1049-P1060 VanDerWaalsContact CE1-O 3.29Å; F1049-P1060 WeakPolarHBondContact CE1-O 3.43Å; T1052-P1060 WeakPolarHBondContact O-CD 3.04Å; E1058-P1060 WeakPolarHBondContact O-CD 3.27Å; P1060-D1062 PolarHBondContact O-N 3.36Å
1061	S	66	Low	74.2	Confident	80 Å²	80	80.6 Å²	80.6	56%	0.559	45%	0.451	S	S	*	.			trans	-83	42.3	-167.2	64.6	0	0	0	0	113.4	A1059	A1059-S1061 PolarHBondContact O-N 2.94Å
1062	D	79.2	Confident	75.2	Confident	86 Å²	86	74.8 Å²	74.8	46%	0.46	43%	0.43	S	S	.	.			trans	-84	140	170.1	-168.3	6.9	0	0	0	110.6	P1060 Q1064 S1065 F1066	P1060-D1062 PolarHBondContact O-N 3.36Å; D1062-Q1064 PolarHBondContact O-N 2.93Å; D1062-S1065 PolarHBondContact O-N 3.27Å; D1062-F1066 PolarHBondContact O-N 2.99Å
1063	Y	82.7	Confident	76.6	Confident	69 Å²	69	73.6 Å²	73.6	27%	0.271	42%	0.424	S	S	.	.	H	α-helix	trans	-55.5	-37.5	177.6	163.5	-97.5	0	0	0	111.9	Y962 T972 F1066 A1067	Y962-Y1063 AromaticContact CE1-CE2 3.99Å; Y962-Y1063 HydrophobicContact CE1-CE2 3.99Å; Y962-Y1063 HydrophobicContact CE2-CE2 4.36Å; Y962-Y1063 AromaticContact CZ-CE2 3.6Å; Y962-Y1063 VanDerWaalsContact OH-CD2 3.3Å; Y962-Y1063 WeakPolarHBondContact OH-CD2 3.44Å; Y962-Y1063 WeakPolarHBondContact OH-CE2 3.33Å; T972-Y1063 PolarHBondContact O-OH 3.31Å; Y1063-F1066 PolarHBondContact O-N 3.32Å; Y1063-A1067 WeakPolarHBondContact O-CB 3.39Å; Y1063-A1067 PolarHBondContact O-N 3.01Å
1064	Q	85.3	Confident	78.2	Confident	136 Å²	136	66.7 Å²	66.7	64%	0.636	39%	0.39	S	S	*	.	H	α-helix	trans	-64.1	-44.3	179.1	-65.5	-168.3	-11	0	0	112.2	D1062 F1066 A1067 V1068	D1062-Q1064 PolarHBondContact O-N 2.93Å; Q1064-F1066 VanDerWaalsContact C-N 3.33Å; Q1064-F1066 PolarHBondContact O-N 3.48Å; Q1064-A1067 PolarHBondContact O-N 3.45Å; Q1064-V1068 WeakPolarHBondContact O-CG2 3.34Å; Q1064-V1068 PolarHBondContact O-N 3.18Å
1065	S	86.6	Confident	79.7	Confident	53 Å²	53	66.6 Å²	66.6	37%	0.371	38%	0.383	S	S	.	.	H	α-helix	trans	-62.2	-42.4	176.7	-64.6	0	0	0	0	111.4	D1062 V1068 V1069	D1062-S1065 PolarHBondContact O-N 3.27Å; S1065-V1068 PolarHBondContact O-N 3.3Å; S1065-V1069 WeakPolarHBondContact O-CG2 3.41Å; S1065-V1069 PolarHBondContact O-N 3.37Å
1066	F	87.6	Confident	81.3	Confident	18 Å²	18	64.3 Å²	64.3	8%	0.079	37%	0.37	C	S	.	.	H	α-helix	trans	-60.8	-46.3	174.3	172.3	-100.9	0	0	0	112.2	F1042 P1045 Y1046 F1049 D1062 Y1063 Q1064 V1068 V1069 T1070	F1042-F1066 HydrophobicContact CD2-CE1 4.4Å; F1042-F1066 AromaticContact CD2-CZ 3.82Å; F1042-F1066 HydrophobicContact CD2-CZ 3.82Å; F1042-F1066 AromaticContact CE2-CE1 3.98Å; F1042-F1066 HydrophobicContact CE2-CE1 3.98Å; F1042-F1066 AromaticContact CE2-CZ 3.61Å; F1042-F1066 HydrophobicContact CE2-CZ 3.61Å; F1042-F1066 HydrophobicContact CZ-CZ 4.35Å; P1045-F1066 HydrophobicContact CB-CD2 4.2Å; P1045-F1066 HydrophobicContact CB-CE2 3.91Å; Y1046-F1066 HydrophobicContact CD2-CE2 4.5Å; F1049-F1066 HydrophobicContact CD2-CD2 4.25Å; D1062-F1066 PolarHBondContact O-N 2.99Å; Y1063-F1066 PolarHBondContact O-N 3.32Å; Q1064-F1066 VanDerWaalsContact C-N 3.33Å; Q1064-F1066 PolarHBondContact O-N 3.48Å; F1066-V1068 PolarHBondContact O-N 3.22Å; F1066-V1069 PolarHBondContact O-N 3.04Å; F1066-T1070 WeakPolarHBondContact O-CB 3.48Å; F1066-T1070 PolarHBondContact O-N 3.18Å; F1066-T1070 PolarHBondContact O-OG1 3.27Å
1067	A	89.6	Confident	82.8	Confident	5 Å²	5	59.8 Å²	59.8	4%	0.041	35%	0.346	C	S	.	.	H	α-helix	trans	-60.3	-44.2	178.3	0	0	0	0	0	111.7	A973 Y1063 Q1064 T1070 A1071	A973-A1067 WeakPolarHBondContact O-CB 3.49Å; Y1063-A1067 WeakPolarHBondContact O-CB 3.39Å; Y1063-A1067 PolarHBondContact O-N 3.01Å; Q1064-A1067 PolarHBondContact O-N 3.45Å; A1067-T1070 PolarHBondContact O-N 2.95Å; A1067-A1071 WeakPolarHBondContact O-CB 3.49Å; A1067-A1071 PolarHBondContact O-N 3.36Å
1068	V	90.6	Very high	84.3	Confident	88 Å²	88	57 Å²	57	53%	0.533	32%	0.317	S	S	.	.	H	α-helix	trans	-66.1	-43.1	178.8	171.8	0	0	0	0	112	Q1064 S1065 F1066 A1071 S1072	Q1064-V1068 WeakPolarHBondContact O-CG2 3.34Å; Q1064-V1068 PolarHBondContact O-N 3.18Å; S1065-V1068 PolarHBondContact O-N 3.3Å; F1066-V1068 PolarHBondContact O-N 3.22Å; V1068-A1071 PolarHBondContact O-N 3.37Å; V1068-S1072 VanDerWaalsContact O-CB 3.28Å; V1068-S1072 WeakPolarHBondContact O-CB 3.42Å; V1068-S1072 PolarHBondContact O-N 3.16Å; V1068-S1072 PolarHBondContact O-OG 3.48Å
1069	V	91	Very high	85.7	Confident	58 Å²	58	51.7 Å²	51.7	35%	0.352	29%	0.294	S	S	.	.	H	α-helix	trans	-64	-43	177.8	170.6	0	0	0	0	110.8	P1045 F1049 S1065 F1066 S1073	P1045-V1069 HydrophobicContact CB-CG1 4.09Å; P1045-V1069 HydrophobicContact CG-CG1 4.21Å; F1049-V1069 HydrophobicContact CE2-CB 4.05Å; F1049-V1069 HydrophobicContact CE2-CG1 4.22Å; F1049-V1069 HydrophobicContact CE2-CG2 3.93Å; F1049-V1069 HydrophobicContact CZ-CB 4.39Å; F1049-V1069 HydrophobicContact CZ-CG2 3.88Å; S1065-V1069 WeakPolarHBondContact O-CG2 3.41Å; S1065-V1069 PolarHBondContact O-N 3.37Å; F1066-V1069 PolarHBondContact O-N 3.04Å; V1069-S1073 VanDerWaalsContact O-CB 3.31Å; V1069-S1073 WeakPolarHBondContact O-CB 3.09Å; V1069-S1073 PolarHBondContact O-N 3.36Å; V1069-S1073 PolarHBondContact O-OG 3.43Å
1070	T	92.2	Very high	87.2	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-66.5	-44	178.6	-55.1	0	0	0	0	111.2	V958 Y974 I1041 F1066 A1067 S1073 L1074	V958-T1070 HydrophobicContact CG1-CG2 3.85Å; Y974-T1070 HydrophobicContact CE1-CG2 3.83Å; I1041-T1070 HydrophobicContact CG2-CG2 3.54Å; F1066-T1070 WeakPolarHBondContact O-CB 3.48Å; F1066-T1070 PolarHBondContact O-N 3.18Å; F1066-T1070 PolarHBondContact O-OG1 3.27Å; A1067-T1070 PolarHBondContact O-N 2.95Å; T1070-S1073 PolarHBondContact O-N 2.99Å; T1070-L1074 WeakPolarHBondContact O-CB 3.22Å; T1070-L1074 PolarHBondContact O-N 3.37Å
1071	A	92.6	Very high	88.7	Confident	8 Å²	8	54 Å²	54	7%	0.066	30%	0.295	C	S	.	.	H	α-helix	trans	-61.6	-47	176.1	0	0	0	0	0	112.2	Y974 F978 A1067 V1068 L1074 V1075	Y974-A1071 HydrophobicContact CD1-CB 3.93Å; Y974-A1071 HydrophobicContact CE1-CB 4.05Å; F978-A1071 HydrophobicContact CD1-CB 3.88Å; F978-A1071 HydrophobicContact CD2-CB 4Å; F978-A1071 HydrophobicContact CE1-CB 3.59Å; F978-A1071 HydrophobicContact CE2-CB 3.76Å; F978-A1071 HydrophobicContact CG-CB 4.06Å; F978-A1071 HydrophobicContact CZ-CB 3.53Å; A1067-A1071 WeakPolarHBondContact O-CB 3.49Å; A1067-A1071 PolarHBondContact O-N 3.36Å; V1068-A1071 PolarHBondContact O-N 3.37Å; A1071-L1074 WeakPolarHBondContact O-CB 3.4Å; A1071-L1074 PolarHBondContact O-N 2.75Å; A1071-V1075 WeakPolarHBondContact O-CG2 3.32Å; A1071-V1075 PolarHBondContact O-N 2.97Å; A1071-V1075 VanDerWaalsContact O-N 3.09Å
1072	S	93.1	Very high	89.7	Confident	54 Å²	54	50.8 Å²	50.8	38%	0.378	27%	0.271	S	S	.	.	H	α-helix	trans	-63.1	-46.1	178.6	-58.4	0	0	0	0	111	V1068 L1074 V1075 F1076	V1068-S1072 VanDerWaalsContact O-CB 3.28Å; V1068-S1072 WeakPolarHBondContact O-CB 3.42Å; V1068-S1072 PolarHBondContact O-N 3.16Å; V1068-S1072 PolarHBondContact O-OG 3.48Å; S1072-L1074 VanDerWaalsContact C-N 3.3Å; S1072-L1074 PolarHBondContact O-N 3.03Å; S1072-V1075 PolarHBondContact O-N 3.34Å; S1072-F1076 VanDerWaalsContact O-CD2 3.23Å; S1072-F1076 WeakPolarHBondContact O-CD2 3.34Å; S1072-F1076 PolarHBondContact O-N 3.2Å
1073	S	93.6	Very high	89.8	Confident	39 Å²	39	57.3 Å²	57.3	27%	0.273	29%	0.29	S	S	.	.	H	α-helix	trans	-57.6	-43.5	177.1	-60.6	0	0	0	0	111.7	V1069 T1070 F1076 I1077	V1069-S1073 VanDerWaalsContact O-CB 3.31Å; V1069-S1073 WeakPolarHBondContact O-CB 3.09Å; V1069-S1073 PolarHBondContact O-N 3.36Å; V1069-S1073 PolarHBondContact O-OG 3.43Å; T1070-S1073 PolarHBondContact O-N 2.99Å; S1073-F1076 PolarHBondContact O-N 2.92Å; S1073-I1077 WeakPolarHBondContact O-CB 3.29Å; S1073-I1077 WeakPolarHBondContact O-CD1 3.17Å; S1073-I1077 VanDerWaalsContact O-CG1 3.24Å; S1073-I1077 WeakPolarHBondContact O-CG1 3.27Å; S1073-I1077 PolarHBondContact O-N 3.36Å
1074	L	93.9	Very high	89.4	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-60.5	-48.3	176.3	176.2	69.5	0	0	0	112.4	A954 F955 Y974 F978 Y982 I1041 T1070 A1071 S1072 F1076 I1077 V1078	A954-L1074 HydrophobicContact CB-CD1 3.91Å; F955-L1074 HydrophobicContact CB-CD2 3.82Å; F955-L1074 HydrophobicContact CD2-CD2 3.53Å; F955-L1074 HydrophobicContact CG-CD2 4.14Å; Y974-L1074 HydrophobicContact CE2-CD2 4.48Å; F978-L1074 HydrophobicContact CE1-CD2 4.47Å; Y982-L1074 HydrophobicContact CD2-CD2 4.22Å; Y982-L1074 HydrophobicContact CE2-CD2 3.57Å; Y982-L1074 HydrophobicContact CE2-CG 3.91Å; I1041-L1074 HydrophobicContact CD1-CB 4.07Å; I1041-L1074 HydrophobicContact CD1-CD1 3.51Å; I1041-L1074 HydrophobicContact CD1-CG 4.39Å; I1041-L1074 HydrophobicContact CG2-CB 4.35Å; T1070-L1074 WeakPolarHBondContact O-CB 3.22Å; T1070-L1074 PolarHBondContact O-N 3.37Å; A1071-L1074 WeakPolarHBondContact O-CB 3.4Å; A1071-L1074 PolarHBondContact O-N 2.75Å; S1072-L1074 VanDerWaalsContact C-N 3.3Å; S1072-L1074 PolarHBondContact O-N 3.03Å; L1074-F1076 VanDerWaalsContact C-N 3.35Å; L1074-F1076 PolarHBondContact O-N 3.36Å; L1074-I1077 PolarHBondContact O-N 3.04Å; L1074-V1078 HydrophobicContact CD1-CG2 3.79Å; L1074-V1078 HydrophobicContact CG-CG2 4.37Å; L1074-V1078 WeakPolarHBondContact O-CB 3.49Å; L1074-V1078 VanDerWaalsContact O-CG2 3.3Å; L1074-V1078 WeakPolarHBondContact O-CG2 3.49Å; L1074-V1078 PolarHBondContact O-N 2.9Å
1075	V	93	Very high	88.2	Confident	28 Å²	28	53.2 Å²	53.2	17%	0.17	29%	0.291	C	S	.	.	H	α-helix	trans	-61.1	-45.2	-179.7	174.6	0	0	0	0	110.7	F978 Y982 A1071 S1072 N1079	F978-V1075 HydrophobicContact CE2-CG2 3.7Å; F978-V1075 HydrophobicContact CZ-CG2 3.78Å; Y982-V1075 HydrophobicContact CD2-CG2 4.39Å; Y982-V1075 HydrophobicContact CE2-CG2 4.42Å; A1071-V1075 WeakPolarHBondContact O-CG2 3.32Å; A1071-V1075 PolarHBondContact O-N 2.97Å; A1071-V1075 VanDerWaalsContact O-N 3.09Å; S1072-V1075 PolarHBondContact O-N 3.34Å; V1075-N1079 WeakPolarHBondContact CG1-ND2 3.28Å; V1075-N1079 VanDerWaalsContact O-CB 3.28Å; V1075-N1079 WeakPolarHBondContact O-CB 3.45Å; V1075-N1079 VanDerWaalsContact O-CG 3.27Å; V1075-N1079 PolarHBondContact O-N 3.11Å; V1075-N1079 PolarHBondContact O-ND2 3.07Å
1076	F	92.6	Very high	86.4	Confident	157 Å²	157	60 Å²	60	69%	0.689	31%	0.314	S	S	*	.	H	α-helix	trans	-62.9	-49	177.7	-83.4	-69.5	0	0	0	112.4	S1072 S1073 L1074 N1079 L1080	S1072-F1076 VanDerWaalsContact O-CD2 3.23Å; S1072-F1076 WeakPolarHBondContact O-CD2 3.34Å; S1072-F1076 PolarHBondContact O-N 3.2Å; S1073-F1076 PolarHBondContact O-N 2.92Å; L1074-F1076 VanDerWaalsContact C-N 3.35Å; L1074-F1076 PolarHBondContact O-N 3.36Å; F1076-N1079 PolarHBondContact O-N 3.35Å; F1076-L1080 WeakPolarHBondContact O-CB 3.42Å; F1076-L1080 PolarHBondContact O-N 3.13Å
1077	I	92.3	Very high	86.3	Confident	60 Å²	60	62.2 Å²	62.2	31%	0.308	33%	0.326	S	S	.	.	H	α-helix	trans	-63	-46.7	-178	-71	165.3	0	0	0	110.7	V1037 I1041 S1073 L1074 L1080 Q1081	V1037-I1077 HydrophobicContact CG1-CG2 3.8Å; I1041-I1077 HydrophobicContact CD1-CD1 4.02Å; I1041-I1077 HydrophobicContact CG1-CD1 3.65Å; S1073-I1077 WeakPolarHBondContact O-CB 3.29Å; S1073-I1077 WeakPolarHBondContact O-CD1 3.17Å; S1073-I1077 VanDerWaalsContact O-CG1 3.24Å; S1073-I1077 WeakPolarHBondContact O-CG1 3.27Å; S1073-I1077 PolarHBondContact O-N 3.36Å; L1074-I1077 PolarHBondContact O-N 3.04Å; I1077-L1080 PolarHBondContact O-N 2.96Å; I1077-Q1081 WeakPolarHBondContact O-CB 3.46Å; I1077-Q1081 PolarHBondContact O-N 2.83Å
1078	V	91.6	Very high	86.2	Confident	0 Å²	0	65.2 Å²	65.2	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-62.9	-47.3	-179.7	167.3	0	0	0	0	110.9	F950 K951 L1074 L1080 Q1081 V1082	F950-V1078 HydrophobicContact CE1-CG2 4.34Å; K951-V1078 HydrophobicContact CB-CG1 3.58Å; K951-V1078 HydrophobicContact CB-CG2 4.18Å; L1074-V1078 HydrophobicContact CD1-CG2 3.79Å; L1074-V1078 HydrophobicContact CG-CG2 4.37Å; L1074-V1078 WeakPolarHBondContact O-CB 3.49Å; L1074-V1078 VanDerWaalsContact O-CG2 3.3Å; L1074-V1078 WeakPolarHBondContact O-CG2 3.49Å; L1074-V1078 PolarHBondContact O-N 2.9Å; V1078-L1080 VanDerWaalsContact C-N 3.34Å; V1078-L1080 PolarHBondContact O-N 2.9Å; V1078-Q1081 PolarHBondContact O-N 2.85Å; V1078-V1082 VanDerWaalsContact O-CG2 3.29Å; V1078-V1082 WeakPolarHBondContact O-CG2 3.44Å; V1078-V1082 PolarHBondContact O-N 3.14Å
1079	N	90.7	Very high	85.9	Confident	46 Å²	46	63.9 Å²	63.9	25%	0.246	33%	0.33	C	S	.	.	H	α-helix	trans	-67.3	-36	-179.3	-72.3	-22.6	0	0	0	112.2	Y986 V1075 F1076 V1082 R1083	Y986-N1079 PolarHBondContact O-ND2 3.44Å; V1075-N1079 WeakPolarHBondContact CG1-ND2 3.28Å; V1075-N1079 VanDerWaalsContact O-CB 3.28Å; V1075-N1079 WeakPolarHBondContact O-CB 3.45Å; V1075-N1079 VanDerWaalsContact O-CG 3.27Å; V1075-N1079 PolarHBondContact O-N 3.11Å; V1075-N1079 PolarHBondContact O-ND2 3.07Å; F1076-N1079 PolarHBondContact O-N 3.35Å; N1079-V1082 PolarHBondContact O-N 3.37Å; N1079-R1083 PolarHBondContact O-N 3.41Å
1080	L	90.1	Very high	85.6	Confident	109 Å²	109	64.2 Å²	64.2	57%	0.571	33%	0.329	S	S	*	.	H	α-helix	trans	-69.7	-38.5	175.6	-167.3	137.3	0	0	0	111.8	F1076 I1077 V1078 V1082 R1083 T1084	F1076-L1080 WeakPolarHBondContact O-CB 3.42Å; F1076-L1080 PolarHBondContact O-N 3.13Å; I1077-L1080 PolarHBondContact O-N 2.96Å; V1078-L1080 VanDerWaalsContact C-N 3.34Å; V1078-L1080 PolarHBondContact O-N 2.9Å; L1080-V1082 VanDerWaalsContact C-N 3.34Å; L1080-V1082 PolarHBondContact O-N 3.46Å; L1080-R1083 WeakPolarHBondContact O-CB 3.39Å; L1080-R1083 PolarHBondContact O-N 3.02Å; L1080-R1083 VanDerWaalsContact O-N 3.16Å; L1080-T1084 HydrophobicContact CD2-CG2 3.96Å; L1080-T1084 WeakPolarHBondContact O-CG2 3.47Å; L1080-T1084 PolarHBondContact O-N 3.39Å; L1080-T1084 PolarHBondContact O-OG1 2.89Å
1081	Q	88.6	Confident	85.2	Confident	40 Å²	40	68.3 Å²	68.3	19%	0.187	35%	0.349	C	S	.	.	H	α-helix	trans	-63.7	-39.6	175.4	-169.5	66.7	23.6	0	0	112.1	F947 F950 I1077 V1078 R1083 T1084 G1085 K1086	F947-Q1081 HydrophobicContact CE1-CG 4.32Å; F950-Q1081 HydrophobicContact CE1-CB 4.1Å; F950-Q1081 HydrophobicContact CE1-CG 3.91Å; F950-Q1081 HydrophobicContact CZ-CG 4.23Å; I1077-Q1081 WeakPolarHBondContact O-CB 3.46Å; I1077-Q1081 PolarHBondContact O-N 2.83Å; V1078-Q1081 PolarHBondContact O-N 2.85Å; Q1081-R1083 VanDerWaalsContact C-N 3.27Å; Q1081-R1083 PolarHBondContact O-N 3.43Å; Q1081-T1084 PolarHBondContact O-N 3.12Å; Q1081-T1084 PolarHBondContact O-OG1 2.63Å; Q1081-G1085 PolarHBondContact O-N 2.98Å; Q1081-K1086 PolarHBondContact NE2-O 3.09Å
1082	V	86.1	Confident	84.7	Confident	12 Å²	12	72.3 Å²	72.3	7%	0.073	37%	0.368	C	S	.	.	H	α-helix	trans	-61.5	-39.3	174.6	173.9	0	0	0	0	110.4	F947 P990 V991 V994 V1078 N1079 L1080	F947-V1082 HydrophobicContact CB-CG2 4.34Å; F947-V1082 HydrophobicContact CD1-CG2 4.19Å; F947-V1082 HydrophobicContact CG-CG2 4.25Å; P990-V1082 HydrophobicContact CB-CG1 4.12Å; V991-V1082 HydrophobicContact CG2-CG2 3.85Å; V994-V1082 HydrophobicContact CG2-CG1 3.62Å; V1078-V1082 VanDerWaalsContact O-CG2 3.29Å; V1078-V1082 WeakPolarHBondContact O-CG2 3.44Å; V1078-V1082 PolarHBondContact O-N 3.14Å; N1079-V1082 PolarHBondContact O-N 3.37Å; L1080-V1082 VanDerWaalsContact C-N 3.34Å; L1080-V1082 PolarHBondContact O-N 3.46Å
1083	R	81.4	Confident	84.1	Confident	224 Å²	224	73.6 Å²	73.6	85%	0.845	37%	0.367	S	S	*	.	H	α-helix	trans	-69.1	-41	177.1	178.6	179.6	174.6	166.6	0	113.6	N1079 L1080 Q1081 G1085	N1079-R1083 PolarHBondContact O-N 3.41Å; L1080-R1083 WeakPolarHBondContact O-CB 3.39Å; L1080-R1083 PolarHBondContact O-N 3.02Å; L1080-R1083 VanDerWaalsContact O-N 3.16Å; Q1081-R1083 VanDerWaalsContact C-N 3.27Å; Q1081-R1083 PolarHBondContact O-N 3.43Å; R1083-G1085 PolarHBondContact O-N 3.39Å
1084	T	75.1	Confident	83.4	Confident	70 Å²	70	76.2 Å²	76.2	43%	0.429	37%	0.374	S	S	.	.	H	α-helix	trans	-72.4	-15.3	-175.4	54.3	0	0	0	0	113	L1080 Q1081 K1086	L1080-T1084 HydrophobicContact CD2-CG2 3.96Å; L1080-T1084 WeakPolarHBondContact O-CG2 3.47Å; L1080-T1084 PolarHBondContact O-N 3.39Å; L1080-T1084 PolarHBondContact O-OG1 2.89Å; Q1081-T1084 PolarHBondContact O-N 3.12Å; Q1081-T1084 PolarHBondContact O-OG1 2.63Å; T1084-K1086 PolarHBondContact O-N 3.5Å
1085	G	59.7	Low	82.5	Confident	48 Å²	48	82.6 Å²	82.6	50%	0.495	41%	0.406	S	S	.	.			trans	66.3	5.1	171.2	0	0	0	0	0	114.9	Q1081 R1083	Q1081-G1085 PolarHBondContact O-N 2.98Å; R1083-G1085 PolarHBondContact O-N 3.39Å
1086	K	49	Very low	81.6	Confident	197 Å²	197	87.5 Å²	87.5	86%	0.857	43%	0.427	S	S	*	.			trans	-92.8	0	179.1	-72.9	-177.9	178.3	-179.5	0	111.4	R946 Q1081 T1084	R946-K1086 PolarHBondContact NH1-OXT 3.23Å; R946-K1086 PolarHBondContact NH2-O 3.35Å; R946-K1086 PolarHBondContact NH2-OXT 3.25Å; R946-K1086 VanDerWaalsContact NH2-OXT 3.09Å; Q1081-K1086 PolarHBondContact NE2-O 3.09Å; T1084-K1086 PolarHBondContact O-N 3.5Å

Retrieved 1,086 of 1,086 residues in 487.9 ms (Link to these results)

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