A0A093HXL8_STRCA Loading...

SLIT and NTRK-like 2

AlphaFold DB , UniProt , Accession A0A093HXL8, Species STRCA (Struthio camelus australis), Gene n/a, Length 857 aa.

						>A0A093HXL8_STRCA|A0A093HXL8
MLKGVWLLSLLTVAGISQTESRKPAKDICSKSRCPCEEKENVLNINCENKGFTTVSLLQPPPSKIYQLFLNGNALTRLFPNEFVNYSNAVTLHLGNNDMQEIRTGAFSGLRTLKRLHLNNNKLEVLREDTFLGLESLEYLQADYNYISAIEAGAFSKLNKLKVLILNDNLLLSLPSNVFRFVLLTHLDLRGNRLKMMPFAGVLEHIGGIMEIQLEENPWNCTCDLLPLKAWLDTITVFVGEIVCETPFRLHGKDVTQLTRQDLCPRKSSSDSNQREKQPVLSDPHISRLSPTANSAISPTRAPKASRPPKTRNRPTPRVTVSKDRQIFGPIMVYQTKSPVPITCPAGCICTSQSSDNGLNVNCQEKKISNISDLHPKPTSPKKLYLTSNYLQVIYRTDLTEYSSLDLLHLGNNRIAVIQEGAFTNLTSLRRLYLNGNYLEILYPSMFDGLHSLQYLYLEYNVIKEILPHTFDALSNLHLLFLNNNLLRSLPDNVFGGTSLTRLNLRNNHFSHLPVRGVLDQLSALIQIDLQENPWDCTCDIMGLRNWIERVTDQNNQQANPPVVINEVICESPTKHSGEHLKFLSKEAICPENPNLSDSSLLSVNQNTDAPHLLGISPSSYPEIHTEVPLSVLILGLLVVFILSVCFGAGLFVFVLKRRKGVQSMPSSANNLDISSFQLQYGSYNTETHDKTEGHVYNYIPPPVGQMCQNPIYMQKEGDPVAYYRNLHEFGYSNLDHKKEDPATLAFTISAAELLEKQSSPREPELLYQNIAERVKELPAGGLVHYNFCTLPKRQFAPSYESRRQNQDRINKTVLYGTPRKYFAEQSKPEHPLLQGKLQTEPDYLEVLEKQTAISQL
					

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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	34.8	Very low	32.6	Very low	248 Å²	248	157.5 Å²	157.5	100%	1.222	83%	0.834	S	S	*	*				0	171.1	0	-95.3	-179.1	165.2	0	0	109.4
2	L	30.9	Very low	32.6	Very low	149 Å²	149	153.8 Å²	153.8	78%	0.78	82%	0.823	S	S	*	*			trans	-68.1	162.9	-165.9	-79.9	71.5	0	0	0	116.9
3	K	33.4	Very low	32.5	Very low	205 Å²	205	152.8 Å²	152.8	89%	0.891	83%	0.825	S	S	*	*			trans	91.5	135.7	149.6	-77.1	156.6	-179.6	-173.9	0	119.3
4	G	34.1	Very low	32.4	Very low	80 Å²	80	148.4 Å²	148.4	83%	0.825	82%	0.82	S	S	*	*			trans	148.7	53.6	175.8	0	0	0	0	0	114
5	V	37	Very low	32.1	Very low	131 Å²	131	143.9 Å²	143.9	79%	0.794	82%	0.82	S	S	*	*			trans	-97.5	123.2	-173.1	157	0	0	0	0	112.1
6	W	32.3	Very low	32.1	Very low	224 Å²	224	145.6 Å²	145.6	85%	0.848	82%	0.824	S	S	*	*			trans	47.3	125.6	151.5	-73.2	62.6	0	0	0	121
7	L	33.8	Very low	31.9	Very low	167 Å²	167	143.7 Å²	143.7	87%	0.874	82%	0.822	S	S	*	*			trans	-149.4	158.3	140.8	-115.2	148.6	0	0	0	110.9
8	L	32.3	Very low	32	Very low	140 Å²	140	145.9 Å²	145.9	73%	0.733	82%	0.824	S	S	*	*			trans	-82.9	140.3	-149.5	-74.2	81.9	0	0	0	116.3
9	S	28.5	Very low	31.7	Very low	99 Å²	99	145.4 Å²	145.4	69%	0.692	83%	0.825	S	S	*	*				17.6	117	127.6	164.1	0	0	0	0	118.9
10	L	30.8	Very low	31.5	Very low	152 Å²	152	147.3 Å²	147.3	80%	0.796	83%	0.826	S	S	*	*				-175.9	150.9	117.1	-98.5	157.4	0	0	0	113.3
11	L	31	Very low	31.2	Very low	138 Å²	138	145.6 Å²	145.6	72%	0.723	82%	0.824	S	S	*	*			trans	68.1	96.5	153.6	-66.2	168.1	0	0	0	122.6
12	T	32	Very low	30.9	Very low	113 Å²	113	145 Å²	145	69%	0.693	81%	0.808	S	S	*	*				69	122.6	122	54.5	0	0	0	0	124.2
13	V	31.9	Very low	30.8	Very low	141 Å²	141	147.2 Å²	147.2	86%	0.855	81%	0.812	S	S	*	*				66.4	130.4	128.2	178.9	0	0	0	0	117.8
14	A	30.7	Very low	30.8	Very low	91 Å²	91	142.7 Å²	142.7	75%	0.752	80%	0.803	S	S	*	*			cis	-137.7	159	18.4	0	0	0	0	0	113
15	G	27.9	Very low	30.9	Very low	80 Å²	80	141.4 Å²	141.4	83%	0.825	79%	0.785	S	S	*	*			trans	-94.5	140.2	175.7	0	0	0	0	0	113.5
16	I	32.1	Very low	31.2	Very low	171 Å²	171	142.7 Å²	142.7	88%	0.877	78%	0.78	S	S	*	*			trans	-98.2	127	165	-60.3	172.4	0	0	0	108
17	S	28.2	Very low	32.4	Very low	114 Å²	114	135.2 Å²	135.2	80%	0.797	76%	0.756	S	S	*	*			trans	-154	135.1	156.1	-164.9	0	0	0	0	110.1
18	Q	33.3	Very low	33.9	Very low	183 Å²	183	127.7 Å²	127.7	86%	0.855	72%	0.717	S	S	*	*			trans	-89.3	133.7	177.3	-66.1	172.3	-25.9	0	0	109.7
19	T	27.6	Very low	35.5	Very low	136 Å²	136	123.5 Å²	123.5	83%	0.834	70%	0.699	S	S	*	*			trans	-133.9	152.7	158.6	45.5	0	0	0	0	110.9
20	E	26.6	Very low	36.8	Very low	183 Å²	183	122.2 Å²	122.2	86%	0.855	69%	0.69	S	S	*	*			trans	-49.1	142.9	-157.9	-62.4	163.5	100.4	0	0	117.2	R22	E20-R22 PolarHBondContact O-N 3.11Å
21	S	26.3	Very low	37.8	Very low	112 Å²	112	121.6 Å²	121.6	78%	0.783	68%	0.68	S	S	*	*			trans	-62.4	98.7	165.1	-178.2	0	0	0	0	110.6	K23	S21-K23 PolarHBondContact O-N 3.26Å
22	R	29	Very low	38.8	Very low	236 Å²	236	120.7 Å²	120.7	89%	0.891	69%	0.686	S	S	*	*	P	Polyproline II helix	trans	-60.5	121.1	157.7	-84.4	-177.7	167.4	175.8	-4	108	E20	E20-R22 PolarHBondContact O-N 3.11Å
23	K	27.2	Very low	40.3	Very low	196 Å²	196	121.8 Å²	121.8	85%	0.852	68%	0.677	S	S	*	*	P	Polyproline II helix	trans	-47.7	124.9	176.8	-63.5	169.9	-177.9	171.4	0	109.7	S21	S21-K23 PolarHBondContact O-N 3.26Å
24	P	34.5	Very low	42.3	Very low	109 Å²	109	115.2 Å²	115.2	71%	0.708	64%	0.638	S	S	*	*	P	Polyproline II helix	trans	-62.3	148.6	174.2	26.2	-33.4	0	0	0	110.2
25	A	35	Very low	44.6	Very low	54 Å²	54	113.9 Å²	113.9	45%	0.446	62%	0.621	S	S	.	*	P	Polyproline II helix	trans	-64.4	160.9	166.7	0	0	0	0	0	109.8	D27	A25-D27 PolarHBondContact O-N 2.93Å
26	K	44.7	Very low	47.1	Very low	157 Å²	157	111.8 Å²	111.8	68%	0.683	59%	0.594	S	S	*	*			trans	-85.1	95.1	-176.9	-63.9	166.2	-174.1	164.3	0	109.2	K31	K26-K31 HydrophobicContact CD-CD 4.27Å
27	D	57.5	Low	49.2	Very low	67 Å²	67	105.9 Å²	105.9	36%	0.358	56%	0.562	S	S	.	*			trans	-55.1	144.3	174.1	-56.1	-62.2	0	0	0	111.1	A25 C29 S30	A25-D27 PolarHBondContact O-N 2.93Å; D27-C29 PolarHBondContact O-N 3.3Å; D27-C29 VanDerWaalsContact O-N 3.14Å; D27-S30 PolarHBondContact N-OG 3.43Å; D27-S30 WeakPolarHBondContact O-CB 3.33Å; D27-S30 PolarHBondContact O-N 3.26Å; D27-S30 PolarHBondContact O-OG 2.88Å
28	I	65.4	Low	51.5	Low	10 Å²	10	105 Å²	105	5%	0.051	55%	0.546	C	S	.	.	G	3₁₀ helix	trans	-43.1	-50.1	175.1	-73.4	162.9	0	0	0	111.8	S30 C34 I45 L58 Q59 P60	I28-S30 VanDerWaalsContact C-N 3.31Å; I28-S30 PolarHBondContact O-N 2.88Å; I28-C34 HydrophobicContact CG2-CB 3.83Å; I28-I45 HydrophobicContact CG2-CG2 3.89Å; I28-L58 HydrophobicContact CD1-CB 3.71Å; I28-L58 HydrophobicContact CD1-CD2 4.24Å; I28-L58 HydrophobicContact CG1-CB 3.92Å; I28-L58 HydrophobicContact CG1-CD2 3.94Å; I28-L58 HydrophobicContact CG2-CD2 4.38Å; I28-Q59 WeakPolarHBondContact CG1-O 3.38Å; I28-Q59 PolarHBondContact N-O 3.49Å; I28-Q59 VanDerWaalsContact N-O 3.12Å; I28-P60 HydrophobicContact CD1-CB 4.15Å
29	C	64.8	Low	52.5	Low	52 Å²	52	98.4 Å²	98.4	35%	0.351	51%	0.514	S	S	.	.	G	3₁₀ helix	trans	-73.5	-20.5	-173.8	-46.5	0	0	0	0	113.1	D27 K31 C36	D27-C29 PolarHBondContact O-N 3.3Å; D27-C29 VanDerWaalsContact O-N 3.14Å; C29-K31 VanDerWaalsContact C-N 3.29Å; C29-K31 PolarHBondContact O-N 2.86Å; C29-C36 VanDerWaalsContact CA-SG 3.51Å; C29-C36 HydrophobicContact CB-CB 3.66Å; C29-C36 WeakPolarHBondContact CB-SG 3.37Å; C29-C36 WeakPolarHBondContact SG-CB 3.36Å; C29-C36 CovalentContact SG-SG 2.04Å; C29-C36 PolarHBondContact SG-SG 3.5Å
30	S	56.1	Low	53.9	Low	71 Å²	71	97.6 Å²	97.6	50%	0.497	50%	0.501	S	S	.	.	G	3₁₀ helix	trans	-76.1	-12.1	-176.6	73	0	0	0	0	114.4	D27 I28	D27-S30 PolarHBondContact N-OG 3.43Å; D27-S30 WeakPolarHBondContact O-CB 3.33Å; D27-S30 PolarHBondContact O-N 3.26Å; D27-S30 PolarHBondContact O-OG 2.88Å; I28-S30 VanDerWaalsContact C-N 3.31Å; I28-S30 PolarHBondContact O-N 2.88Å
31	K	51.6	Low	55.9	Low	139 Å²	139	95.2 Å²	95.2	60%	0.604	49%	0.494	S	S	*	.	G	3₁₀ helix	trans	-144.6	32	-168.2	-118.7	176.8	-171.6	-56.9	0	115.5	K26 C29 R33	K26-K31 HydrophobicContact CD-CD 4.27Å; C29-K31 VanDerWaalsContact C-N 3.29Å; C29-K31 PolarHBondContact O-N 2.86Å; K31-R33 VanDerWaalsContact C-N 3.33Å; K31-R33 PolarHBondContact O-N 2.86Å; K31-R33 VanDerWaalsContact O-N 3.15Å
32	S	51.6	Low	58.2	Low	119 Å²	119	91.2 Å²	91.2	83%	0.832	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.8	46.1	163.7	71.6	0	0	0	0	115.2
33	R	64.6	Low	60.8	Low	136 Å²	136	80.7 Å²	80.7	51%	0.513	43%	0.426	S	S	.	.	S	Bend	trans	-93.3	-36	166.2	-85.2	-173.7	165.6	-170.8	-6.9	112	K31 F52 L57	K31-R33 VanDerWaalsContact C-N 3.33Å; K31-R33 PolarHBondContact O-N 2.86Å; K31-R33 VanDerWaalsContact O-N 3.15Å; R33-F52 HydrophobicContact CB-CZ 4.26Å; R33-L57 PolarHBondContact NH1-O 3.46Å; R33-L57 VanDerWaalsContact NH1-O 3.11Å
34	C	73.2	Confident	63.4	Low	4 Å²	4	71.8 Å²	71.8	3%	0.027	39%	0.388	C	S	.	.	S	Bend	trans	-135.3	133.3	174.8	-52.8	0	0	0	0	107.1	I28 I45 N46 C47	I28-C34 HydrophobicContact CG2-CB 3.83Å; C34-I45 HydrophobicContact CB-CG2 4.18Å; C34-N46 WeakPolarHBondContact CA-O 3.36Å; C34-N46 VanDerWaalsContact CB-O 3.22Å; C34-N46 WeakPolarHBondContact CB-O 3.48Å; C34-C47 HydrophobicContact CB-CB 4.04Å; C34-C47 WeakPolarHBondContact CB-SG 3.46Å; C34-C47 WeakPolarHBondContact SG-CA 3.31Å; C34-C47 WeakPolarHBondContact SG-CB 3.27Å; C34-C47 CovalentContact SG-SG 2.03Å; C34-C47 PolarHBondContact SG-SG 3.34Å
35	P	78.8	Confident	65.9	Low	63 Å²	63	66.6 Å²	66.6	41%	0.409	35%	0.354	S	S	.	.			trans	-54	148.7	159	20.7	-32.6	0	0	0	111.6	N46	P35-N46 WeakPolarHBondContact CD-O 3.32Å; P35-N46 HydrophobicContact CG-CB 4.16Å; P35-N46 WeakPolarHBondContact CG-O 3.32Å; P35-N46 PolarHBondContact O-N 3.15Å; P35-N46 VanDerWaalsContact O-N 3.08Å
36	C	81.3	Confident	68.1	Low	36 Å²	36	65 Å²	65	24%	0.243	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	121.3	172.9	-57.1	0	0	0	0	109.1	C29 L43 N44	C29-C36 VanDerWaalsContact CA-SG 3.51Å; C29-C36 HydrophobicContact CB-CB 3.66Å; C29-C36 WeakPolarHBondContact CB-SG 3.37Å; C29-C36 WeakPolarHBondContact SG-CB 3.36Å; C29-C36 CovalentContact SG-SG 2.04Å; C29-C36 PolarHBondContact SG-SG 3.5Å; C36-L43 HydrophobicContact CB-CD1 4.12Å; C36-L43 HydrophobicContact CB-CG 4.37Å; C36-N44 CarbonylContact C-O 3.55Å; C36-N44 VanDerWaalsContact CA-O 3.22Å; C36-N44 WeakPolarHBondContact CA-O 3.42Å
37	E	76.9	Confident	70.1	Confident	47 Å²	47	57.5 Å²	57.5	22%	0.22	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	157.9	172.3	-59	97.7	-134.9	0	0	110.6	L43 N44 E579	E37-L43 CarbonylContact O-C 3.55Å; E37-L43 VanDerWaalsContact O-CA 3.24Å; E37-L43 WeakPolarHBondContact O-CA 3.27Å; E37-L43 WeakPolarHBondContact O-CD1 3.43Å; E37-N44 PolarHBondContact N-O 3.28Å; E37-N44 PolarHBondContact O-N 2.85Å; E37-E579 HydrophobicContact CG-CG 4.05Å
38	E	75	Confident	71.3	Confident	95 Å²	95	56.5 Å²	56.5	44%	0.444	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	129.2	-179.9	-171.7	176.2	169.6	0	0	112.4	L43 K64	E38-L43 HydrophobicContact CB-CD1 3.94Å; E38-L43 HydrophobicContact CG-CD1 4.47Å; E38-K64 WeakPolarHBondContact OE1-CD 3.44Å; E38-K64 IonicContact OE1-NZ 3.45Å; E38-K64 PolarHBondContact OE1-NZ 3.32Å; E38-K64 IonicContact OE2-NZ 3.08Å; E38-K64 PolarHBondContact OE2-NZ 3.03Å
39	K	56	Low	72.1	Confident	45 Å²	45	61.9 Å²	61.9	20%	0.196	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.3	150.8	174.8	-158.3	-141.7	77.7	-175.7	0	112.8	N41 V42 K582 F583	K39-N41 PolarHBondContact O-N 3.3Å; K39-V42 PolarHBondContact N-O 3.49Å; K39-V42 CarbonylContact O-C 3.38Å; K39-V42 WeakPolarHBondContact O-CA 3.48Å; K39-V42 PolarHBondContact O-N 3.39Å; K39-K582 PolarHBondContact NZ-O 3.2Å; K39-F583 HydrophobicContact CB-CD1 3.9Å; K39-F583 HydrophobicContact CD-CB 3.62Å; K39-F583 HydrophobicContact CD-CD1 3.63Å; K39-F583 HydrophobicContact CD-CE1 4.42Å; K39-F583 HydrophobicContact CD-CG 3.79Å; K39-F583 WeakPolarHBondContact CD-O 3.35Å; K39-F583 HydrophobicContact CG-CD1 4.43Å; K39-F583 VanDerWaalsContact NZ-CD1 3.28Å
40	E	55.9	Low	72.8	Confident	118 Å²	118	64.6 Å²	64.6	55%	0.551	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.7	23.6	-177.3	-87.8	161.1	-143.7	0	0	113.3	V42	E40-V42 PolarHBondContact O-N 2.84Å
41	N	69.4	Low	74	Confident	133 Å²	133	63.5 Å²	63.5	71%	0.711	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.7	18	-171.6	-43.4	-76.2	0	0	0	114.8	K39	K39-N41 PolarHBondContact O-N 3.3Å
42	V	74.5	Confident	75.5	Confident	29 Å²	29	57.6 Å²	57.6	18%	0.176	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	130.5	170.6	-175.4	0	0	0	0	108.7	K39 E40 I65 Q67	K39-V42 PolarHBondContact N-O 3.49Å; K39-V42 CarbonylContact O-C 3.38Å; K39-V42 WeakPolarHBondContact O-CA 3.48Å; K39-V42 PolarHBondContact O-N 3.39Å; E40-V42 PolarHBondContact O-N 2.84Å; V42-I65 CarbonylContact C-O 3.51Å; V42-I65 WeakPolarHBondContact CA-O 3.38Å; V42-I65 HydrophobicContact CG1-CG2 4.31Å; V42-I65 HydrophobicContact CG2-CB 4.3Å; V42-I65 HydrophobicContact CG2-CG2 4.01Å; V42-Q67 HydrophobicContact CG1-CG 4.05Å
43	L	82.3	Confident	76.9	Confident	15 Å²	15	55.9 Å²	55.9	8%	0.079	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	123.8	176.9	-178.4	87.9	0	0	0	109	C36 E37 E38 I45 P61 I65 Y66 Q67	C36-L43 HydrophobicContact CB-CD1 4.12Å; C36-L43 HydrophobicContact CB-CG 4.37Å; E37-L43 CarbonylContact O-C 3.55Å; E37-L43 VanDerWaalsContact O-CA 3.24Å; E37-L43 WeakPolarHBondContact O-CA 3.27Å; E37-L43 WeakPolarHBondContact O-CD1 3.43Å; E38-L43 HydrophobicContact CB-CD1 3.94Å; E38-L43 HydrophobicContact CG-CD1 4.47Å; L43-I45 HydrophobicContact CD2-CD1 3.99Å; L43-I45 HydrophobicContact CD2-CG1 3.88Å; L43-I45 HydrophobicContact CG-CG1 4.19Å; L43-P61 HydrophobicContact CD2-CG 3.44Å; L43-P61 VanDerWaalsContact CD2-CG 3.44Å; L43-I65 PolarHBondContact N-O 3.42Å; L43-Y66 CarbonylContact O-C 3.34Å; L43-Y66 WeakPolarHBondContact O-CA 3.4Å; L43-Y66 WeakPolarHBondContact O-CB 3.32Å; L43-Q67 PolarHBondContact O-N 2.81Å
44	N	82.9	Confident	77.6	Confident	9 Å²	9	51.2 Å²	51.2	5%	0.048	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	125.8	173.2	-76.2	17.3	0	0	0	108.6	C36 E37 Q67 F69 H580	C36-N44 CarbonylContact C-O 3.55Å; C36-N44 VanDerWaalsContact CA-O 3.22Å; C36-N44 WeakPolarHBondContact CA-O 3.42Å; E37-N44 PolarHBondContact N-O 3.28Å; E37-N44 PolarHBondContact O-N 2.85Å; N44-Q67 PolarHBondContact ND2-OE1 3.34Å; N44-Q67 VanDerWaalsContact ND2-OE1 3.07Å; N44-Q67 WeakPolarHBondContact OD1-CB 3.36Å; N44-Q67 WeakPolarHBondContact OD1-CG 3.33Å; N44-Q67 PolarHBondContact OD1-OE1 3.11Å; N44-F69 HydrophobicContact CB-CE2 4.3Å; N44-H580 PolarHBondContact ND2-CE1 2.75Å; N44-H580 PolarHBondContact ND2-NE2 3.27Å
45	I	85.7	Confident	78	Confident	0 Å²	0	51 Å²	51	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	100.3	-177.2	-54.3	177.5	0	0	0	108.3	I28 C34 L43 Y66 Q67 L68 F69	I28-I45 HydrophobicContact CG2-CG2 3.89Å; C34-I45 HydrophobicContact CB-CG2 4.18Å; L43-I45 HydrophobicContact CD2-CD1 3.99Å; L43-I45 HydrophobicContact CD2-CG1 3.88Å; L43-I45 HydrophobicContact CG-CG1 4.19Å; I45-Y66 HydrophobicContact CD1-CD2 3.92Å; I45-Y66 HydrophobicContact CD1-CE2 4.34Å; I45-Y66 HydrophobicContact CD1-CG 4.04Å; I45-Q67 PolarHBondContact N-O 2.85Å; I45-L68 HydrophobicContact CB-CD1 3.97Å; I45-L68 HydrophobicContact CG2-CD1 3.82Å; I45-F69 PolarHBondContact O-N 3.45Å
46	N	83.1	Confident	77.6	Confident	20 Å²	20	52.2 Å²	52.2	11%	0.107	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	107.5	-179.3	-178.2	-28.7	0	0	0	111.1	C34 P35 E48 F69	C34-N46 WeakPolarHBondContact CA-O 3.36Å; C34-N46 VanDerWaalsContact CB-O 3.22Å; C34-N46 WeakPolarHBondContact CB-O 3.48Å; P35-N46 WeakPolarHBondContact CD-O 3.32Å; P35-N46 HydrophobicContact CG-CB 4.16Å; P35-N46 WeakPolarHBondContact CG-O 3.32Å; P35-N46 PolarHBondContact O-N 3.15Å; P35-N46 VanDerWaalsContact O-N 3.08Å; N46-E48 WeakPolarHBondContact OD1-CB 3.28Å; N46-E48 WeakPolarHBondContact OD1-CG 3.46Å; N46-E48 PolarHBondContact OD1-N 2.67Å; N46-F69 HydrophobicContact CB-CD2 4.42Å
47	C	84.8	Confident	76.9	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	30%	0.296	C	S	.	.			trans	-111.2	25.1	179.2	-69.8	0	0	0	0	112.2	C34 K50 F52 F69 L70 N73	C34-C47 HydrophobicContact CB-CB 4.04Å; C34-C47 WeakPolarHBondContact CB-SG 3.46Å; C34-C47 WeakPolarHBondContact SG-CA 3.31Å; C34-C47 WeakPolarHBondContact SG-CB 3.27Å; C34-C47 CovalentContact SG-SG 2.03Å; C34-C47 PolarHBondContact SG-SG 3.34Å; C47-K50 WeakPolarHBondContact O-CG 3.41Å; C47-F52 HydrophobicContact CB-CD2 4.16Å; C47-F52 HydrophobicContact CB-CE2 3.74Å; C47-F69 CarbonylContact C-O 3.27Å; C47-F69 VanDerWaalsContact CA-O 3.25Å; C47-F69 WeakPolarHBondContact CA-O 3.29Å; C47-F69 VanDerWaalsContact CB-O 3.26Å; C47-F69 WeakPolarHBondContact CB-O 3.49Å; C47-F69 PolarHBondContact N-O 3.29Å; C47-L70 HydrophobicContact CB-CD2 3.52Å; C47-L70 HydrophobicContact CB-CG 4.3Å; C47-N73 PolarHBondContact O-ND2 3.42Å
48	E	83.4	Confident	76.6	Confident	46 Å²	46	52.7 Å²	52.7	22%	0.215	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.1	146.3	-171.9	-62.3	-171.8	148.5	0	0	114.2	N46 K50 F69 N71	N46-E48 WeakPolarHBondContact OD1-CB 3.28Å; N46-E48 WeakPolarHBondContact OD1-CG 3.46Å; N46-E48 PolarHBondContact OD1-N 2.67Å; E48-K50 VanDerWaalsContact O-CD 3.3Å; E48-K50 WeakPolarHBondContact O-CD 3.27Å; E48-K50 VanDerWaalsContact O-CE 3.27Å; E48-K50 WeakPolarHBondContact O-CE 3.3Å; E48-K50 WeakPolarHBondContact O-CG 3.45Å; E48-K50 PolarHBondContact O-N 3.21Å; E48-K50 VanDerWaalsContact O-N 3.11Å; E48-K50 PolarHBondContact O-NZ 3.29Å; E48-F69 HydrophobicContact CG-CB 3.76Å; E48-N71 WeakPolarHBondContact CA-O 3.29Å; E48-N71 HydrophobicContact CG-CB 4.08Å; E48-N71 WeakPolarHBondContact OE1-CB 3.39Å; E48-N71 PolarHBondContact OE1-ND2 3.33Å
49	N	81.7	Confident	76.4	Confident	123 Å²	123	52.5 Å²	52.5	66%	0.658	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.2	28.3	176.2	-62.8	-60.5	0	0	0	114.7	N71	N49-N71 PolarHBondContact N-O 3.11Å
50	K	81.1	Confident	77.1	Confident	109 Å²	109	50.8 Å²	50.8	47%	0.474	28%	0.281	S	S	.	.	S	Bend	trans	-92.3	-5.1	-179.3	-53.2	-50.7	178.6	-135.4	0	114.1	C47 E48 F52 N73	C47-K50 WeakPolarHBondContact O-CG 3.41Å; E48-K50 VanDerWaalsContact O-CD 3.3Å; E48-K50 WeakPolarHBondContact O-CD 3.27Å; E48-K50 VanDerWaalsContact O-CE 3.27Å; E48-K50 WeakPolarHBondContact O-CE 3.3Å; E48-K50 WeakPolarHBondContact O-CG 3.45Å; E48-K50 PolarHBondContact O-N 3.21Å; E48-K50 VanDerWaalsContact O-N 3.11Å; E48-K50 PolarHBondContact O-NZ 3.29Å; K50-F52 HydrophobicContact CB-CD2 3.74Å; K50-F52 HydrophobicContact CB-CE2 3.39Å; K50-F52 HydrophobicContact CB-CZ 3.93Å; K50-F52 HydrophobicContact CG-CD2 4.36Å; K50-F52 HydrophobicContact CG-CE2 3.68Å; K50-F52 HydrophobicContact CG-CZ 4.3Å; K50-N73 PolarHBondContact N-OD1 3.11Å; K50-N73 VanDerWaalsContact N-OD1 3.11Å
51	G	81.1	Confident	77.7	Confident	47 Å²	47	46 Å²	46	49%	0.485	26%	0.26	S	S	.	.			trans	72.5	27.4	-178	0	0	0	0	0	114.6	T53 N73	G51-T53 PolarHBondContact O-N 2.95Å; G51-N73 PolarHBondContact N-OD1 2.8Å
52	F	81.9	Confident	77.6	Confident	16 Å²	16	44.4 Å²	44.4	7%	0.07	26%	0.257	C	S	.	.			trans	-62	130	175.7	-68.5	-63	0	0	0	111.4	R33 C47 K50 L58 L70 N73 A74 L75	R33-F52 HydrophobicContact CB-CZ 4.26Å; C47-F52 HydrophobicContact CB-CD2 4.16Å; C47-F52 HydrophobicContact CB-CE2 3.74Å; K50-F52 HydrophobicContact CB-CD2 3.74Å; K50-F52 HydrophobicContact CB-CE2 3.39Å; K50-F52 HydrophobicContact CB-CZ 3.93Å; K50-F52 HydrophobicContact CG-CD2 4.36Å; K50-F52 HydrophobicContact CG-CE2 3.68Å; K50-F52 HydrophobicContact CG-CZ 4.3Å; F52-L58 HydrophobicContact CD2-CD1 4.36Å; F52-L58 HydrophobicContact CE1-CD2 4.05Å; F52-L58 HydrophobicContact CE1-CG 4.43Å; F52-L58 HydrophobicContact CE2-CD1 4.43Å; F52-L58 HydrophobicContact CE2-CD2 4.29Å; F52-L58 HydrophobicContact CG-CD1 4.48Å; F52-L58 HydrophobicContact CZ-CD2 3.84Å; F52-L70 HydrophobicContact CD2-CD2 4.16Å; F52-N73 HydrophobicContact CB-CB 4.23Å; F52-N73 WeakPolarHBondContact CD2-OD1 3.42Å; F52-N73 PolarHBondContact N-OD1 2.84Å; F52-A74 CarbonylContact O-C 3.06Å; F52-A74 VanDerWaalsContact O-C 3.27Å; F52-A74 WeakPolarHBondContact O-CA 3.33Å; F52-A74 PolarHBondContact O-N 3.11Å; F52-L75 HydrophobicContact CB-CD2 4.35Å; F52-L75 WeakPolarHBondContact O-CD2 3.46Å; F52-L75 PolarHBondContact O-N 3.41Å
53	T	81.5	Confident	77.4	Confident	82 Å²	82	47.9 Å²	47.9	50%	0.503	28%	0.283	S	S	.	.	S	Bend	trans	-100.5	-19.3	177.8	52.1	0	0	0	0	113.6	G51 A74	G51-T53 PolarHBondContact O-N 2.95Å; T53-A74 HydrophobicContact CG2-CB 4.02Å
54	T	79.6	Confident	77	Confident	39 Å²	39	50.9 Å²	50.9	24%	0.239	30%	0.295	C	S	.	.			trans	-145.1	146.3	174.8	50.2	0	0	0	0	110.5	S56 L57 E82	T54-S56 VanDerWaalsContact C-N 3.29Å; T54-L57 WeakPolarHBondContact OG1-CG 3.45Å; T54-E82 WeakPolarHBondContact CB-OE1 3.4Å
55	V	80.6	Confident	77	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	31%	0.312	C	S	.	.	G	3₁₀ helix	trans	-73.7	-27.3	175.6	-175.5	0	0	0	0	110.2	L57 L58 L70 L75 L78 E82 F83 Y86	V55-L57 PolarHBondContact O-N 3.31Å; V55-L58 WeakPolarHBondContact O-CB 3.05Å; V55-L58 PolarHBondContact O-N 3.4Å; V55-L70 HydrophobicContact CG2-CD1 4.42Å; V55-L75 HydrophobicContact CG2-CD1 4.21Å; V55-L75 HydrophobicContact CG2-CD2 4.19Å; V55-L78 HydrophobicContact CG2-CD2 4.01Å; V55-E82 HydrophobicContact CB-CB 4.44Å; V55-E82 HydrophobicContact CB-CG 4.31Å; V55-E82 PolarHBondContact N-OE1 3.14Å; V55-F83 HydrophobicContact CB-CZ 4.43Å; V55-F83 HydrophobicContact CG1-CD1 4.18Å; V55-F83 HydrophobicContact CG1-CE1 3.77Å; V55-F83 HydrophobicContact CG1-CZ 4.02Å; V55-F83 HydrophobicContact CG2-CE1 4.36Å; V55-F83 HydrophobicContact CG2-CE2 4.19Å; V55-F83 HydrophobicContact CG2-CZ 3.78Å; V55-Y86 HydrophobicContact CG1-CE1 4.34Å; V55-Y86 HydrophobicContact CG1-CE2 4.04Å; V55-Y86 WeakPolarHBondContact CG1-OH 3.42Å; V55-Y86 PolarHBondContact O-OH 2.95Å
56	S	70.2	Confident	76.9	Confident	87 Å²	87	54.4 Å²	54.4	61%	0.608	31%	0.313	S	S	*	.	G	3₁₀ helix	trans	-56.6	-14.5	175.5	-57.7	0	0	0	0	115.4	T54 E82	T54-S56 VanDerWaalsContact C-N 3.29Å; S56-E82 PolarHBondContact N-OE1 2.82Å; S56-E82 VanDerWaalsContact N-OE1 3.1Å; S56-E82 VanDerWaalsContact OG-CG 3.29Å; S56-E82 WeakPolarHBondContact OG-CG 3.26Å; S56-E82 PolarHBondContact OG-OE1 2.89Å
57	L	66.6	Low	77	Confident	83 Å²	83	54 Å²	54	44%	0.435	31%	0.31	S	S	.	.	G	3₁₀ helix	trans	-81.5	-1.2	174.9	-70.3	170.4	0	0	0	114	R33 T54 V55	R33-L57 PolarHBondContact NH1-O 3.46Å; R33-L57 VanDerWaalsContact NH1-O 3.11Å; T54-L57 WeakPolarHBondContact OG1-CG 3.45Å; V55-L57 PolarHBondContact O-N 3.31Å
58	L	71.2	Confident	77.1	Confident	10 Å²	10	54 Å²	54	5%	0.052	31%	0.31	C	S	.	.			trans	-120.6	131	-177.9	-63.9	165	0	0	0	107.8	I28 F52 V55 L70 Y86	I28-L58 HydrophobicContact CD1-CB 3.71Å; I28-L58 HydrophobicContact CD1-CD2 4.24Å; I28-L58 HydrophobicContact CG1-CB 3.92Å; I28-L58 HydrophobicContact CG1-CD2 3.94Å; I28-L58 HydrophobicContact CG2-CD2 4.38Å; F52-L58 HydrophobicContact CD2-CD1 4.36Å; F52-L58 HydrophobicContact CE1-CD2 4.05Å; F52-L58 HydrophobicContact CE1-CG 4.43Å; F52-L58 HydrophobicContact CE2-CD1 4.43Å; F52-L58 HydrophobicContact CE2-CD2 4.29Å; F52-L58 HydrophobicContact CG-CD1 4.48Å; F52-L58 HydrophobicContact CZ-CD2 3.84Å; V55-L58 WeakPolarHBondContact O-CB 3.05Å; V55-L58 PolarHBondContact O-N 3.4Å; L58-L70 HydrophobicContact CD1-CD2 3.77Å; L58-Y86 VanDerWaalsContact CB-OH 3.28Å; L58-Y86 WeakPolarHBondContact CB-OH 3.48Å; L58-Y86 PolarHBondContact O-OH 2.99Å
59	Q	70.4	Confident	77.2	Confident	92 Å²	92	52 Å²	52	43%	0.43	30%	0.301	S	S	.	.			trans	-121.8	104.5	176.6	-173.9	167.8	7.2	0	0	109.7	I28	I28-Q59 WeakPolarHBondContact CG1-O 3.38Å; I28-Q59 PolarHBondContact N-O 3.49Å; I28-Q59 VanDerWaalsContact N-O 3.12Å
60	P	70.6	Confident	77.4	Confident	8 Å²	8	46.2 Å²	46.2	5%	0.052	27%	0.27	C	S	.	.			trans	-77.8	155.8	-170.3	32.9	-37.6	0	0	0	112.8	I28 Y66 N85 Y86	I28-P60 HydrophobicContact CD1-CB 4.15Å; P60-Y66 HydrophobicContact CB-CE1 3.99Å; P60-Y66 HydrophobicContact CB-CE2 4.36Å; P60-Y66 WeakPolarHBondContact CB-OH 3.02Å; P60-Y66 VanDerWaalsContact CG-OH 3.22Å; P60-Y66 WeakPolarHBondContact CG-OH 3.04Å; P60-N85 HydrophobicContact CG-CB 4.38Å; P60-N85 WeakPolarHBondContact CG-O 3.27Å; P60-Y86 HydrophobicContact CB-CD1 4.21Å; P60-Y86 HydrophobicContact CB-CE1 4.04Å; P60-Y86 HydrophobicContact CG-CD1 3.85Å; P60-Y86 HydrophobicContact CG-CD2 3.93Å; P60-Y86 HydrophobicContact CG-CE1 3.79Å; P60-Y86 HydrophobicContact CG-CE2 3.9Å; P60-Y86 HydrophobicContact CG-CG 3.92Å
61	P	68.9	Low	77.7	Confident	18 Å²	18	42.1 Å²	42.1	12%	0.117	25%	0.253	C	S	.	.			trans	-68.1	125.1	176.5	25.6	-30.2	0	0	0	110.6	L43 S63	L43-P61 HydrophobicContact CD2-CG 3.44Å; L43-P61 VanDerWaalsContact CD2-CG 3.44Å; P61-S63 VanDerWaalsContact C-N 3.34Å; P61-S63 PolarHBondContact O-N 3.36Å
62	P	67.3	Low	77.7	Confident	100 Å²	100	41 Å²	41	65%	0.649	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.8	-11.4	-168.4	31.1	-37.2	0	0	0	114.6	N88	P62-N88 PolarHBondContact O-ND2 3.36Å
63	S	70.4	Confident	77.9	Confident	102 Å²	102	40.7 Å²	40.7	71%	0.713	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-108	-5.4	-168.3	53.6	0	0	0	0	115.4	P61	P61-S63 VanDerWaalsContact C-N 3.34Å; P61-S63 PolarHBondContact O-N 3.36Å
64	K	75	Confident	78.2	Confident	78 Å²	78	38.7 Å²	38.7	34%	0.339	23%	0.232	S	C	.	.	S	Bend	trans	-118.8	154.8	179.2	-57.9	-159.5	177.8	-162.1	0	111.2	E38 Y66 N88	E38-K64 WeakPolarHBondContact OE1-CD 3.44Å; E38-K64 IonicContact OE1-NZ 3.45Å; E38-K64 PolarHBondContact OE1-NZ 3.32Å; E38-K64 IonicContact OE2-NZ 3.08Å; E38-K64 PolarHBondContact OE2-NZ 3.03Å; K64-Y66 WeakPolarHBondContact O-CD1 3.28Å; K64-N88 WeakPolarHBondContact O-CB 3.37Å; K64-N88 PolarHBondContact O-ND2 2.94Å
65	I	81.7	Confident	78.6	Confident	81 Å²	81	36.9 Å²	36.9	42%	0.415	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	148.1	168.7	-58.2	179.8	0	0	0	107.7	V42 L43 N88 V90	V42-I65 CarbonylContact C-O 3.51Å; V42-I65 WeakPolarHBondContact CA-O 3.38Å; V42-I65 HydrophobicContact CG1-CG2 4.31Å; V42-I65 HydrophobicContact CG2-CB 4.3Å; V42-I65 HydrophobicContact CG2-CG2 4.01Å; L43-I65 PolarHBondContact N-O 3.42Å; I65-N88 WeakPolarHBondContact CA-O 3.48Å; I65-N88 WeakPolarHBondContact CG2-O 3.41Å; I65-V90 HydrophobicContact CG2-CB 4.41Å; I65-V90 HydrophobicContact CG2-CG2 3.38Å
66	Y	84.1	Confident	78.9	Confident	2 Å²	2	39.6 Å²	39.6	1%	0.008	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	160.7	-179.2	55.8	-97.8	0	0	0	116.9	L43 I45 P60 K64 L68 Y86 N88 A89 V90	L43-Y66 CarbonylContact O-C 3.34Å; L43-Y66 WeakPolarHBondContact O-CA 3.4Å; L43-Y66 WeakPolarHBondContact O-CB 3.32Å; I45-Y66 HydrophobicContact CD1-CD2 3.92Å; I45-Y66 HydrophobicContact CD1-CE2 4.34Å; I45-Y66 HydrophobicContact CD1-CG 4.04Å; P60-Y66 HydrophobicContact CB-CE1 3.99Å; P60-Y66 HydrophobicContact CB-CE2 4.36Å; P60-Y66 WeakPolarHBondContact CB-OH 3.02Å; P60-Y66 VanDerWaalsContact CG-OH 3.22Å; P60-Y66 WeakPolarHBondContact CG-OH 3.04Å; K64-Y66 WeakPolarHBondContact O-CD1 3.28Å; Y66-L68 HydrophobicContact CD2-CB 4.47Å; Y66-Y86 AromaticContact CE2-CD1 3.94Å; Y66-Y86 HydrophobicContact CE2-CD1 3.94Å; Y66-Y86 AromaticContact CZ-CD1 3.99Å; Y66-Y86 WeakPolarHBondContact OH-CA 3.2Å; Y66-Y86 WeakPolarHBondContact OH-CB 3.39Å; Y66-Y86 WeakPolarHBondContact OH-CD1 3.1Å; Y66-N88 HydrophobicContact CD1-CB 4.29Å; Y66-N88 HydrophobicContact CE1-CB 4.13Å; Y66-N88 PolarHBondContact N-O 3.01Å; Y66-A89 HydrophobicContact CD2-CB 3.99Å; Y66-A89 HydrophobicContact CE2-CB 3.61Å; Y66-A89 CarbonylContact O-C 3.6Å; Y66-A89 WeakPolarHBondContact O-CA 3.44Å; Y66-V90 PolarHBondContact O-N 3.46Å
67	Q	84.6	Confident	79.8	Confident	11 Å²	11	41 Å²	41	5%	0.051	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	146.2	164	-56.2	-171.2	-16.1	0	0	109.2	V42 L43 N44 I45 F69 E567 H580	V42-Q67 HydrophobicContact CG1-CG 4.05Å; L43-Q67 PolarHBondContact O-N 2.81Å; N44-Q67 PolarHBondContact ND2-OE1 3.34Å; N44-Q67 VanDerWaalsContact ND2-OE1 3.07Å; N44-Q67 WeakPolarHBondContact OD1-CB 3.36Å; N44-Q67 WeakPolarHBondContact OD1-CG 3.33Å; N44-Q67 PolarHBondContact OD1-OE1 3.11Å; I45-Q67 PolarHBondContact N-O 2.85Å; Q67-F69 HydrophobicContact CB-CE2 3.8Å; Q67-F69 HydrophobicContact CB-CZ 4.03Å; Q67-E567 PolarHBondContact NE2-OE1 3.32Å; Q67-E567 VanDerWaalsContact NE2-OE1 3.16Å; Q67-H580 PolarHBondContact OE1-CE1 2.69Å
68	L	87.5	Confident	81	Confident	1 Å²	1	37 Å²	37	1%	0.005	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	117.8	-176.2	179.5	58.2	0	0	0	111.8	I45 Y66 L70 F83 Y86 T91 L92 H93	I45-L68 HydrophobicContact CB-CD1 3.97Å; I45-L68 HydrophobicContact CG2-CD1 3.82Å; Y66-L68 HydrophobicContact CD2-CB 4.47Å; L68-L70 HydrophobicContact CD1-CD1 4.35Å; L68-L70 HydrophobicContact CD1-CG 4.17Å; L68-L70 HydrophobicContact CD2-CD1 3.85Å; L68-L70 HydrophobicContact CG-CD1 3.93Å; L68-L70 HydrophobicContact CG-CG 4.1Å; L68-F83 HydrophobicContact CD2-CE1 4.45Å; L68-Y86 HydrophobicContact CD2-CD1 3.83Å; L68-Y86 HydrophobicContact CD2-CE1 3.56Å; L68-T91 PolarHBondContact N-O 3.46Å; L68-L92 HydrophobicContact CB-CD1 4.15Å; L68-L92 HydrophobicContact CD2-CD1 3.98Å; L68-L92 HydrophobicContact CG-CD1 4.03Å; L68-L92 WeakPolarHBondContact O-CA 3.4Å; L68-H93 PolarHBondContact O-N 2.89Å
69	F	85.4	Confident	81.8	Confident	4 Å²	4	40.7 Å²	40.7	2%	0.018	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	109.7	-179.5	-52.6	-94.6	0	0	0	109.7	N44 I45 N46 C47 E48 Q67 H93 I569 H580	N44-F69 HydrophobicContact CB-CE2 4.3Å; I45-F69 PolarHBondContact O-N 3.45Å; N46-F69 HydrophobicContact CB-CD2 4.42Å; C47-F69 CarbonylContact C-O 3.27Å; C47-F69 VanDerWaalsContact CA-O 3.25Å; C47-F69 WeakPolarHBondContact CA-O 3.29Å; C47-F69 VanDerWaalsContact CB-O 3.26Å; C47-F69 WeakPolarHBondContact CB-O 3.49Å; C47-F69 PolarHBondContact N-O 3.29Å; E48-F69 HydrophobicContact CG-CB 3.76Å; Q67-F69 HydrophobicContact CB-CE2 3.8Å; Q67-F69 HydrophobicContact CB-CZ 4.03Å; F69-H93 HydrophobicContact CD1-CB 4.32Å; F69-H93 AromaticContact CD1-CD2 3.3Å; F69-H93 WeakPolarHBondContact CD1-CD2 3.26Å; F69-H93 AromaticContact CD1-CG 3.89Å; F69-H93 AromaticContact CD1-NE2 3.86Å; F69-H93 AromaticContact CE1-CD2 3.24Å; F69-H93 WeakPolarHBondContact CE1-CD2 3.12Å; F69-H93 AromaticContact CE1-NE2 3.32Å; F69-H93 VanDerWaalsContact CE1-NE2 3.32Å; F69-H93 WeakPolarHBondContact CE1-NE2 3.41Å; F69-I569 HydrophobicContact CE1-CD1 4.22Å; F69-H580 AromaticContact CE1-NE2 3.85Å; F69-H580 AromaticContact CE2-NE2 3.82Å; F69-H580 AromaticContact CZ-CE1 3.45Å; F69-H580 VanDerWaalsContact CZ-CE1 3.45Å; F69-H580 WeakPolarHBondContact CZ-CE1 3.38Å; F69-H580 AromaticContact CZ-NE2 3.22Å; F69-H580 WeakPolarHBondContact CZ-NE2 3.28Å
70	L	86.6	Confident	82.6	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	22%	0.223	C	C	.	.			trans	-116.6	20.3	179.3	-76.4	164.3	0	0	0	111.9	C47 F52 V55 L58 L68 N73 L75 L92 H93 L94 N97	C47-L70 HydrophobicContact CB-CD2 3.52Å; C47-L70 HydrophobicContact CB-CG 4.3Å; F52-L70 HydrophobicContact CD2-CD2 4.16Å; V55-L70 HydrophobicContact CG2-CD1 4.42Å; L58-L70 HydrophobicContact CD1-CD2 3.77Å; L68-L70 HydrophobicContact CD1-CD1 4.35Å; L68-L70 HydrophobicContact CD1-CG 4.17Å; L68-L70 HydrophobicContact CD2-CD1 3.85Å; L68-L70 HydrophobicContact CG-CD1 3.93Å; L68-L70 HydrophobicContact CG-CG 4.1Å; L70-N73 VanDerWaalsContact C-ND2 3.28Å; L70-N73 PolarHBondContact O-ND2 2.86Å; L70-L75 HydrophobicContact CB-CD1 4.01Å; L70-L75 HydrophobicContact CD1-CD1 4.17Å; L70-L75 HydrophobicContact CD2-CD1 4.42Å; L70-L75 HydrophobicContact CG-CD1 4.44Å; L70-L92 HydrophobicContact CD1-CD1 4.29Å; L70-H93 WeakPolarHBondContact CA-O 3.3Å; L70-H93 WeakPolarHBondContact CB-O 3.48Å; L70-H93 PolarHBondContact N-O 3.41Å; L70-L94 HydrophobicContact CB-CD2 3.88Å; L70-L94 HydrophobicContact CD1-CD2 4.01Å; L70-N97 PolarHBondContact O-ND2 2.87Å
71	N	86.5	Confident	83.2	Confident	24 Å²	24	43.3 Å²	43.3	13%	0.128	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.1	148.2	-178.3	-59	-44.9	0	0	0	112.8	E48 N49 N73 H93 G95	E48-N71 WeakPolarHBondContact CA-O 3.29Å; E48-N71 HydrophobicContact CG-CB 4.08Å; E48-N71 WeakPolarHBondContact OE1-CB 3.39Å; E48-N71 PolarHBondContact OE1-ND2 3.33Å; N49-N71 PolarHBondContact N-O 3.11Å; N71-N73 VanDerWaalsContact C-N 3.27Å; N71-N73 PolarHBondContact O-N 3.4Å; N71-N73 PolarHBondContact O-ND2 3.44Å; N71-H93 WeakPolarHBondContact ND2-CB 3.43Å; N71-H93 WeakPolarHBondContact OD1-CB 3.34Å; N71-G95 VanDerWaalsContact CA-O 3.29Å; N71-G95 WeakPolarHBondContact CA-O 3.43Å; N71-G95 WeakPolarHBondContact OD1-CA 3.43Å; N71-G95 PolarHBondContact OD1-N 2.88Å
72	G	80.2	Confident	83.9	Confident	22 Å²	22	43.2 Å²	43.2	23%	0.227	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	67.9	22.6	175	0	0	0	0	0	114.8	G95 N96	G72-G95 PolarHBondContact N-O 3.43Å; G72-N96 WeakPolarHBondContact CA-O 3.49Å; G72-N96 PolarHBondContact N-O 2.96Å
73	N	86.9	Confident	84.8	Confident	11 Å²	11	38.5 Å²	38.5	6%	0.059	21%	0.211	C	C	.	.	S	Bend	trans	-97.4	-176.1	174.7	-74.3	-71.5	0	0	0	111.3	C47 K50 G51 F52 L70 N71 L75 N97	C47-N73 PolarHBondContact O-ND2 3.42Å; K50-N73 PolarHBondContact N-OD1 3.11Å; K50-N73 VanDerWaalsContact N-OD1 3.11Å; G51-N73 PolarHBondContact N-OD1 2.8Å; F52-N73 HydrophobicContact CB-CB 4.23Å; F52-N73 WeakPolarHBondContact CD2-OD1 3.42Å; F52-N73 PolarHBondContact N-OD1 2.84Å; L70-N73 VanDerWaalsContact C-ND2 3.28Å; L70-N73 PolarHBondContact O-ND2 2.86Å; N71-N73 VanDerWaalsContact C-N 3.27Å; N71-N73 PolarHBondContact O-N 3.4Å; N71-N73 PolarHBondContact O-ND2 3.44Å; N73-L75 HydrophobicContact CB-CG 4.19Å; N73-N97 WeakPolarHBondContact CA-OD1 3.49Å; N73-N97 VanDerWaalsContact CB-OD1 3.25Å; N73-N97 WeakPolarHBondContact CB-OD1 3.38Å; N73-N97 PolarHBondContact N-OD1 2.85Å; N73-N97 WeakPolarHBondContact O-CA 3.35Å; N73-N97 PolarHBondContact O-OD1 3.49Å
74	A	86.9	Confident	85.5	Confident	39 Å²	39	36.9 Å²	36.9	32%	0.322	20%	0.197	S	C	.	.			trans	-103.6	35.1	-178.1	0	0	0	0	0	111.8	F52 T53 T76	F52-A74 CarbonylContact O-C 3.06Å; F52-A74 VanDerWaalsContact O-C 3.27Å; F52-A74 WeakPolarHBondContact O-CA 3.33Å; F52-A74 PolarHBondContact O-N 3.11Å; T53-A74 HydrophobicContact CG2-CB 4.02Å; A74-T76 PolarHBondContact O-N 3.11Å
75	L	88.1	Confident	85.9	Confident	1 Å²	1	38.2 Å²	38.2	1%	0.005	21%	0.208	C	C	.	.			trans	-77.3	57.2	-178.3	-56	174.4	0	0	0	111.5	F52 V55 L70 N73 R77 L94 N97 M99	F52-L75 HydrophobicContact CB-CD2 4.35Å; F52-L75 WeakPolarHBondContact O-CD2 3.46Å; F52-L75 PolarHBondContact O-N 3.41Å; V55-L75 HydrophobicContact CG2-CD1 4.21Å; V55-L75 HydrophobicContact CG2-CD2 4.19Å; L70-L75 HydrophobicContact CB-CD1 4.01Å; L70-L75 HydrophobicContact CD1-CD1 4.17Å; L70-L75 HydrophobicContact CD2-CD1 4.42Å; L70-L75 HydrophobicContact CG-CD1 4.44Å; N73-L75 HydrophobicContact CB-CG 4.19Å; L75-R77 PolarHBondContact O-N 3.06Å; L75-R77 VanDerWaalsContact O-N 3.09Å; L75-L94 HydrophobicContact CD1-CD2 3.59Å; L75-N97 HydrophobicContact CB-CB 4.28Å; L75-N97 WeakPolarHBondContact CB-OD1 3.4Å; L75-N97 VanDerWaalsContact CG-OD1 3.27Å; L75-N97 WeakPolarHBondContact CG-OD1 3.45Å; L75-N97 PolarHBondContact N-OD1 3.42Å; L75-M99 HydrophobicContact CB-CE 4.23Å; L75-M99 WeakPolarHBondContact O-CE 3.22Å; L75-M99 WeakPolarHBondContact O-CG 3.38Å
76	T	87.9	Confident	86.1	Confident	57 Å²	57	34.5 Å²	34.5	35%	0.35	19%	0.189	S	C	.	.			trans	-57.9	-24.7	-177	55.8	0	0	0	0	113.8	A74 D98 Q100	A74-T76 PolarHBondContact O-N 3.11Å; T76-D98 HydrophobicContact CG2-CB 4.42Å; T76-Q100 PolarHBondContact O-N 3.01Å
77	R	89.3	Confident	86.1	Confident	116 Å²	116	37 Å²	37	44%	0.438	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	141.2	175.9	-59.3	-176.7	-175.4	130.7	10.5	110.6	L75 E101	L75-R77 PolarHBondContact O-N 3.06Å; L75-R77 VanDerWaalsContact O-N 3.09Å; R77-E101 VanDerWaalsContact CA-O 3.29Å; R77-E101 WeakPolarHBondContact CA-O 3.15Å; R77-E101 HydrophobicContact CG-CB 4.47Å
78	L	90.6	Very high	86.2	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	135.4	171.5	-63.7	177.8	0	0	0	110.8	V55 F83 L94 M99 E101 I102 R103 A106 F107	V55-L78 HydrophobicContact CG2-CD2 4.01Å; L78-F83 HydrophobicContact CD1-CE2 4.15Å; L78-F83 HydrophobicContact CD2-CE2 4.18Å; L78-L94 HydrophobicContact CD1-CD1 4.1Å; L78-M99 HydrophobicContact CD1-CE 3.79Å; L78-M99 HydrophobicContact CD1-SD 3.79Å; L78-M99 HydrophobicContact CD2-CE 4.17Å; L78-M99 HydrophobicContact CG-CE 3.81Å; L78-M99 HydrophobicContact CG-SD 3.93Å; L78-E101 PolarHBondContact N-O 3.08Å; L78-E101 VanDerWaalsContact N-O 3.12Å; L78-I102 HydrophobicContact CD1-CG1 4.32Å; L78-I102 HydrophobicContact CD1-CG2 4.46Å; L78-R103 VanDerWaalsContact O-CB 3.31Å; L78-R103 WeakPolarHBondContact O-CB 3.45Å; L78-R103 WeakPolarHBondContact O-CG 2.97Å; L78-R103 PolarHBondContact O-N 3.36Å; L78-R103 VanDerWaalsContact O-N 3.11Å; L78-A106 HydrophobicContact CB-CB 3.87Å; L78-F107 HydrophobicContact CD1-CE1 3.74Å; L78-F107 HydrophobicContact CD1-CZ 3.9Å
79	F	88.3	Confident	86.2	Confident	88 Å²	88	38.1 Å²	38.1	39%	0.386	21%	0.213	S	C	.	.			trans	-96.9	155.5	-178.3	-69	-89.3	0	0	0	112.7	N81 E82 A106	F79-N81 PolarHBondContact O-N 2.93Å; F79-E82 HydrophobicContact CB-CG 4.44Å; F79-E82 PolarHBondContact N-OE2 3.44Å; F79-E82 PolarHBondContact O-N 2.89Å; F79-A106 VanDerWaalsContact O-CA 3.3Å; F79-A106 WeakPolarHBondContact O-CA 3.22Å; F79-A106 WeakPolarHBondContact O-CB 3.32Å
80	P	86.8	Confident	86.3	Confident	61 Å²	61	39.4 Å²	39.4	40%	0.396	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.3	138.7	176.6	-23.8	35.2	0	0	0	111.7	E82 R103 T104	P80-E82 PolarHBondContact O-N 2.95Å; P80-R103 HydrophobicContact CG-CB 3.98Å; P80-T104 WeakPolarHBondContact CB-O 3.43Å
81	N	84.4	Confident	86.2	Confident	93 Å²	93	39.6 Å²	39.6	50%	0.497	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.6	11.9	178.9	-61	-53.4	0	0	0	116.8	F79 F83 V84 G105 S108	F79-N81 PolarHBondContact O-N 2.93Å; N81-F83 PolarHBondContact O-N 2.95Å; N81-F83 VanDerWaalsContact O-N 3.16Å; N81-V84 HydrophobicContact CB-CB 4.44Å; N81-V84 HydrophobicContact CB-CG2 3.53Å; N81-V84 WeakPolarHBondContact O-CB 3.41Å; N81-V84 PolarHBondContact O-N 2.03Å; N81-V84 VanDerWaalsContact O-N 3.09Å; N81-V84 WeakPolarHBondContact OD1-CG2 3.25Å; N81-G105 PolarHBondContact N-O 3.4Å; N81-S108 WeakPolarHBondContact OD1-CB 3.42Å; N81-S108 PolarHBondContact OD1-OG 3.4Å
82	E	83.5	Confident	86.4	Confident	16 Å²	16	38.5 Å²	38.5	8%	0.075	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-29.2	176.9	-115	-176.9	134.7	0	0	113.1	T54 V55 S56 F79 P80	T54-E82 WeakPolarHBondContact CB-OE1 3.4Å; V55-E82 HydrophobicContact CB-CB 4.44Å; V55-E82 HydrophobicContact CB-CG 4.31Å; V55-E82 PolarHBondContact N-OE1 3.14Å; S56-E82 PolarHBondContact N-OE1 2.82Å; S56-E82 VanDerWaalsContact N-OE1 3.1Å; S56-E82 VanDerWaalsContact OG-CG 3.29Å; S56-E82 WeakPolarHBondContact OG-CG 3.26Å; S56-E82 PolarHBondContact OG-OE1 2.89Å; F79-E82 HydrophobicContact CB-CG 4.44Å; F79-E82 PolarHBondContact N-OE2 3.44Å; F79-E82 PolarHBondContact O-N 2.89Å; P80-E82 PolarHBondContact O-N 2.95Å
83	F	87.2	Confident	86.7	Confident	1 Å²	1	38.4 Å²	38.4	0%	0.004	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.9	15.6	178.4	-67.5	-84.9	0	0	0	114.7	V55 L68 L78 N81 N85 Y86 L92 L94 A106 F107 S108 L110	V55-F83 HydrophobicContact CB-CZ 4.43Å; V55-F83 HydrophobicContact CG1-CD1 4.18Å; V55-F83 HydrophobicContact CG1-CE1 3.77Å; V55-F83 HydrophobicContact CG1-CZ 4.02Å; V55-F83 HydrophobicContact CG2-CE1 4.36Å; V55-F83 HydrophobicContact CG2-CE2 4.19Å; V55-F83 HydrophobicContact CG2-CZ 3.78Å; L68-F83 HydrophobicContact CD2-CE1 4.45Å; L78-F83 HydrophobicContact CD1-CE2 4.15Å; L78-F83 HydrophobicContact CD2-CE2 4.18Å; N81-F83 PolarHBondContact O-N 2.95Å; N81-F83 VanDerWaalsContact O-N 3.16Å; F83-N85 VanDerWaalsContact C-N 3.29Å; F83-N85 PolarHBondContact O-N 3.1Å; F83-Y86 HydrophobicContact CB-CD2 4.33Å; F83-Y86 HydrophobicContact CB-CG 4.43Å; F83-Y86 HydrophobicContact CD1-CD1 4.05Å; F83-Y86 HydrophobicContact CD1-CD2 4.11Å; F83-Y86 AromaticContact CD1-CG 3.85Å; F83-Y86 HydrophobicContact CD1-CG 3.85Å; F83-Y86 WeakPolarHBondContact O-CA 3.42Å; F83-Y86 VanDerWaalsContact O-CB 3.31Å; F83-Y86 WeakPolarHBondContact O-CB 3.42Å; F83-Y86 PolarHBondContact O-N 2.77Å; F83-L92 HydrophobicContact CD1-CD2 4.4Å; F83-L92 HydrophobicContact CE1-CD1 4.14Å; F83-L92 HydrophobicContact CE1-CD2 3.79Å; F83-L92 HydrophobicContact CZ-CD1 4.43Å; F83-L92 HydrophobicContact CZ-CD2 3.88Å; F83-L94 HydrophobicContact CZ-CD1 4.34Å; F83-A106 WeakPolarHBondContact CD2-O 3.25Å; F83-F107 AromaticContact CD2-CD1 3.98Å; F83-F107 HydrophobicContact CD2-CD1 3.98Å; F83-F107 HydrophobicContact CD2-CE1 4.49Å; F83-F107 HydrophobicContact CE2-CD1 4.04Å; F83-F107 HydrophobicContact CE2-CE1 4.09Å; F83-S108 CarbonylContact C-O 3.47Å; F83-L110 HydrophobicContact CB-CD1 3.93Å; F83-L110 HydrophobicContact CB-CD2 3.89Å; F83-L110 HydrophobicContact CB-CG 3.67Å; F83-L110 HydrophobicContact CD1-CD1 4.04Å; F83-L110 HydrophobicContact CD1-CD2 4.02Å; F83-L110 HydrophobicContact CD1-CG 4.36Å; F83-L110 HydrophobicContact CD2-CD1 4.32Å; F83-L110 HydrophobicContact CG-CD1 3.85Å; F83-L110 HydrophobicContact CG-CD2 4.24Å; F83-L110 HydrophobicContact CG-CG 4.13Å
84	V	85	Confident	86.8	Confident	68 Å²	68	37.9 Å²	37.9	41%	0.412	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-37.3	-177.6	157.2	0	0	0	0	113.1	N81 Y86 S108	N81-V84 HydrophobicContact CB-CB 4.44Å; N81-V84 HydrophobicContact CB-CG2 3.53Å; N81-V84 WeakPolarHBondContact O-CB 3.41Å; N81-V84 PolarHBondContact O-N 2.03Å; N81-V84 VanDerWaalsContact O-N 3.09Å; N81-V84 WeakPolarHBondContact OD1-CG2 3.25Å; V84-Y86 PolarHBondContact O-N 3.26Å; V84-S108 VanDerWaalsContact CA-O 3.28Å; V84-S108 WeakPolarHBondContact CA-O 3.05Å; V84-S108 WeakPolarHBondContact CG2-O 3.15Å; V84-S108 PolarHBondContact N-O 3.12Å; V84-S108 VanDerWaalsContact N-O 3.1Å
85	N	82.2	Confident	86.8	Confident	107 Å²	107	36 Å²	36	57%	0.572	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.7	2.8	177	-65.7	-25.7	0	0	0	113.4	P60 F83	P60-N85 HydrophobicContact CG-CB 4.38Å; P60-N85 WeakPolarHBondContact CG-O 3.27Å; F83-N85 VanDerWaalsContact C-N 3.29Å; F83-N85 PolarHBondContact O-N 3.1Å
86	Y	85.3	Confident	86.6	Confident	3 Å²	3	39.6 Å²	39.6	1%	0.012	21%	0.211	C	C	.	.			trans	-102.9	30.8	-169.9	-66.5	-111.2	0	0	0	114.1	V55 L58 P60 Y66 L68 F83 V84 N88 A89 L110	V55-Y86 HydrophobicContact CG1-CE1 4.34Å; V55-Y86 HydrophobicContact CG1-CE2 4.04Å; V55-Y86 WeakPolarHBondContact CG1-OH 3.42Å; V55-Y86 PolarHBondContact O-OH 2.95Å; L58-Y86 VanDerWaalsContact CB-OH 3.28Å; L58-Y86 WeakPolarHBondContact CB-OH 3.48Å; L58-Y86 PolarHBondContact O-OH 2.99Å; P60-Y86 HydrophobicContact CB-CD1 4.21Å; P60-Y86 HydrophobicContact CB-CE1 4.04Å; P60-Y86 HydrophobicContact CG-CD1 3.85Å; P60-Y86 HydrophobicContact CG-CD2 3.93Å; P60-Y86 HydrophobicContact CG-CE1 3.79Å; P60-Y86 HydrophobicContact CG-CE2 3.9Å; P60-Y86 HydrophobicContact CG-CG 3.92Å; Y66-Y86 AromaticContact CE2-CD1 3.94Å; Y66-Y86 HydrophobicContact CE2-CD1 3.94Å; Y66-Y86 AromaticContact CZ-CD1 3.99Å; Y66-Y86 WeakPolarHBondContact OH-CA 3.2Å; Y66-Y86 WeakPolarHBondContact OH-CB 3.39Å; Y66-Y86 WeakPolarHBondContact OH-CD1 3.1Å; L68-Y86 HydrophobicContact CD2-CD1 3.83Å; L68-Y86 HydrophobicContact CD2-CE1 3.56Å; F83-Y86 HydrophobicContact CB-CD2 4.33Å; F83-Y86 HydrophobicContact CB-CG 4.43Å; F83-Y86 HydrophobicContact CD1-CD1 4.05Å; F83-Y86 HydrophobicContact CD1-CD2 4.11Å; F83-Y86 AromaticContact CD1-CG 3.85Å; F83-Y86 HydrophobicContact CD1-CG 3.85Å; F83-Y86 WeakPolarHBondContact O-CA 3.42Å; F83-Y86 VanDerWaalsContact O-CB 3.31Å; F83-Y86 WeakPolarHBondContact O-CB 3.42Å; F83-Y86 PolarHBondContact O-N 2.77Å; V84-Y86 PolarHBondContact O-N 3.26Å; Y86-N88 PolarHBondContact O-N 2.95Å; Y86-A89 PolarHBondContact O-N 3.47Å; Y86-A89 VanDerWaalsContact O-N 3.16Å; Y86-L110 WeakPolarHBondContact O-CD2 3.48Å
87	S	84.3	Confident	86.6	Confident	54 Å²	54	37 Å²	37	38%	0.378	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-20.3	-171.1	56	0	0	0	0	116.5	G109 T112	S87-G109 WeakPolarHBondContact CA-O 3.29Å; S87-T112 WeakPolarHBondContact O-CG2 3.33Å; S87-T112 PolarHBondContact O-OG1 3.13Å
88	N	86.9	Confident	86.5	Confident	34 Å²	34	35.3 Å²	35.3	18%	0.182	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.4	7.3	-172.1	-45	-11.6	0	0	0	112.9	P62 K64 I65 Y66 Y86 T112	P62-N88 PolarHBondContact O-ND2 3.36Å; K64-N88 WeakPolarHBondContact O-CB 3.37Å; K64-N88 PolarHBondContact O-ND2 2.94Å; I65-N88 WeakPolarHBondContact CA-O 3.48Å; I65-N88 WeakPolarHBondContact CG2-O 3.41Å; Y66-N88 HydrophobicContact CD1-CB 4.29Å; Y66-N88 HydrophobicContact CE1-CB 4.13Å; Y66-N88 PolarHBondContact N-O 3.01Å; Y86-N88 PolarHBondContact O-N 2.95Å; N88-T112 VanDerWaalsContact C-OG1 3.3Å; N88-T112 WeakPolarHBondContact CA-OG1 3.16Å
89	A	87.6	Confident	86.6	Confident	1 Å²	1	35.3 Å²	35.3	1%	0.008	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	129.1	176.5	0	0	0	0	0	111.1	Y66 Y86 L110 T112 L113	Y66-A89 HydrophobicContact CD2-CB 3.99Å; Y66-A89 HydrophobicContact CE2-CB 3.61Å; Y66-A89 CarbonylContact O-C 3.6Å; Y66-A89 WeakPolarHBondContact O-CA 3.44Å; Y86-A89 PolarHBondContact O-N 3.47Å; Y86-A89 VanDerWaalsContact O-N 3.16Å; A89-L110 HydrophobicContact CB-CD2 3.94Å; A89-T112 CarbonylContact O-C 3.57Å; A89-T112 PolarHBondContact O-OG1 3.03Å; A89-T112 VanDerWaalsContact O-OG1 3.06Å; A89-L113 HydrophobicContact CB-CD1 4.03Å; A89-L113 WeakPolarHBondContact O-CA 3.38Å; A89-L113 WeakPolarHBondContact O-CD1 3.34Å; A89-L113 PolarHBondContact O-N 3.28Å; A89-L113 VanDerWaalsContact O-N 3.12Å
90	V	87.3	Confident	86.6	Confident	32 Å²	32	35.6 Å²	35.6	19%	0.194	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	-36	178.5	168.7	0	0	0	0	112.5	I65 Y66 K114 R115	I65-V90 HydrophobicContact CG2-CB 4.41Å; I65-V90 HydrophobicContact CG2-CG2 3.38Å; Y66-V90 PolarHBondContact O-N 3.46Å; V90-K114 HydrophobicContact CG1-CB 4.27Å; V90-K114 HydrophobicContact CG1-CD 4.03Å; V90-K114 HydrophobicContact CG1-CG 4.36Å; V90-K114 PolarHBondContact O-N 2.95Å; V90-R115 PolarHBondContact O-N 3.09Å; V90-R115 VanDerWaalsContact O-N 3.15Å
91	T	85.1	Confident	86.7	Confident	3 Å²	3	35.2 Å²	35.2	2%	0.018	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	133.9	179.9	-56.7	0	0	0	0	109.1	L68 H93 R115	L68-T91 PolarHBondContact N-O 3.46Å; T91-H93 WeakPolarHBondContact CG2-NE2 3.22Å; T91-R115 HydrophobicContact CG2-CB 4.02Å
92	L	90.4	Very high	87	Confident	1 Å²	1	31.1 Å²	31.1	1%	0.005	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	117.8	178.8	176.3	57.1	0	0	0	109.9	L68 L70 F83 L94 F107 L110 L113 R115 L116 H117	L68-L92 HydrophobicContact CB-CD1 4.15Å; L68-L92 HydrophobicContact CD2-CD1 3.98Å; L68-L92 HydrophobicContact CG-CD1 4.03Å; L68-L92 WeakPolarHBondContact O-CA 3.4Å; L70-L92 HydrophobicContact CD1-CD1 4.29Å; F83-L92 HydrophobicContact CD1-CD2 4.4Å; F83-L92 HydrophobicContact CE1-CD1 4.14Å; F83-L92 HydrophobicContact CE1-CD2 3.79Å; F83-L92 HydrophobicContact CZ-CD1 4.43Å; F83-L92 HydrophobicContact CZ-CD2 3.88Å; L92-L94 HydrophobicContact CD1-CD1 4.25Å; L92-L94 HydrophobicContact CD1-CD2 4.46Å; L92-L94 HydrophobicContact CD1-CG 4.02Å; L92-L94 HydrophobicContact CD2-CD1 3.81Å; L92-L94 HydrophobicContact CD2-CG 4.46Å; L92-L94 HydrophobicContact CG-CD1 3.87Å; L92-L94 HydrophobicContact CG-CG 4.02Å; L92-F107 HydrophobicContact CD2-CE1 4.34Å; L92-L110 HydrophobicContact CD2-CD1 3.67Å; L92-L113 HydrophobicContact CB-CD1 3.68Å; L92-L113 HydrophobicContact CB-CD2 4.06Å; L92-R115 PolarHBondContact N-O 2.91Å; L92-L116 HydrophobicContact CB-CD1 4.18Å; L92-L116 HydrophobicContact CD2-CD1 4.07Å; L92-L116 HydrophobicContact CG-CD1 4.04Å; L92-H117 PolarHBondContact O-N 2.95Å
93	H	85.8	Confident	87.3	Confident	21 Å²	21	35.4 Å²	35.4	10%	0.097	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	123.8	173.9	-58	-101.1	0	0	0	110.6	L68 F69 L70 N71 T91 H117	L68-H93 PolarHBondContact O-N 2.89Å; F69-H93 HydrophobicContact CD1-CB 4.32Å; F69-H93 AromaticContact CD1-CD2 3.3Å; F69-H93 WeakPolarHBondContact CD1-CD2 3.26Å; F69-H93 AromaticContact CD1-CG 3.89Å; F69-H93 AromaticContact CD1-NE2 3.86Å; F69-H93 AromaticContact CE1-CD2 3.24Å; F69-H93 WeakPolarHBondContact CE1-CD2 3.12Å; F69-H93 AromaticContact CE1-NE2 3.32Å; F69-H93 VanDerWaalsContact CE1-NE2 3.32Å; F69-H93 WeakPolarHBondContact CE1-NE2 3.41Å; L70-H93 WeakPolarHBondContact CA-O 3.3Å; L70-H93 WeakPolarHBondContact CB-O 3.48Å; L70-H93 PolarHBondContact N-O 3.41Å; N71-H93 WeakPolarHBondContact ND2-CB 3.43Å; N71-H93 WeakPolarHBondContact OD1-CB 3.34Å; T91-H93 WeakPolarHBondContact CG2-NE2 3.22Å; H93-H117 HydrophobicContact CB-CB 4.48Å; H93-H117 AromaticContact CE1-CD2 3.25Å; H93-H117 PolarHBondContact CE1-CD2 3.35Å; H93-H117 AromaticContact CE1-CE1 3.82Å; H93-H117 AromaticContact CE1-CG 3.72Å; H93-H117 AromaticContact CE1-NE2 3.36Å; H93-H117 PolarHBondContact CE1-NE2 3.46Å; H93-H117 AromaticContact CG-CD2 3.85Å; H93-H117 AromaticContact ND1-CD2 3.24Å; H93-H117 PolarHBondContact ND1-CD2 2.94Å; H93-H117 AromaticContact ND1-CG 3.38Å; H93-H117 AromaticContact ND1-ND1 3.97Å; H93-H117 AromaticContact ND1-NE2 3.83Å; H93-H117 AromaticContact NE2-CD2 3.85Å; H93-H117 AromaticContact NE2-NE2 3.96Å
94	L	90	Very high	87.2	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	21%	0.205	C	C	.	.			trans	-131	22.9	-178.1	-74.3	166.2	0	0	0	111	L70 L75 L78 F83 L92 N97 M99 F107 L116 H117 L118 N121	L70-L94 HydrophobicContact CB-CD2 3.88Å; L70-L94 HydrophobicContact CD1-CD2 4.01Å; L75-L94 HydrophobicContact CD1-CD2 3.59Å; L78-L94 HydrophobicContact CD1-CD1 4.1Å; F83-L94 HydrophobicContact CZ-CD1 4.34Å; L92-L94 HydrophobicContact CD1-CD1 4.25Å; L92-L94 HydrophobicContact CD1-CD2 4.46Å; L92-L94 HydrophobicContact CD1-CG 4.02Å; L92-L94 HydrophobicContact CD2-CD1 3.81Å; L92-L94 HydrophobicContact CD2-CG 4.46Å; L92-L94 HydrophobicContact CG-CD1 3.87Å; L92-L94 HydrophobicContact CG-CG 4.02Å; L94-N97 PolarHBondContact O-ND2 2.94Å; L94-M99 HydrophobicContact CB-CE 4.14Å; L94-M99 HydrophobicContact CD1-CE 4.39Å; L94-M99 HydrophobicContact CD2-CE 4.19Å; L94-M99 HydrophobicContact CG-CE 4.49Å; L94-F107 HydrophobicContact CD1-CE1 3.94Å; L94-F107 HydrophobicContact CD1-CZ 4.38Å; L94-L116 HydrophobicContact CD1-CD1 4.28Å; L94-H117 PolarHBondContact N-O 2.89Å; L94-L118 HydrophobicContact CB-CD2 3.9Å; L94-L118 HydrophobicContact CD1-CD2 4.13Å; L94-N121 PolarHBondContact O-ND2 3.26Å
95	G	86.1	Confident	87.2	Confident	0 Å²	0	36 Å²	36	0%	0	19%	0.189	C	C	.	.			trans	-71.7	163.8	179.4	0	0	0	0	0	113	N71 G72 N97 N119	N71-G95 VanDerWaalsContact CA-O 3.29Å; N71-G95 WeakPolarHBondContact CA-O 3.43Å; N71-G95 WeakPolarHBondContact OD1-CA 3.43Å; N71-G95 PolarHBondContact OD1-N 2.88Å; G72-G95 PolarHBondContact N-O 3.43Å; G95-N97 VanDerWaalsContact C-N 3.25Å; G95-N97 PolarHBondContact O-N 2.97Å; G95-N97 PolarHBondContact O-ND2 3.41Å; G95-N119 CarbonylContact C-O 3.53Å; G95-N119 WeakPolarHBondContact CA-O 3.3Å
96	N	85.3	Confident	87.6	Confident	76 Å²	76	30.9 Å²	30.9	41%	0.406	16%	0.162	S	C	.	.	S	Bend	trans	54.2	34.5	178	-55.6	-40.6	0	0	0	114.1	G72 N119 N120	G72-N96 WeakPolarHBondContact CA-O 3.49Å; G72-N96 PolarHBondContact N-O 2.96Å; N96-N119 PolarHBondContact N-O 2.86Å; N96-N119 VanDerWaalsContact N-O 3.13Å; N96-N120 WeakPolarHBondContact CA-O 3.31Å; N96-N120 PolarHBondContact N-O 3.39Å; N96-N120 WeakPolarHBondContact OD1-CB 3.28Å; N96-N120 PolarHBondContact OD1-ND2 3.11Å
97	N	87	Confident	87.9	Confident	1 Å²	1	30.8 Å²	30.8	1%	0.005	16%	0.161	C	C	.	.	S	Bend	trans	-106.9	3.9	-172.1	-96.8	-88.6	0	0	0	115	L70 N73 L75 L94 G95 M99 N121	L70-N97 PolarHBondContact O-ND2 2.87Å; N73-N97 WeakPolarHBondContact CA-OD1 3.49Å; N73-N97 VanDerWaalsContact CB-OD1 3.25Å; N73-N97 WeakPolarHBondContact CB-OD1 3.38Å; N73-N97 PolarHBondContact N-OD1 2.85Å; N73-N97 WeakPolarHBondContact O-CA 3.35Å; N73-N97 PolarHBondContact O-OD1 3.49Å; L75-N97 HydrophobicContact CB-CB 4.28Å; L75-N97 WeakPolarHBondContact CB-OD1 3.4Å; L75-N97 VanDerWaalsContact CG-OD1 3.27Å; L75-N97 WeakPolarHBondContact CG-OD1 3.45Å; L75-N97 PolarHBondContact N-OD1 3.42Å; L94-N97 PolarHBondContact O-ND2 2.94Å; G95-N97 VanDerWaalsContact C-N 3.25Å; G95-N97 PolarHBondContact O-N 2.97Å; G95-N97 PolarHBondContact O-ND2 3.41Å; N97-M99 HydrophobicContact CB-CB 4.43Å; N97-M99 HydrophobicContact CB-CE 4.41Å; N97-M99 PolarHBondContact O-N 2.85Å; N97-M99 VanDerWaalsContact O-N 3.13Å; N97-N121 WeakPolarHBondContact CA-OD1 3.4Å; N97-N121 WeakPolarHBondContact CB-OD1 3.2Å; N97-N121 PolarHBondContact N-OD1 3.34Å
98	D	87.7	Confident	88.1	Confident	81 Å²	81	30 Å²	30	43%	0.433	16%	0.155	S	C	.	.			trans	54.8	26.6	-172.3	-98.5	12.8	0	0	0	113.4	T76 Q100 N121 K122	T76-D98 HydrophobicContact CG2-CB 4.42Å; D98-Q100 PolarHBondContact O-N 3.49Å; D98-N121 PolarHBondContact N-OD1 2.86Å; D98-K122 HydrophobicContact CB-CD 4.27Å; D98-K122 WeakPolarHBondContact OD1-CE 3.37Å; D98-K122 IonicContact OD1-NZ 2.72Å; D98-K122 PolarHBondContact OD1-NZ 2.79Å; D98-K122 IonicContact OD2-NZ 2.74Å; D98-K122 PolarHBondContact OD2-NZ 2.83Å
99	M	92	Very high	87.8	Confident	0 Å²	0	29 Å²	29	0%	0	15%	0.154	C	C	.	.			trans	-69	117.4	-171	-167.1	179.3	-63.2	0	0	111.8	L75 L78 L94 N97 I102 L118 N121 K122 L123	L75-M99 HydrophobicContact CB-CE 4.23Å; L75-M99 WeakPolarHBondContact O-CE 3.22Å; L75-M99 WeakPolarHBondContact O-CG 3.38Å; L78-M99 HydrophobicContact CD1-CE 3.79Å; L78-M99 HydrophobicContact CD1-SD 3.79Å; L78-M99 HydrophobicContact CD2-CE 4.17Å; L78-M99 HydrophobicContact CG-CE 3.81Å; L78-M99 HydrophobicContact CG-SD 3.93Å; L94-M99 HydrophobicContact CB-CE 4.14Å; L94-M99 HydrophobicContact CD1-CE 4.39Å; L94-M99 HydrophobicContact CD2-CE 4.19Å; L94-M99 HydrophobicContact CG-CE 4.49Å; N97-M99 HydrophobicContact CB-CB 4.43Å; N97-M99 HydrophobicContact CB-CE 4.41Å; N97-M99 PolarHBondContact O-N 2.85Å; N97-M99 VanDerWaalsContact O-N 3.13Å; M99-I102 HydrophobicContact CG-CG1 4.49Å; M99-I102 HydrophobicContact SD-CD1 4.02Å; M99-I102 HydrophobicContact SD-CG1 3.65Å; M99-L118 HydrophobicContact SD-CD2 4.26Å; M99-N121 HydrophobicContact CB-CB 4.17Å; M99-N121 VanDerWaalsContact CB-OD1 3.32Å; M99-N121 WeakPolarHBondContact CB-OD1 3.49Å; M99-N121 PolarHBondContact N-OD1 3.02Å; M99-K122 CarbonylContact O-C 3.21Å; M99-K122 VanDerWaalsContact O-CA 3.24Å; M99-K122 WeakPolarHBondContact O-CA 3.35Å; M99-K122 PolarHBondContact O-N 3.17Å; M99-L123 HydrophobicContact CB-CD2 4.42Å; M99-L123 HydrophobicContact CG-CD2 4.04Å; M99-L123 WeakPolarHBondContact O-CD2 3.47Å; M99-L123 PolarHBondContact O-N 2.96Å; M99-L123 HydrophobicContact SD-CD2 4.42Å
100	Q	89.3	Confident	87.9	Confident	95 Å²	95	29 Å²	29	44%	0.444	15%	0.154	S	C	.	.			trans	-94.8	-42.9	-177.3	-64.4	171.6	-2.1	0	0	112.6	T76 D98 K122	T76-Q100 PolarHBondContact O-N 3.01Å; D98-Q100 PolarHBondContact O-N 3.49Å; Q100-K122 HydrophobicContact CG-CB 4.32Å
101	E	87.4	Confident	87.9	Confident	52 Å²	52	35.6 Å²	35.6	24%	0.243	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	130.8	-175.6	178.4	170.8	-115.2	0	0	112.3	R77 L78 R103 R127	R77-E101 VanDerWaalsContact CA-O 3.29Å; R77-E101 WeakPolarHBondContact CA-O 3.15Å; R77-E101 HydrophobicContact CG-CB 4.47Å; L78-E101 PolarHBondContact N-O 3.08Å; L78-E101 VanDerWaalsContact N-O 3.12Å; E101-R103 HydrophobicContact CG-CG 4.22Å; E101-R103 IonicContact OE2-NE 2.71Å; E101-R103 PolarHBondContact OE2-NE 3.48Å; E101-R103 IonicContact OE2-NH2 3.93Å; E101-R127 IonicContact OE1-CZ 3.38Å; E101-R127 IonicContact OE1-NH1 2.67Å; E101-R127 PolarHBondContact OE1-NH1 3.49Å; E101-R127 IonicContact OE1-NH2 3.21Å; E101-R127 PolarHBondContact OE1-NH2 3.22Å; E101-R127 VanDerWaalsContact OE1-NH2 3.17Å
102	I	92.5	Very high	88	Confident	8 Å²	8	38.3 Å²	38.3	4%	0.041	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	118.3	164.8	-56.6	172.3	0	0	0	107.2	L78 M99 A106 F107 L118 L123 T130	L78-I102 HydrophobicContact CD1-CG1 4.32Å; L78-I102 HydrophobicContact CD1-CG2 4.46Å; M99-I102 HydrophobicContact CG-CG1 4.49Å; M99-I102 HydrophobicContact SD-CD1 4.02Å; M99-I102 HydrophobicContact SD-CG1 3.65Å; I102-A106 HydrophobicContact CG2-CB 3.85Å; I102-F107 HydrophobicContact CD1-CE2 4.09Å; I102-F107 HydrophobicContact CD1-CZ 4.04Å; I102-F107 HydrophobicContact CG2-CD2 4.44Å; I102-F107 HydrophobicContact CG2-CE2 3.86Å; I102-F107 HydrophobicContact CG2-CZ 4.2Å; I102-L118 HydrophobicContact CD1-CD1 4.08Å; I102-L118 HydrophobicContact CD1-CD2 4.19Å; I102-L123 HydrophobicContact CD1-CD1 4.03Å; I102-L123 HydrophobicContact CD1-CD2 4.1Å; I102-L123 HydrophobicContact CG1-CD2 3.95Å; I102-T130 HydrophobicContact CB-CG2 4.16Å; I102-T130 HydrophobicContact CD1-CG2 4.18Å; I102-T130 HydrophobicContact CG2-CG2 4.11Å
103	R	89.4	Confident	88.1	Confident	105 Å²	105	38.3 Å²	38.3	40%	0.396	19%	0.192	S	C	.	.	P	Polyproline II helix	trans	-78.8	157.3	178.5	-67.6	-175.9	163.9	-165.2	-4.9	112	L78 P80 E101 G105 A106	L78-R103 VanDerWaalsContact O-CB 3.31Å; L78-R103 WeakPolarHBondContact O-CB 3.45Å; L78-R103 WeakPolarHBondContact O-CG 2.97Å; L78-R103 PolarHBondContact O-N 3.36Å; L78-R103 VanDerWaalsContact O-N 3.11Å; P80-R103 HydrophobicContact CG-CB 3.98Å; E101-R103 HydrophobicContact CG-CG 4.22Å; E101-R103 IonicContact OE2-NE 2.71Å; E101-R103 PolarHBondContact OE2-NE 3.48Å; E101-R103 IonicContact OE2-NH2 3.93Å; R103-G105 PolarHBondContact O-N 3.31Å; R103-A106 VanDerWaalsContact O-CB 3.29Å; R103-A106 WeakPolarHBondContact O-CB 3.1Å; R103-A106 PolarHBondContact O-N 3.34Å
104	T	85.6	Confident	88.2	Confident	75 Å²	75	41.8 Å²	41.8	46%	0.46	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	128.2	-177	56.6	0	0	0	0	111	P80 A106 D129	P80-T104 WeakPolarHBondContact CB-O 3.43Å; T104-A106 VanDerWaalsContact C-N 3.3Å; T104-A106 PolarHBondContact O-N 2.86Å; T104-D129 HydrophobicContact CG2-CB 3.58Å
105	G	83.9	Confident	88	Confident	7 Å²	7	45.3 Å²	45.3	7%	0.072	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	64.6	25.3	-176.5	0	0	0	0	0	115.3	N81 R103 F107 S108 D129	N81-G105 PolarHBondContact N-O 3.4Å; R103-G105 PolarHBondContact O-N 3.31Å; G105-F107 VanDerWaalsContact C-N 3.33Å; G105-S108 WeakPolarHBondContact O-CB 3.34Å; G105-S108 PolarHBondContact O-N 2.81Å; G105-D129 PolarHBondContact N-O 3.24Å
106	A	89.8	Confident	88.3	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59	-45.3	171.8	0	0	0	0	0	112.1	L78 F79 F83 I102 R103 T104 S108	L78-A106 HydrophobicContact CB-CB 3.87Å; F79-A106 VanDerWaalsContact O-CA 3.3Å; F79-A106 WeakPolarHBondContact O-CA 3.22Å; F79-A106 WeakPolarHBondContact O-CB 3.32Å; F83-A106 WeakPolarHBondContact CD2-O 3.25Å; I102-A106 HydrophobicContact CG2-CB 3.85Å; R103-A106 VanDerWaalsContact O-CB 3.29Å; R103-A106 WeakPolarHBondContact O-CB 3.1Å; R103-A106 PolarHBondContact O-N 3.34Å; T104-A106 VanDerWaalsContact C-N 3.3Å; T104-A106 PolarHBondContact O-N 2.86Å; A106-S108 PolarHBondContact O-N 2.04Å
107	F	92.1	Very high	88.3	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.6	8.7	176.3	-57.1	-52	0	0	0	114.4	L78 F83 L92 L94 I102 G105 G109 L110 L116 T130 F131 L132 L134	L78-F107 HydrophobicContact CD1-CE1 3.74Å; L78-F107 HydrophobicContact CD1-CZ 3.9Å; F83-F107 AromaticContact CD2-CD1 3.98Å; F83-F107 HydrophobicContact CD2-CD1 3.98Å; F83-F107 HydrophobicContact CD2-CE1 4.49Å; F83-F107 HydrophobicContact CE2-CD1 4.04Å; F83-F107 HydrophobicContact CE2-CE1 4.09Å; L92-F107 HydrophobicContact CD2-CE1 4.34Å; L94-F107 HydrophobicContact CD1-CE1 3.94Å; L94-F107 HydrophobicContact CD1-CZ 4.38Å; I102-F107 HydrophobicContact CD1-CE2 4.09Å; I102-F107 HydrophobicContact CD1-CZ 4.04Å; I102-F107 HydrophobicContact CG2-CD2 4.44Å; I102-F107 HydrophobicContact CG2-CE2 3.86Å; I102-F107 HydrophobicContact CG2-CZ 4.2Å; G105-F107 VanDerWaalsContact C-N 3.33Å; F107-G109 PolarHBondContact O-N 2.82Å; F107-G109 VanDerWaalsContact O-N 3.12Å; F107-L110 HydrophobicContact CB-CD1 3.97Å; F107-L110 HydrophobicContact CD1-CD1 3.67Å; F107-L110 HydrophobicContact CG-CD1 4.21Å; F107-L110 WeakPolarHBondContact O-CB 3.31Å; F107-L110 PolarHBondContact O-N 2.8Å; F107-L110 VanDerWaalsContact O-N 3.1Å; F107-L116 HydrophobicContact CE2-CD2 4.11Å; F107-L116 HydrophobicContact CZ-CD2 4.12Å; F107-T130 VanDerWaalsContact CD2-O 3.27Å; F107-T130 WeakPolarHBondContact CD2-O 3.48Å; F107-F131 HydrophobicContact CD2-CD1 4.46Å; F107-F131 HydrophobicContact CE2-CD1 4.24Å; F107-L132 CarbonylContact C-O 3.04Å; F107-L134 HydrophobicContact CB-CD1 4.09Å; F107-L134 HydrophobicContact CB-CD2 4.05Å; F107-L134 HydrophobicContact CB-CG 3.9Å; F107-L134 HydrophobicContact CD2-CD1 3.76Å; F107-L134 HydrophobicContact CD2-CG 4.48Å; F107-L134 HydrophobicContact CE2-CD1 4.41Å; F107-L134 HydrophobicContact CG-CD1 4.01Å; F107-L134 HydrophobicContact CG-CG 4.36Å
108	S	87.9	Confident	88.6	Confident	37 Å²	37	41.7 Å²	41.7	26%	0.259	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.5	116.5	172	177	0	0	0	0	109.9	N81 F83 V84 G105 A106 L132	N81-S108 WeakPolarHBondContact OD1-CB 3.42Å; N81-S108 PolarHBondContact OD1-OG 3.4Å; F83-S108 CarbonylContact C-O 3.47Å; V84-S108 VanDerWaalsContact CA-O 3.28Å; V84-S108 WeakPolarHBondContact CA-O 3.05Å; V84-S108 WeakPolarHBondContact CG2-O 3.15Å; V84-S108 PolarHBondContact N-O 3.12Å; V84-S108 VanDerWaalsContact N-O 3.1Å; G105-S108 WeakPolarHBondContact O-CB 3.34Å; G105-S108 PolarHBondContact O-N 2.81Å; A106-S108 PolarHBondContact O-N 2.04Å; S108-L132 PolarHBondContact N-O 2.74Å
109	G	82.2	Confident	88.5	Confident	15 Å²	15	38.1 Å²	38.1	16%	0.155	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	122.3	-34.1	-174.7	0	0	0	0	0	114	S87 F107 R111	S87-G109 WeakPolarHBondContact CA-O 3.29Å; F107-G109 PolarHBondContact O-N 2.82Å; F107-G109 VanDerWaalsContact O-N 3.12Å; G109-R111 PolarHBondContact O-N 2.72Å
110	L	89.4	Confident	88.2	Confident	1 Å²	1	42.3 Å²	42.3	1%	0.005	20%	0.204	C	C	.	.			trans	-75.4	45.3	-169.7	-64.3	-179	0	0	0	115.2	F83 Y86 A89 L92 F107 T112 L113 L134	F83-L110 HydrophobicContact CB-CD1 3.93Å; F83-L110 HydrophobicContact CB-CD2 3.89Å; F83-L110 HydrophobicContact CB-CG 3.67Å; F83-L110 HydrophobicContact CD1-CD1 4.04Å; F83-L110 HydrophobicContact CD1-CD2 4.02Å; F83-L110 HydrophobicContact CD1-CG 4.36Å; F83-L110 HydrophobicContact CD2-CD1 4.32Å; F83-L110 HydrophobicContact CG-CD1 3.85Å; F83-L110 HydrophobicContact CG-CD2 4.24Å; F83-L110 HydrophobicContact CG-CG 4.13Å; Y86-L110 WeakPolarHBondContact O-CD2 3.48Å; A89-L110 HydrophobicContact CB-CD2 3.94Å; L92-L110 HydrophobicContact CD2-CD1 3.67Å; F107-L110 HydrophobicContact CB-CD1 3.97Å; F107-L110 HydrophobicContact CD1-CD1 3.67Å; F107-L110 HydrophobicContact CG-CD1 4.21Å; F107-L110 WeakPolarHBondContact O-CB 3.31Å; F107-L110 PolarHBondContact O-N 2.8Å; F107-L110 VanDerWaalsContact O-N 3.1Å; L110-T112 VanDerWaalsContact C-N 3.28Å; L110-T112 PolarHBondContact O-N 3.03Å; L110-L113 HydrophobicContact CB-CB 4.16Å; L110-L113 HydrophobicContact CD1-CD2 4.32Å; L110-L113 WeakPolarHBondContact O-CB 3.21Å; L110-L113 PolarHBondContact O-N 3.25Å; L110-L113 VanDerWaalsContact O-N 3.16Å; L110-L134 HydrophobicContact CB-CD2 3.56Å; L110-L134 HydrophobicContact CD1-CD2 4.08Å; L110-L134 HydrophobicContact CG-CD2 4.46Å
111	R	86.1	Confident	88.2	Confident	170 Å²	170	38 Å²	38	64%	0.642	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-23	-171.5	-63	-175.1	-178.6	-163.8	-0.8	115.1	G109 S136	G109-R111 PolarHBondContact O-N 2.72Å; R111-S136 WeakPolarHBondContact O-CB 3.24Å; R111-S136 PolarHBondContact O-OG 3.18Å
112	T	88.3	Confident	88.5	Confident	60 Å²	60	39 Å²	39	37%	0.368	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.2	-4	178.8	54.4	0	0	0	0	113.6	S87 N88 A89 L110 K114	S87-T112 WeakPolarHBondContact O-CG2 3.33Å; S87-T112 PolarHBondContact O-OG1 3.13Å; N88-T112 VanDerWaalsContact C-OG1 3.3Å; N88-T112 WeakPolarHBondContact CA-OG1 3.16Å; A89-T112 CarbonylContact O-C 3.57Å; A89-T112 PolarHBondContact O-OG1 3.03Å; A89-T112 VanDerWaalsContact O-OG1 3.06Å; L110-T112 VanDerWaalsContact C-N 3.28Å; L110-T112 PolarHBondContact O-N 3.03Å; T112-K114 PolarHBondContact O-N 3.23Å
113	L	92.5	Very high	88.5	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	19%	0.187	C	C	.	.			trans	-66.1	127.4	-174.6	-160	82.4	0	0	0	111.1	A89 L92 L110 L116 L134 S136 L137	A89-L113 HydrophobicContact CB-CD1 4.03Å; A89-L113 WeakPolarHBondContact O-CA 3.38Å; A89-L113 WeakPolarHBondContact O-CD1 3.34Å; A89-L113 PolarHBondContact O-N 3.28Å; A89-L113 VanDerWaalsContact O-N 3.12Å; L92-L113 HydrophobicContact CB-CD1 3.68Å; L92-L113 HydrophobicContact CB-CD2 4.06Å; L110-L113 HydrophobicContact CB-CB 4.16Å; L110-L113 HydrophobicContact CD1-CD2 4.32Å; L110-L113 WeakPolarHBondContact O-CB 3.21Å; L110-L113 PolarHBondContact O-N 3.25Å; L110-L113 VanDerWaalsContact O-N 3.16Å; L113-L116 HydrophobicContact CD2-CB 4.01Å; L113-L116 HydrophobicContact CD2-CD1 4.45Å; L113-L134 HydrophobicContact CB-CD2 3.99Å; L113-L134 HydrophobicContact CD2-CD2 3.57Å; L113-L134 HydrophobicContact CG-CD2 4.41Å; L113-S136 CarbonylContact O-C 3.49Å; L113-S136 WeakPolarHBondContact O-CB 3.4Å; L113-L137 HydrophobicContact CD2-CD1 3.98Å; L113-L137 HydrophobicContact CG-CD1 4.31Å; L113-L137 WeakPolarHBondContact O-CA 3.5Å; L113-L137 PolarHBondContact O-N 2.87Å; L113-L137 VanDerWaalsContact O-N 3.12Å
114	K	87.1	Confident	88.6	Confident	94 Å²	94	40 Å²	40	41%	0.409	20%	0.197	S	C	.	.			trans	-105.6	-32.2	178	-71.2	177.1	170.5	-106.4	0	112.8	V90 T112 E138 Y139	V90-K114 HydrophobicContact CG1-CB 4.27Å; V90-K114 HydrophobicContact CG1-CD 4.03Å; V90-K114 HydrophobicContact CG1-CG 4.36Å; V90-K114 PolarHBondContact O-N 2.95Å; T112-K114 PolarHBondContact O-N 3.23Å; K114-E138 IonicContact NZ-OE1 3.39Å; K114-E138 PolarHBondContact NZ-OE1 2.82Å; K114-E138 PolarHBondContact O-N 3.32Å; K114-Y139 PolarHBondContact O-N 3.37Å
115	R	85.7	Confident	88.9	Confident	74 Å²	74	39 Å²	39	28%	0.279	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	130.5	-177	-62.9	-173.1	175.1	156.6	-4.2	111.3	V90 T91 L92 E567	V90-R115 PolarHBondContact O-N 3.09Å; V90-R115 VanDerWaalsContact O-N 3.15Å; T91-R115 HydrophobicContact CG2-CB 4.02Å; L92-R115 PolarHBondContact N-O 2.91Å; R115-E567 IonicContact NH1-OE1 2.72Å; R115-E567 PolarHBondContact NH1-OE1 3.26Å
116	L	92.8	Very high	89.4	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	124.9	175.5	177.6	57.7	0	0	0	110.4	L92 L94 F107 L113 L118 F131 L134 L137 Y139 L140 Q141	L92-L116 HydrophobicContact CB-CD1 4.18Å; L92-L116 HydrophobicContact CD2-CD1 4.07Å; L92-L116 HydrophobicContact CG-CD1 4.04Å; L94-L116 HydrophobicContact CD1-CD1 4.28Å; F107-L116 HydrophobicContact CE2-CD2 4.11Å; F107-L116 HydrophobicContact CZ-CD2 4.12Å; L113-L116 HydrophobicContact CD2-CB 4.01Å; L113-L116 HydrophobicContact CD2-CD1 4.45Å; L116-L118 HydrophobicContact CD1-CD2 4.48Å; L116-L118 HydrophobicContact CD1-CG 4.27Å; L116-L118 HydrophobicContact CD2-CD1 4.09Å; L116-L118 HydrophobicContact CG-CD1 4.23Å; L116-L118 HydrophobicContact CG-CG 4.16Å; L116-F131 HydrophobicContact CD2-CD1 4.21Å; L116-F131 HydrophobicContact CD2-CE1 4.2Å; L116-L134 HydrophobicContact CD2-CD1 3.61Å; L116-L137 HydrophobicContact CB-CD1 3.76Å; L116-L137 HydrophobicContact CB-CD2 4.34Å; L116-Y139 PolarHBondContact N-O 3.12Å; L116-Y139 VanDerWaalsContact N-O 3.12Å; L116-L140 HydrophobicContact CB-CD1 4.13Å; L116-L140 HydrophobicContact CD2-CD1 3.99Å; L116-L140 HydrophobicContact CG-CD1 4.04Å; L116-Q141 PolarHBondContact O-N 2.61Å
117	H	86.4	Confident	89.5	Confident	1 Å²	1	43.1 Å²	43.1	1%	0.005	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	117.8	179.6	-51.2	-103.2	0	0	0	109.7	L92 H93 L94 Y139 Q141 N566	L92-H117 PolarHBondContact O-N 2.95Å; H93-H117 HydrophobicContact CB-CB 4.48Å; H93-H117 AromaticContact CE1-CD2 3.25Å; H93-H117 PolarHBondContact CE1-CD2 3.35Å; H93-H117 AromaticContact CE1-CE1 3.82Å; H93-H117 AromaticContact CE1-CG 3.72Å; H93-H117 AromaticContact CE1-NE2 3.36Å; H93-H117 PolarHBondContact CE1-NE2 3.46Å; H93-H117 AromaticContact CG-CD2 3.85Å; H93-H117 AromaticContact ND1-CD2 3.24Å; H93-H117 PolarHBondContact ND1-CD2 2.94Å; H93-H117 AromaticContact ND1-CG 3.38Å; H93-H117 AromaticContact ND1-ND1 3.97Å; H93-H117 AromaticContact ND1-NE2 3.83Å; H93-H117 AromaticContact NE2-CD2 3.85Å; H93-H117 AromaticContact NE2-NE2 3.96Å; L94-H117 PolarHBondContact N-O 2.89Å; H117-Y139 AromaticContact CE1-CD1 3.92Å; H117-Y139 AromaticContact CE1-CE1 3.32Å; H117-Y139 WeakPolarHBondContact CE1-CE1 3.24Å; H117-Y139 AromaticContact ND1-CE1 3.66Å; H117-Q141 PolarHBondContact ND1-OE1 2.89Å; H117-N566 PolarHBondContact CE1-OD1 3.39Å
118	L	92.2	Very high	89.4	Confident	0 Å²	0	47 Å²	47	0%	0	22%	0.222	C	C	.	.			trans	-120.7	18.4	-179.9	-68.5	167.1	0	0	0	111.6	L94 M99 I102 L116 N121 L123 F131 L140 Q141 A142 N145	L94-L118 HydrophobicContact CB-CD2 3.9Å; L94-L118 HydrophobicContact CD1-CD2 4.13Å; M99-L118 HydrophobicContact SD-CD2 4.26Å; I102-L118 HydrophobicContact CD1-CD1 4.08Å; I102-L118 HydrophobicContact CD1-CD2 4.19Å; L116-L118 HydrophobicContact CD1-CD2 4.48Å; L116-L118 HydrophobicContact CD1-CG 4.27Å; L116-L118 HydrophobicContact CD2-CD1 4.09Å; L116-L118 HydrophobicContact CG-CD1 4.23Å; L116-L118 HydrophobicContact CG-CG 4.16Å; L118-N121 PolarHBondContact O-ND2 3.1Å; L118-L123 HydrophobicContact CB-CD1 4.37Å; L118-L123 HydrophobicContact CD1-CD1 4.4Å; L118-F131 HydrophobicContact CD1-CE1 3.99Å; L118-L140 HydrophobicContact CD1-CD1 4.42Å; L118-Q141 PolarHBondContact N-O 3.46Å; L118-A142 HydrophobicContact CB-CB 4.3Å; L118-N145 PolarHBondContact O-ND2 3.18Å
119	N	86.7	Confident	89.4	Confident	7 Å²	7	48.7 Å²	48.7	4%	0.037	23%	0.228	C	C	.	.			trans	-60.6	146.4	-174.6	62.2	-73.1	0	0	0	113.8	G95 N96 N121 Q141 D143	G95-N119 CarbonylContact C-O 3.53Å; G95-N119 WeakPolarHBondContact CA-O 3.3Å; N96-N119 PolarHBondContact N-O 2.86Å; N96-N119 VanDerWaalsContact N-O 3.13Å; N119-N121 PolarHBondContact O-ND2 3.34Å; N119-Q141 HydrophobicContact CB-CG 4.26Å; N119-D143 WeakPolarHBondContact CA-O 3.4Å; N119-D143 WeakPolarHBondContact CB-OD1 3.37Å
120	N	84.5	Confident	89.8	Confident	87 Å²	87	48.2 Å²	48.2	47%	0.465	22%	0.222	S	C	.	.	S	Bend	trans	51.8	63.1	179.1	-165.2	32.9	0	0	0	112.8	N96 D143 Y144	N96-N120 WeakPolarHBondContact CA-O 3.31Å; N96-N120 PolarHBondContact N-O 3.39Å; N96-N120 WeakPolarHBondContact OD1-CB 3.28Å; N96-N120 PolarHBondContact OD1-ND2 3.11Å; N120-D143 PolarHBondContact N-O 3.47Å; N120-Y144 WeakPolarHBondContact CA-O 3.32Å; N120-Y144 PolarHBondContact N-O 2.85Å
121	N	90.4	Very high	90	Very high	4 Å²	4	48.2 Å²	48.2	2%	0.021	22%	0.222	C	C	.	.			trans	-132.1	-173.3	177.9	-86	-60.7	0	0	0	110.1	L94 N97 D98 M99 L118 N119 L123 Y144 N145	L94-N121 PolarHBondContact O-ND2 3.26Å; N97-N121 WeakPolarHBondContact CA-OD1 3.4Å; N97-N121 WeakPolarHBondContact CB-OD1 3.2Å; N97-N121 PolarHBondContact N-OD1 3.34Å; D98-N121 PolarHBondContact N-OD1 2.86Å; M99-N121 HydrophobicContact CB-CB 4.17Å; M99-N121 VanDerWaalsContact CB-OD1 3.32Å; M99-N121 WeakPolarHBondContact CB-OD1 3.49Å; M99-N121 PolarHBondContact N-OD1 3.02Å; L118-N121 PolarHBondContact O-ND2 3.1Å; N119-N121 PolarHBondContact O-ND2 3.34Å; N121-L123 HydrophobicContact CB-CG 4.4Å; N121-Y144 PolarHBondContact N-O 3.16Å; N121-N145 WeakPolarHBondContact CA-OD1 3.29Å; N121-N145 WeakPolarHBondContact CB-OD1 3.04Å; N121-N145 PolarHBondContact N-ND2 3.23Å; N121-N145 PolarHBondContact O-OD1 3.09Å
122	K	92.4	Very high	90.2	Very high	74 Å²	74	43.5 Å²	43.5	32%	0.322	21%	0.209	S	C	.	.			trans	-116.5	30.3	-172	-63.8	-179.4	168.4	159.9	0	112	D98 M99 Q100 Y146	D98-K122 HydrophobicContact CB-CD 4.27Å; D98-K122 WeakPolarHBondContact OD1-CE 3.37Å; D98-K122 IonicContact OD1-NZ 2.72Å; D98-K122 PolarHBondContact OD1-NZ 2.79Å; D98-K122 IonicContact OD2-NZ 2.74Å; D98-K122 PolarHBondContact OD2-NZ 2.83Å; M99-K122 CarbonylContact O-C 3.21Å; M99-K122 VanDerWaalsContact O-CA 3.24Å; M99-K122 WeakPolarHBondContact O-CA 3.35Å; M99-K122 PolarHBondContact O-N 3.17Å; Q100-K122 HydrophobicContact CG-CB 4.32Å; K122-Y146 HydrophobicContact CB-CD2 4.37Å; K122-Y146 HydrophobicContact CB-CE2 4.46Å; K122-Y146 HydrophobicContact CG-CD2 4.49Å; K122-Y146 HydrophobicContact CG-CE2 4.1Å
123	L	92.8	Very high	90.1	Very high	5 Å²	5	41.2 Å²	41.2	3%	0.026	20%	0.198	C	C	.	.			trans	-74.2	128.6	-177.8	-59	174.1	0	0	0	110.9	M99 I102 L118 N121 N145 Y146 I147	M99-L123 HydrophobicContact CB-CD2 4.42Å; M99-L123 HydrophobicContact CG-CD2 4.04Å; M99-L123 WeakPolarHBondContact O-CD2 3.47Å; M99-L123 PolarHBondContact O-N 2.96Å; M99-L123 HydrophobicContact SD-CD2 4.42Å; I102-L123 HydrophobicContact CD1-CD1 4.03Å; I102-L123 HydrophobicContact CD1-CD2 4.1Å; I102-L123 HydrophobicContact CG1-CD2 3.95Å; L118-L123 HydrophobicContact CB-CD1 4.37Å; L118-L123 HydrophobicContact CD1-CD1 4.4Å; N121-L123 HydrophobicContact CB-CG 4.4Å; L123-N145 WeakPolarHBondContact CB-OD1 3.01Å; L123-N145 WeakPolarHBondContact CG-OD1 3.3Å; L123-N145 PolarHBondContact N-OD1 3.38Å; L123-Y146 CarbonylContact O-C 3.54Å; L123-Y146 WeakPolarHBondContact O-CA 3.3Å; L123-Y146 PolarHBondContact O-N 3.16Å; L123-I147 HydrophobicContact CB-CG1 4.23Å; L123-I147 WeakPolarHBondContact O-CG1 3.25Å; L123-I147 PolarHBondContact O-N 2.89Å; L123-I147 VanDerWaalsContact O-N 3.08Å
124	E	91.9	Very high	90.1	Very high	130 Å²	130	41.2 Å²	41.2	61%	0.607	20%	0.198	S	C	*	.			trans	-100.1	-28.1	-176.7	-64.3	-178.1	179.9	0	0	114.5	I147 S148	E124-I147 WeakPolarHBondContact O-CA 3.13Å; E124-S148 PolarHBondContact O-N 3.47Å; E124-S148 PolarHBondContact O-OG 3.19Å
125	V	92.3	Very high	90.2	Very high	54 Å²	54	41.9 Å²	41.9	33%	0.327	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	136.8	-173.9	-178.9	0	0	0	0	110.7	R127 A149	V125-R127 HydrophobicContact CG1-CG 4.18Å; V125-A149 WeakPolarHBondContact CA-O 2.89Å; V125-A149 HydrophobicContact CG1-CB 4.47Å
126	L	93.6	Very high	90.4	Very high	3 Å²	3	39.4 Å²	39.4	2%	0.016	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	116.8	168.9	-60.1	-178.7	0	0	0	110.4	T130 F131 I147 A149 I150 E151 F155 L166	L126-T130 HydrophobicContact CD2-CG2 4.41Å; L126-F131 HydrophobicContact CB-CE2 4.35Å; L126-F131 HydrophobicContact CD1-CE2 4.04Å; L126-F131 HydrophobicContact CD1-CZ 4.14Å; L126-F131 HydrophobicContact CD2-CE2 4.07Å; L126-F131 HydrophobicContact CD2-CZ 3.85Å; L126-F131 HydrophobicContact CG-CE2 4.38Å; L126-I147 HydrophobicContact CD1-CD1 4.01Å; L126-I147 HydrophobicContact CD1-CG2 4.42Å; L126-I147 HydrophobicContact CD2-CD1 4.17Å; L126-I147 HydrophobicContact CG-CD1 4.03Å; L126-I147 HydrophobicContact CG-CG1 4.49Å; L126-I147 HydrophobicContact CG-CG2 3.99Å; L126-A149 PolarHBondContact N-O 2.56Å; L126-A149 VanDerWaalsContact N-O 3.09Å; L126-I150 HydrophobicContact CB-CG1 4.26Å; L126-I150 HydrophobicContact CB-CG2 4.36Å; L126-I150 HydrophobicContact CD1-CD1 4.41Å; L126-I150 HydrophobicContact CD1-CG1 4.25Å; L126-I150 WeakPolarHBondContact O-CA 2.98Å; L126-E151 PolarHBondContact O-N 2.67Å; L126-F155 HydrophobicContact CD1-CE1 4.3Å; L126-F155 HydrophobicContact CD1-CZ 4.29Å; L126-L166 HydrophobicContact CD1-CD2 4.4Å
127	R	92.4	Very high	90.5	Very high	90 Å²	90	39.4 Å²	39.4	34%	0.34	20%	0.197	S	C	.	.			trans	-96.3	162.3	-175.6	-54.6	-177.9	-176.1	127.9	-6.4	111.9	E101 V125 D129 T130 E151	E101-R127 IonicContact OE1-CZ 3.38Å; E101-R127 IonicContact OE1-NH1 2.67Å; E101-R127 PolarHBondContact OE1-NH1 3.49Å; E101-R127 IonicContact OE1-NH2 3.21Å; E101-R127 PolarHBondContact OE1-NH2 3.22Å; E101-R127 VanDerWaalsContact OE1-NH2 3.17Å; V125-R127 HydrophobicContact CG1-CG 4.18Å; R127-D129 VanDerWaalsContact C-N 3.28Å; R127-D129 PolarHBondContact O-N 3.04Å; R127-T130 WeakPolarHBondContact CB-OG1 3.1Å; R127-T130 PolarHBondContact N-OG1 2.86Å; R127-T130 VanDerWaalsContact O-CB 3.31Å; R127-T130 WeakPolarHBondContact O-CB 3.32Å; R127-T130 PolarHBondContact O-N 3.07Å; R127-T130 VanDerWaalsContact O-N 3.09Å; R127-T130 PolarHBondContact O-OG1 2.72Å; R127-E151 WeakPolarHBondContact CA-OE2 3.41Å; R127-E151 WeakPolarHBondContact CB-OE2 3.15Å
128	E	89.6	Confident	90.6	Very high	81 Å²	81	41.5 Å²	41.5	38%	0.379	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.7	-43.8	178.6	176.4	156.4	-176.7	0	0	112.3	T130 E151 K157	E128-T130 VanDerWaalsContact C-N 3.35Å; E128-T130 PolarHBondContact O-N 3.25Å; E128-E151 PolarHBondContact N-OE2 2.95Å; E128-K157 IonicContact OE1-NZ 2.61Å
129	D	88.6	Confident	90.4	Very high	72 Å²	72	42.6 Å²	42.6	39%	0.385	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.8	2.7	-179.1	-65.8	-42.4	0	0	0	114.5	T104 G105 R127 F131 L132	T104-D129 HydrophobicContact CG2-CB 3.58Å; G105-D129 PolarHBondContact N-O 3.24Å; R127-D129 VanDerWaalsContact C-N 3.28Å; R127-D129 PolarHBondContact O-N 3.04Å; D129-F131 PolarHBondContact O-N 2.8Å; D129-L132 WeakPolarHBondContact O-CB 3.44Å; D129-L132 PolarHBondContact O-N 2.96Å
130	T	90.4	Very high	90.8	Very high	5 Å²	5	42.3 Å²	42.3	3%	0.031	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-43.4	-177.2	-69.7	0	0	0	0	111.7	I102 F107 L126 R127 E128	I102-T130 HydrophobicContact CB-CG2 4.16Å; I102-T130 HydrophobicContact CD1-CG2 4.18Å; I102-T130 HydrophobicContact CG2-CG2 4.11Å; F107-T130 VanDerWaalsContact CD2-O 3.27Å; F107-T130 WeakPolarHBondContact CD2-O 3.48Å; L126-T130 HydrophobicContact CD2-CG2 4.41Å; R127-T130 WeakPolarHBondContact CB-OG1 3.1Å; R127-T130 PolarHBondContact N-OG1 2.86Å; R127-T130 VanDerWaalsContact O-CB 3.31Å; R127-T130 WeakPolarHBondContact O-CB 3.32Å; R127-T130 PolarHBondContact O-N 3.07Å; R127-T130 VanDerWaalsContact O-N 3.09Å; R127-T130 PolarHBondContact O-OG1 2.72Å; E128-T130 VanDerWaalsContact C-N 3.35Å; E128-T130 PolarHBondContact O-N 3.25Å
131	F	92.7	Very high	91	Very high	2 Å²	2	38.3 Å²	38.3	1%	0.009	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.7	18.5	-176.8	-57.3	-72.3	0	0	0	113.5	F107 L116 L118 L126 D129 G133 L134 L140 A154 F155 L158	F107-F131 HydrophobicContact CD2-CD1 4.46Å; F107-F131 HydrophobicContact CE2-CD1 4.24Å; L116-F131 HydrophobicContact CD2-CD1 4.21Å; L116-F131 HydrophobicContact CD2-CE1 4.2Å; L118-F131 HydrophobicContact CD1-CE1 3.99Å; L126-F131 HydrophobicContact CB-CE2 4.35Å; L126-F131 HydrophobicContact CD1-CE2 4.04Å; L126-F131 HydrophobicContact CD1-CZ 4.14Å; L126-F131 HydrophobicContact CD2-CE2 4.07Å; L126-F131 HydrophobicContact CD2-CZ 3.85Å; L126-F131 HydrophobicContact CG-CE2 4.38Å; D129-F131 PolarHBondContact O-N 2.8Å; F131-G133 PolarHBondContact O-N 2.71Å; F131-L134 HydrophobicContact CB-CD1 4.12Å; F131-L134 HydrophobicContact CD1-CD1 3.94Å; F131-L134 WeakPolarHBondContact O-CB 3.4Å; F131-L134 PolarHBondContact O-N 2.78Å; F131-L140 HydrophobicContact CD1-CD2 4.49Å; F131-L140 HydrophobicContact CE1-CD1 3.93Å; F131-L140 HydrophobicContact CE1-CD2 3.96Å; F131-L140 HydrophobicContact CE2-CD2 4.25Å; F131-L140 HydrophobicContact CZ-CD1 4.39Å; F131-L140 HydrophobicContact CZ-CD2 3.82Å; F131-A154 WeakPolarHBondContact CD2-O 3.46Å; F131-F155 HydrophobicContact CD2-CD1 4.3Å; F131-F155 HydrophobicContact CD2-CE1 4.36Å; F131-F155 HydrophobicContact CE2-CD1 4.29Å; F131-F155 AromaticContact CE2-CE1 3.89Å; F131-F155 HydrophobicContact CE2-CE1 3.89Å; F131-L158 HydrophobicContact CB-CD1 4.22Å; F131-L158 HydrophobicContact CB-CD2 4.03Å; F131-L158 HydrophobicContact CB-CG 4.41Å; F131-L158 HydrophobicContact CD2-CD1 4.48Å; F131-L158 HydrophobicContact CG-CD1 4.32Å
132	L	90.3	Very high	91.1	Very high	70 Å²	70	38.2 Å²	38.2	37%	0.366	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	118.8	-178.3	-174.4	64.9	0	0	0	111.3	F107 S108 D129 K157	F107-L132 CarbonylContact C-O 3.04Å; S108-L132 PolarHBondContact N-O 2.74Å; D129-L132 WeakPolarHBondContact O-CB 3.44Å; D129-L132 PolarHBondContact O-N 2.96Å; L132-K157 HydrophobicContact CD1-CG 4.4Å
133	G	86.8	Confident	90.6	Very high	13 Å²	13	34.8 Å²	34.8	13%	0.134	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	114.3	-14.5	-176.9	0	0	0	0	0	114.8	F131 E135	F131-G133 PolarHBondContact O-N 2.71Å; G133-E135 VanDerWaalsContact C-N 3.31Å; G133-E135 PolarHBondContact O-N 2.74Å
134	L	92.4	Very high	90.2	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	19%	0.186	C	C	.	.			trans	-90.1	44.9	-173.2	-62.9	177.2	0	0	0	114.2	F107 L110 L113 L116 F131 S136 L137 L158	F107-L134 HydrophobicContact CB-CD1 4.09Å; F107-L134 HydrophobicContact CB-CD2 4.05Å; F107-L134 HydrophobicContact CB-CG 3.9Å; F107-L134 HydrophobicContact CD2-CD1 3.76Å; F107-L134 HydrophobicContact CD2-CG 4.48Å; F107-L134 HydrophobicContact CE2-CD1 4.41Å; F107-L134 HydrophobicContact CG-CD1 4.01Å; F107-L134 HydrophobicContact CG-CG 4.36Å; L110-L134 HydrophobicContact CB-CD2 3.56Å; L110-L134 HydrophobicContact CD1-CD2 4.08Å; L110-L134 HydrophobicContact CG-CD2 4.46Å; L113-L134 HydrophobicContact CB-CD2 3.99Å; L113-L134 HydrophobicContact CD2-CD2 3.57Å; L113-L134 HydrophobicContact CG-CD2 4.41Å; L116-L134 HydrophobicContact CD2-CD1 3.61Å; F131-L134 HydrophobicContact CB-CD1 4.12Å; F131-L134 HydrophobicContact CD1-CD1 3.94Å; F131-L134 WeakPolarHBondContact O-CB 3.4Å; F131-L134 PolarHBondContact O-N 2.78Å; L134-S136 PolarHBondContact O-N 3.13Å; L134-L137 HydrophobicContact CB-CB 4.31Å; L134-L137 HydrophobicContact CD1-CD2 4.43Å; L134-L137 WeakPolarHBondContact O-CB 3.42Å; L134-L137 PolarHBondContact O-N 2.87Å; L134-L137 VanDerWaalsContact O-N 3.15Å; L134-L158 HydrophobicContact CB-CD2 3.68Å; L134-L158 WeakPolarHBondContact O-CD2 3.3Å
135	E	89.3	Confident	90	Very high	108 Å²	108	32.3 Å²	32.3	51%	0.505	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-15.1	-173.5	-64.5	171.9	-154.6	0	0	114.9	G133	G133-E135 VanDerWaalsContact C-N 3.31Å; G133-E135 PolarHBondContact O-N 2.74Å
136	S	91	Very high	90.1	Very high	22 Å²	22	36.1 Å²	36.1	15%	0.154	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104	2.8	179.1	-66.9	0	0	0	0	115.2	R111 L113 L134 E138 K160	R111-S136 WeakPolarHBondContact O-CB 3.24Å; R111-S136 PolarHBondContact O-OG 3.18Å; L113-S136 CarbonylContact O-C 3.49Å; L113-S136 WeakPolarHBondContact O-CB 3.4Å; L134-S136 PolarHBondContact O-N 3.13Å; S136-E138 PolarHBondContact O-N 3.18Å; S136-K160 PolarHBondContact OG-NZ 2.85Å
137	L	94.1	Very high	90.1	Very high	0 Å²	0	36 Å²	36	0%	0	17%	0.167	C	C	.	.			trans	-65.8	128	-171.1	-159.5	73.5	0	0	0	111.9	L113 L116 L134 L140 L158 K160 L161	L113-L137 HydrophobicContact CD2-CD1 3.98Å; L113-L137 HydrophobicContact CG-CD1 4.31Å; L113-L137 WeakPolarHBondContact O-CA 3.5Å; L113-L137 PolarHBondContact O-N 2.87Å; L113-L137 VanDerWaalsContact O-N 3.12Å; L116-L137 HydrophobicContact CB-CD1 3.76Å; L116-L137 HydrophobicContact CB-CD2 4.34Å; L134-L137 HydrophobicContact CB-CB 4.31Å; L134-L137 HydrophobicContact CD1-CD2 4.43Å; L134-L137 WeakPolarHBondContact O-CB 3.42Å; L134-L137 PolarHBondContact O-N 2.87Å; L134-L137 VanDerWaalsContact O-N 3.15Å; L137-L140 HydrophobicContact CD2-CB 3.95Å; L137-L140 HydrophobicContact CD2-CD1 4.33Å; L137-L158 HydrophobicContact CB-CD2 4.16Å; L137-L158 HydrophobicContact CD2-CD1 4.27Å; L137-L158 HydrophobicContact CD2-CD2 4.16Å; L137-K160 CarbonylContact O-C 3.5Å; L137-L161 HydrophobicContact CD2-CD1 4.31Å; L137-L161 HydrophobicContact CG-CD1 4.44Å; L137-L161 VanDerWaalsContact O-CA 3.28Å; L137-L161 WeakPolarHBondContact O-CA 3.01Å; L137-L161 PolarHBondContact O-N 2.98Å
138	E	88.9	Confident	90.1	Very high	45 Å²	45	34.1 Å²	34.1	21%	0.21	17%	0.167	C	C	.	.			trans	-108.3	-26.3	178.8	-59.9	-170.4	-129	0	0	112.2	K114 S136 K160 K162 V163	K114-E138 IonicContact NZ-OE1 3.39Å; K114-E138 PolarHBondContact NZ-OE1 2.82Å; K114-E138 PolarHBondContact O-N 3.32Å; S136-E138 PolarHBondContact O-N 3.18Å; E138-K160 HydrophobicContact CG-CB 4.28Å; E138-K162 PolarHBondContact O-N 2.95Å; E138-K162 WeakPolarHBondContact OE2-CE 3.37Å; E138-K162 IonicContact OE2-NZ 2.75Å; E138-K162 PolarHBondContact OE2-NZ 2.86Å; E138-V163 PolarHBondContact O-N 2.9Å
139	Y	88.1	Confident	90.2	Very high	22 Å²	22	32.2 Å²	32.2	9%	0.086	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	128.2	-177.3	179.6	-79.5	0	0	0	110.7	K114 L116 H117 Q141 V163 I165 N566	K114-Y139 PolarHBondContact O-N 3.37Å; L116-Y139 PolarHBondContact N-O 3.12Å; L116-Y139 VanDerWaalsContact N-O 3.12Å; H117-Y139 AromaticContact CE1-CD1 3.92Å; H117-Y139 AromaticContact CE1-CE1 3.32Å; H117-Y139 WeakPolarHBondContact CE1-CE1 3.24Å; H117-Y139 AromaticContact ND1-CE1 3.66Å; Y139-Q141 HydrophobicContact CD1-CB 4.39Å; Y139-Q141 HydrophobicContact CE1-CB 3.56Å; Y139-Q141 PolarHBondContact OH-OE1 3.3Å; Y139-V163 HydrophobicContact CD2-CB 3.66Å; Y139-V163 HydrophobicContact CD2-CG1 3.59Å; Y139-V163 HydrophobicContact CD2-CG2 4.22Å; Y139-V163 HydrophobicContact CE2-CB 4.3Å; Y139-V163 HydrophobicContact CE2-CG1 3.71Å; Y139-V163 HydrophobicContact CG-CB 4.36Å; Y139-I165 HydrophobicContact CE2-CD1 4.13Å; Y139-I165 WeakPolarHBondContact OH-CD1 3.31Å; Y139-N566 PolarHBondContact OH-ND2 3.43Å
140	L	94.4	Very high	90.5	Very high	1 Å²	1	29.4 Å²	29.4	1%	0.005	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	122.7	174.8	178.2	57.9	0	0	0	110.3	L116 L118 F131 L137 F155 L158 L161 V163 L164 I165	L116-L140 HydrophobicContact CB-CD1 4.13Å; L116-L140 HydrophobicContact CD2-CD1 3.99Å; L116-L140 HydrophobicContact CG-CD1 4.04Å; L118-L140 HydrophobicContact CD1-CD1 4.42Å; F131-L140 HydrophobicContact CD1-CD2 4.49Å; F131-L140 HydrophobicContact CE1-CD1 3.93Å; F131-L140 HydrophobicContact CE1-CD2 3.96Å; F131-L140 HydrophobicContact CE2-CD2 4.25Å; F131-L140 HydrophobicContact CZ-CD1 4.39Å; F131-L140 HydrophobicContact CZ-CD2 3.82Å; L137-L140 HydrophobicContact CD2-CB 3.95Å; L137-L140 HydrophobicContact CD2-CD1 4.33Å; L140-F155 HydrophobicContact CD2-CD1 4.47Å; L140-F155 HydrophobicContact CD2-CE1 4.07Å; L140-L158 HydrophobicContact CD2-CD1 4.26Å; L140-L161 HydrophobicContact CB-CD1 3.77Å; L140-V163 PolarHBondContact N-O 2.89Å; L140-L164 HydrophobicContact CB-CD1 4.11Å; L140-L164 HydrophobicContact CD2-CD1 3.88Å; L140-L164 HydrophobicContact CG-CD1 4.03Å; L140-L164 WeakPolarHBondContact O-CA 3.16Å; L140-I165 PolarHBondContact O-N 2.82Å
141	Q	88.3	Confident	90.7	Very high	4 Å²	4	33.2 Å²	33.2	2%	0.019	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	124.8	178.2	173.6	-177.7	6.6	0	0	110.5	L116 H117 L118 N119 Y139 D143 I165	L116-Q141 PolarHBondContact O-N 2.61Å; H117-Q141 PolarHBondContact ND1-OE1 2.89Å; L118-Q141 PolarHBondContact N-O 3.46Å; N119-Q141 HydrophobicContact CB-CG 4.26Å; Y139-Q141 HydrophobicContact CD1-CB 4.39Å; Y139-Q141 HydrophobicContact CE1-CB 3.56Å; Y139-Q141 PolarHBondContact OH-OE1 3.3Å; Q141-D143 VanDerWaalsContact CD-OD1 3.29Å; Q141-D143 WeakPolarHBondContact CG-OD1 3.29Å; Q141-D143 PolarHBondContact NE2-OD1 2.66Å; Q141-D143 PolarHBondContact NE2-OD2 3.27Å; Q141-I165 HydrophobicContact CB-CB 4.44Å; Q141-I165 HydrophobicContact CG-CB 4.4Å; Q141-I165 HydrophobicContact CG-CG2 4.45Å
142	A	91.9	Very high	90.5	Very high	1 Å²	1	35.6 Å²	35.6	1%	0.008	19%	0.188	C	C	.	.			trans	-144.6	40.3	177.4	0	0	0	0	0	112.2	L118 I147 I165 L166 N169	L118-A142 HydrophobicContact CB-CB 4.3Å; A142-I147 HydrophobicContact CB-CD1 4.19Å; A142-I165 PolarHBondContact N-O 3.27Å; A142-L166 HydrophobicContact CB-CD2 4.09Å; A142-N169 PolarHBondContact O-ND2 3.28Å
143	D	83.9	Confident	90.4	Very high	3 Å²	3	32.6 Å²	32.6	2%	0.016	17%	0.174	C	C	.	.			trans	-62.4	157.9	170.7	54.7	-49.8	0	0	0	112.7	N119 N120 Q141 N145 I165 N167 R506	N119-D143 WeakPolarHBondContact CA-O 3.4Å; N119-D143 WeakPolarHBondContact CB-OD1 3.37Å; N120-D143 PolarHBondContact N-O 3.47Å; Q141-D143 VanDerWaalsContact CD-OD1 3.29Å; Q141-D143 WeakPolarHBondContact CG-OD1 3.29Å; Q141-D143 PolarHBondContact NE2-OD1 2.66Å; Q141-D143 PolarHBondContact NE2-OD2 3.27Å; D143-N145 PolarHBondContact O-N 2.94Å; D143-N145 PolarHBondContact O-ND2 3.18Å; D143-I165 HydrophobicContact CB-CG2 4.26Å; D143-N167 WeakPolarHBondContact CA-O 3.21Å; D143-N167 WeakPolarHBondContact CB-OD1 3.49Å; D143-R506 IonicContact OD2-NH1 2.74Å; D143-R506 PolarHBondContact OD2-NH1 3Å
144	Y	82.9	Confident	90.7	Very high	79 Å²	79	32.1 Å²	32.1	31%	0.31	17%	0.169	S	C	.	.	S	Bend	trans	49.9	58.9	179.5	-61.8	-73.2	0	0	0	112.7	N120 N121 N167 D168 Y460	N120-Y144 WeakPolarHBondContact CA-O 3.32Å; N120-Y144 PolarHBondContact N-O 2.85Å; N121-Y144 PolarHBondContact N-O 3.16Å; Y144-N167 PolarHBondContact N-O 2.76Å; Y144-D168 WeakPolarHBondContact CA-O 3.46Å; Y144-D168 HydrophobicContact CD1-CB 3.53Å; Y144-D168 HydrophobicContact CE1-CB 3.31Å; Y144-D168 WeakPolarHBondContact CE1-OD2 3.21Å; Y144-D168 HydrophobicContact CE2-CB 4.49Å; Y144-D168 HydrophobicContact CG-CB 4.18Å; Y144-D168 PolarHBondContact OH-OD2 2.78Å; Y144-Y460 PolarHBondContact OH-OH 3.26Å; Y144-Y460 VanDerWaalsContact OH-OH 3.06Å
145	N	89.2	Confident	90.7	Very high	4 Å²	4	32.1 Å²	32.1	2%	0.021	17%	0.169	C	C	.	.	S	Bend	trans	-129.9	178.7	174.1	-87.4	-98.3	0	0	0	109.5	L118 N121 L123 D143 I147 D168 N169	L118-N145 PolarHBondContact O-ND2 3.18Å; N121-N145 WeakPolarHBondContact CA-OD1 3.29Å; N121-N145 WeakPolarHBondContact CB-OD1 3.04Å; N121-N145 PolarHBondContact N-ND2 3.23Å; N121-N145 PolarHBondContact O-OD1 3.09Å; L123-N145 WeakPolarHBondContact CB-OD1 3.01Å; L123-N145 WeakPolarHBondContact CG-OD1 3.3Å; L123-N145 PolarHBondContact N-OD1 3.38Å; D143-N145 PolarHBondContact O-N 2.94Å; D143-N145 PolarHBondContact O-ND2 3.18Å; N145-I147 HydrophobicContact CB-CD1 4.08Å; N145-I147 HydrophobicContact CB-CG1 3.94Å; N145-D168 PolarHBondContact N-O 2.85Å; N145-N169 WeakPolarHBondContact CB-OD1 3.35Å; N145-N169 PolarHBondContact O-OD1 2.92Å
146	Y	92.6	Very high	90.8	Very high	134 Å²	134	27.8 Å²	27.8	53%	0.525	15%	0.151	S	C	.	.			trans	-102.7	27.2	179.1	-58.6	-52.4	0	0	0	112.5	K122 L123 S148 L170	K122-Y146 HydrophobicContact CB-CD2 4.37Å; K122-Y146 HydrophobicContact CB-CE2 4.46Å; K122-Y146 HydrophobicContact CG-CD2 4.49Å; K122-Y146 HydrophobicContact CG-CE2 4.1Å; L123-Y146 CarbonylContact O-C 3.54Å; L123-Y146 WeakPolarHBondContact O-CA 3.3Å; L123-Y146 PolarHBondContact O-N 3.16Å; Y146-S148 PolarHBondContact O-N 2.95Å; Y146-L170 HydrophobicContact CD1-CD1 4.26Å
147	I	94.6	Very high	90.7	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.159	C	C	.	.			trans	-67.3	108.9	-170.3	-54.9	164.7	0	0	0	109.1	L123 E124 L126 A142 N145 A149 I150 L166 N169 L170 L171	L123-I147 HydrophobicContact CB-CG1 4.23Å; L123-I147 WeakPolarHBondContact O-CG1 3.25Å; L123-I147 PolarHBondContact O-N 2.89Å; L123-I147 VanDerWaalsContact O-N 3.08Å; E124-I147 WeakPolarHBondContact O-CA 3.13Å; L126-I147 HydrophobicContact CD1-CD1 4.01Å; L126-I147 HydrophobicContact CD1-CG2 4.42Å; L126-I147 HydrophobicContact CD2-CD1 4.17Å; L126-I147 HydrophobicContact CG-CD1 4.03Å; L126-I147 HydrophobicContact CG-CG1 4.49Å; L126-I147 HydrophobicContact CG-CG2 3.99Å; A142-I147 HydrophobicContact CB-CD1 4.19Å; N145-I147 HydrophobicContact CB-CD1 4.08Å; N145-I147 HydrophobicContact CB-CG1 3.94Å; I147-A149 WeakPolarHBondContact CG2-O 3.43Å; I147-I150 HydrophobicContact CG2-CG1 4.21Å; I147-L166 HydrophobicContact CD1-CD2 4.24Å; I147-N169 HydrophobicContact CB-CB 4.47Å; I147-N169 WeakPolarHBondContact CB-OD1 3.44Å; I147-N169 WeakPolarHBondContact CD1-OD1 3.47Å; I147-N169 WeakPolarHBondContact CG1-OD1 3.48Å; I147-N169 PolarHBondContact N-OD1 3.22Å; I147-L170 CarbonylContact O-C 3.5Å; I147-L170 WeakPolarHBondContact O-CA 3.22Å; I147-L170 PolarHBondContact O-N 3.26Å; I147-L171 HydrophobicContact CB-CD2 4.4Å; I147-L171 HydrophobicContact CG2-CD2 3.76Å; I147-L171 WeakPolarHBondContact O-CD2 3.05Å; I147-L171 PolarHBondContact O-N 2.8Å; I147-L171 VanDerWaalsContact O-N 3.11Å
148	S	92.4	Very high	90.6	Very high	50 Å²	50	30.5 Å²	30.5	35%	0.35	16%	0.159	S	C	.	.			trans	-94.4	-29.3	-176.9	62.7	0	0	0	0	112.5	E124 Y146	E124-S148 PolarHBondContact O-N 3.47Å; E124-S148 PolarHBondContact O-OG 3.19Å; Y146-S148 PolarHBondContact O-N 2.95Å
149	A	92.3	Very high	90.6	Very high	42 Å²	42	33.1 Å²	33.1	35%	0.347	18%	0.175	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	150.3	-177.4	0	0	0	0	0	112.1	V125 L126 I147	V125-A149 WeakPolarHBondContact CA-O 2.89Å; V125-A149 HydrophobicContact CG1-CB 4.47Å; L126-A149 PolarHBondContact N-O 2.56Å; L126-A149 VanDerWaalsContact N-O 3.09Å; I147-A149 WeakPolarHBondContact CG2-O 3.43Å
150	I	94.8	Very high	90.8	Very high	13 Å²	13	37 Å²	37	7%	0.067	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	138.7	171.5	-59.6	174	0	0	0	106.4	L126 I147 A154 F155 L166 L171 L174 P175 V178	L126-I150 HydrophobicContact CB-CG1 4.26Å; L126-I150 HydrophobicContact CB-CG2 4.36Å; L126-I150 HydrophobicContact CD1-CD1 4.41Å; L126-I150 HydrophobicContact CD1-CG1 4.25Å; L126-I150 WeakPolarHBondContact O-CA 2.98Å; I147-I150 HydrophobicContact CG2-CG1 4.21Å; I150-A154 HydrophobicContact CG2-CB 3.68Å; I150-F155 HydrophobicContact CD1-CE2 4.45Å; I150-F155 HydrophobicContact CD1-CZ 4.22Å; I150-F155 HydrophobicContact CG2-CE2 4.3Å; I150-F155 HydrophobicContact CG2-CZ 4.28Å; I150-L166 HydrophobicContact CD1-CD1 4.07Å; I150-L171 HydrophobicContact CD1-CD1 3.99Å; I150-L171 HydrophobicContact CD1-CD2 3.75Å; I150-L171 HydrophobicContact CG1-CD2 3.69Å; I150-L174 HydrophobicContact CD1-CD2 4.28Å; I150-P175 HydrophobicContact CB-CG 4.44Å; I150-P175 HydrophobicContact CG2-CG 4.44Å; I150-P175 VanDerWaalsContact O-CG 3.28Å; I150-P175 WeakPolarHBondContact O-CG 3.45Å; I150-V178 HydrophobicContact CG2-CG2 4.07Å
151	E	93	Very high	90.7	Very high	84 Å²	84	36.9 Å²	36.9	39%	0.393	19%	0.192	S	C	.	.			trans	-83.8	147.4	173.1	-70.4	176.4	-174.3	0	0	111.3	L126 R127 E128 G153 A154	L126-E151 PolarHBondContact O-N 2.67Å; R127-E151 WeakPolarHBondContact CA-OE2 3.41Å; R127-E151 WeakPolarHBondContact CB-OE2 3.15Å; E128-E151 PolarHBondContact N-OE2 2.95Å; E151-G153 PolarHBondContact O-N 3.1Å; E151-A154 VanDerWaalsContact O-CB 3.3Å; E151-A154 WeakPolarHBondContact O-CB 3.4Å; E151-A154 PolarHBondContact O-N 3.35Å
152	A	88.6	Confident	90.7	Very high	52 Å²	52	41.1 Å²	41.1	43%	0.43	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-31	-172.1	0	0	0	0	0	114.3	P175	A152-P175 HydrophobicContact CB-CB 4.12Å
153	G	89.4	Confident	90.4	Very high	7 Å²	7	42.5 Å²	42.5	7%	0.072	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.1	-1.6	179	0	0	0	0	0	116	E151 F155 S156	E151-G153 PolarHBondContact O-N 3.1Å; G153-F155 VanDerWaalsContact C-N 3.27Å; G153-F155 PolarHBondContact O-N 3.03Å; G153-F155 VanDerWaalsContact O-N 3.11Å; G153-S156 WeakPolarHBondContact O-CB 3.47Å; G153-S156 PolarHBondContact O-N 3.12Å; G153-S156 PolarHBondContact O-OG 2.8Å
154	A	92.3	Very high	90.8	Very high	3 Å²	3	42.3 Å²	42.3	3%	0.025	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.2	-37.4	-170.5	0	0	0	0	0	114.7	F131 I150 E151	F131-A154 WeakPolarHBondContact CD2-O 3.46Å; I150-A154 HydrophobicContact CG2-CB 3.68Å; E151-A154 VanDerWaalsContact O-CB 3.3Å; E151-A154 WeakPolarHBondContact O-CB 3.4Å; E151-A154 PolarHBondContact O-N 3.35Å
155	F	93.3	Very high	91	Very high	1 Å²	1	40.1 Å²	40.1	0%	0.004	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102	6.4	178.1	-47.8	-44.3	0	0	0	113.4	L126 F131 L140 I150 G153 K157 L158 L164 L166 V178 F179 V182	L126-F155 HydrophobicContact CD1-CE1 4.3Å; L126-F155 HydrophobicContact CD1-CZ 4.29Å; F131-F155 HydrophobicContact CD2-CD1 4.3Å; F131-F155 HydrophobicContact CD2-CE1 4.36Å; F131-F155 HydrophobicContact CE2-CD1 4.29Å; F131-F155 AromaticContact CE2-CE1 3.89Å; F131-F155 HydrophobicContact CE2-CE1 3.89Å; L140-F155 HydrophobicContact CD2-CD1 4.47Å; L140-F155 HydrophobicContact CD2-CE1 4.07Å; I150-F155 HydrophobicContact CD1-CE2 4.45Å; I150-F155 HydrophobicContact CD1-CZ 4.22Å; I150-F155 HydrophobicContact CG2-CE2 4.3Å; I150-F155 HydrophobicContact CG2-CZ 4.28Å; G153-F155 VanDerWaalsContact C-N 3.27Å; G153-F155 PolarHBondContact O-N 3.03Å; G153-F155 VanDerWaalsContact O-N 3.11Å; F155-K157 PolarHBondContact O-N 3.28Å; F155-L158 HydrophobicContact CB-CD1 4.22Å; F155-L158 HydrophobicContact CD1-CD1 3.82Å; F155-L158 HydrophobicContact CG-CD1 4.44Å; F155-L158 PolarHBondContact O-N 3.34Å; F155-L164 HydrophobicContact CD2-CD2 4.24Å; F155-L164 HydrophobicContact CE2-CD2 3.71Å; F155-L164 HydrophobicContact CZ-CD1 4.31Å; F155-L164 HydrophobicContact CZ-CD2 3.96Å; F155-L166 HydrophobicContact CZ-CD1 4.37Å; F155-V178 HydrophobicContact CD2-CG2 3.82Å; F155-V178 HydrophobicContact CE2-CG2 3.99Å; F155-F179 HydrophobicContact CD2-CD1 4.38Å; F155-F179 HydrophobicContact CD2-CE1 4.25Å; F155-F179 HydrophobicContact CE2-CE1 4.22Å; F155-V182 HydrophobicContact CB-CG1 4.07Å; F155-V182 WeakPolarHBondContact O-CG1 3.18Å
156	S	90.6	Very high	91.1	Very high	17 Å²	17	40 Å²	40	12%	0.119	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-11.4	-171.5	68.9	0	0	0	0	115.9	G153	G153-S156 WeakPolarHBondContact O-CB 3.47Å; G153-S156 PolarHBondContact O-N 3.12Å; G153-S156 PolarHBondContact O-OG 2.8Å
157	K	89.1	Confident	90.7	Very high	78 Å²	78	34.1 Å²	34.1	34%	0.339	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-108.6	-6.6	177.3	-42.6	-56.1	-180	-124.6	0	112.9	E128 L132 F155 N159	E128-K157 IonicContact OE1-NZ 2.61Å; L132-K157 HydrophobicContact CD1-CG 4.4Å; F155-K157 PolarHBondContact O-N 3.28Å; K157-N159 PolarHBondContact O-N 2.82Å; K157-N159 VanDerWaalsContact O-N 3.08Å
158	L	92.3	Very high	90.2	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	20%	0.2	C	C	.	.			trans	-89.1	47.9	-170	-58	-176.3	0	0	0	112	F131 L134 L137 L140 F155 K160 L161 V182	F131-L158 HydrophobicContact CB-CD1 4.22Å; F131-L158 HydrophobicContact CB-CD2 4.03Å; F131-L158 HydrophobicContact CB-CG 4.41Å; F131-L158 HydrophobicContact CD2-CD1 4.48Å; F131-L158 HydrophobicContact CG-CD1 4.32Å; L134-L158 HydrophobicContact CB-CD2 3.68Å; L134-L158 WeakPolarHBondContact O-CD2 3.3Å; L137-L158 HydrophobicContact CB-CD2 4.16Å; L137-L158 HydrophobicContact CD2-CD1 4.27Å; L137-L158 HydrophobicContact CD2-CD2 4.16Å; L140-L158 HydrophobicContact CD2-CD1 4.26Å; F155-L158 HydrophobicContact CB-CD1 4.22Å; F155-L158 HydrophobicContact CD1-CD1 3.82Å; F155-L158 HydrophobicContact CG-CD1 4.44Å; F155-L158 PolarHBondContact O-N 3.34Å; L158-K160 PolarHBondContact O-N 3.25Å; L158-L161 HydrophobicContact CB-CB 4.05Å; L158-L161 HydrophobicContact CB-CD2 4.37Å; L158-L161 HydrophobicContact CD1-CD2 4.09Å; L158-L161 WeakPolarHBondContact O-CB 3.04Å; L158-L161 PolarHBondContact O-N 2.67Å; L158-V182 HydrophobicContact CB-CG1 4.1Å; L158-V182 WeakPolarHBondContact O-CG1 3.05Å
159	N	89.7	Confident	90.2	Very high	101 Å²	101	34.2 Å²	34.2	54%	0.54	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-8.3	-162.9	-57.8	-11.1	0	0	0	115.9	K157	K157-N159 PolarHBondContact O-N 2.82Å; K157-N159 VanDerWaalsContact O-N 3.08Å
160	K	90.6	Very high	90.2	Very high	102 Å²	102	35.7 Å²	35.7	44%	0.443	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-110.1	2.6	177.6	-53.9	-175.6	-158.8	162.4	0	113.7	S136 L137 E138 L158 K162	S136-K160 PolarHBondContact OG-NZ 2.85Å; L137-K160 CarbonylContact O-C 3.5Å; E138-K160 HydrophobicContact CG-CB 4.28Å; L158-K160 PolarHBondContact O-N 3.25Å; K160-K162 PolarHBondContact O-N 3.21Å
161	L	92.9	Very high	90.2	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	18%	0.183	C	C	.	.			trans	-67.4	123.7	-172.9	-173.2	70	0	0	0	111.1	L137 L140 L158 V163 L164 V182 L183 L184	L137-L161 HydrophobicContact CD2-CD1 4.31Å; L137-L161 HydrophobicContact CG-CD1 4.44Å; L137-L161 VanDerWaalsContact O-CA 3.28Å; L137-L161 WeakPolarHBondContact O-CA 3.01Å; L137-L161 PolarHBondContact O-N 2.98Å; L140-L161 HydrophobicContact CB-CD1 3.77Å; L158-L161 HydrophobicContact CB-CB 4.05Å; L158-L161 HydrophobicContact CB-CD2 4.37Å; L158-L161 HydrophobicContact CD1-CD2 4.09Å; L158-L161 WeakPolarHBondContact O-CB 3.04Å; L158-L161 PolarHBondContact O-N 2.67Å; L161-V163 WeakPolarHBondContact CD1-O 3.48Å; L161-L164 HydrophobicContact CD2-CB 4.48Å; L161-V182 HydrophobicContact CB-CB 4.27Å; L161-V182 HydrophobicContact CB-CG1 4.02Å; L161-V182 HydrophobicContact CD2-CG1 4.27Å; L161-L183 CarbonylContact O-C 3.56Å; L161-L183 PolarHBondContact O-N 2.05Å; L161-L184 HydrophobicContact CB-CD2 4.5Å; L161-L184 HydrophobicContact CD2-CD2 3.97Å; L161-L184 HydrophobicContact CG-CD2 3.83Å
162	K	87.9	Confident	90.1	Very high	93 Å²	93	36 Å²	36	40%	0.404	19%	0.19	S	C	.	.			trans	-112	-37.7	-178.6	-65.8	162.9	-175.5	172.3	0	112	E138 K160 L184 T185 H186	E138-K162 PolarHBondContact O-N 2.95Å; E138-K162 WeakPolarHBondContact OE2-CE 3.37Å; E138-K162 IonicContact OE2-NZ 2.75Å; E138-K162 PolarHBondContact OE2-NZ 2.86Å; K160-K162 PolarHBondContact O-N 3.21Å; K162-L184 CarbonylContact O-C 3.57Å; K162-L184 WeakPolarHBondContact O-CA 3.16Å; K162-T185 PolarHBondContact O-N 2.81Å; K162-T185 PolarHBondContact O-OG1 2.82Å; K162-H186 PolarHBondContact O-N 3.23Å; K162-H186 VanDerWaalsContact O-N 3.09Å
163	V	85.2	Confident	90.2	Very high	29 Å²	29	37 Å²	37	18%	0.176	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	124.2	-175.3	-179.9	0	0	0	0	109.3	E138 Y139 L140 L161 I165 H186	E138-V163 PolarHBondContact O-N 2.9Å; Y139-V163 HydrophobicContact CD2-CB 3.66Å; Y139-V163 HydrophobicContact CD2-CG1 3.59Å; Y139-V163 HydrophobicContact CD2-CG2 4.22Å; Y139-V163 HydrophobicContact CE2-CB 4.3Å; Y139-V163 HydrophobicContact CE2-CG1 3.71Å; Y139-V163 HydrophobicContact CG-CB 4.36Å; L140-V163 PolarHBondContact N-O 2.89Å; L161-V163 WeakPolarHBondContact CD1-O 3.48Å; V163-I165 HydrophobicContact CG1-CD1 4.18Å; V163-I165 HydrophobicContact CG1-CG1 4.03Å; V163-H186 HydrophobicContact CG1-CB 4.29Å; V163-H186 HydrophobicContact CG2-CB 4.23Å
164	L	93.8	Very high	90.3	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	115.7	176.4	179.1	58.8	0	0	0	110	L140 F155 L161 L166 F179 L184 H186 L187 D188	L140-L164 HydrophobicContact CB-CD1 4.11Å; L140-L164 HydrophobicContact CD2-CD1 3.88Å; L140-L164 HydrophobicContact CG-CD1 4.03Å; L140-L164 WeakPolarHBondContact O-CA 3.16Å; F155-L164 HydrophobicContact CD2-CD2 4.24Å; F155-L164 HydrophobicContact CE2-CD2 3.71Å; F155-L164 HydrophobicContact CZ-CD1 4.31Å; F155-L164 HydrophobicContact CZ-CD2 3.96Å; L161-L164 HydrophobicContact CD2-CB 4.48Å; L164-L166 HydrophobicContact CD1-CD1 3.94Å; L164-L166 HydrophobicContact CD1-CG 3.94Å; L164-L166 HydrophobicContact CD2-CD1 3.85Å; L164-L166 HydrophobicContact CG-CD1 3.81Å; L164-L166 HydrophobicContact CG-CG 4.07Å; L164-F179 HydrophobicContact CD2-CE1 3.85Å; L164-L184 HydrophobicContact CB-CD1 4.17Å; L164-L184 HydrophobicContact CB-CD2 3.82Å; L164-L184 HydrophobicContact CD2-CD1 4.09Å; L164-H186 PolarHBondContact N-O 3.27Å; L164-H186 VanDerWaalsContact N-O 3.1Å; L164-L187 HydrophobicContact CB-CD1 4.12Å; L164-L187 HydrophobicContact CD2-CD1 3.97Å; L164-L187 HydrophobicContact CG-CD1 4.06Å; L164-L187 WeakPolarHBondContact O-CA 3.15Å; L164-D188 PolarHBondContact O-N 2.75Å; L164-D188 VanDerWaalsContact O-N 3.09Å
165	I	85.6	Confident	90.3	Very high	32 Å²	32	38.6 Å²	38.6	16%	0.164	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	115.3	-178.6	-59.5	173.8	0	0	0	108.7	Y139 L140 Q141 A142 D143 V163 N167	Y139-I165 HydrophobicContact CE2-CD1 4.13Å; Y139-I165 WeakPolarHBondContact OH-CD1 3.31Å; L140-I165 PolarHBondContact O-N 2.82Å; Q141-I165 HydrophobicContact CB-CB 4.44Å; Q141-I165 HydrophobicContact CG-CB 4.4Å; Q141-I165 HydrophobicContact CG-CG2 4.45Å; A142-I165 PolarHBondContact N-O 3.27Å; D143-I165 HydrophobicContact CB-CG2 4.26Å; V163-I165 HydrophobicContact CG1-CD1 4.18Å; V163-I165 HydrophobicContact CG1-CG1 4.03Å; I165-N167 WeakPolarHBondContact CG2-OD1 3.23Å
166	L	92.7	Very high	90.2	Very high	1 Å²	1	41.9 Å²	41.9	1%	0.005	23%	0.225	C	C	.	.			trans	-135.4	22.5	-175.2	-72.7	171	0	0	0	112.1	L126 A142 I147 I150 F155 L164 N169 L171 D188 L189 N192	L126-L166 HydrophobicContact CD1-CD2 4.4Å; A142-L166 HydrophobicContact CB-CD2 4.09Å; I147-L166 HydrophobicContact CD1-CD2 4.24Å; I150-L166 HydrophobicContact CD1-CD1 4.07Å; F155-L166 HydrophobicContact CZ-CD1 4.37Å; L164-L166 HydrophobicContact CD1-CD1 3.94Å; L164-L166 HydrophobicContact CD1-CG 3.94Å; L164-L166 HydrophobicContact CD2-CD1 3.85Å; L164-L166 HydrophobicContact CG-CD1 3.81Å; L164-L166 HydrophobicContact CG-CG 4.07Å; L166-N169 PolarHBondContact O-ND2 3.14Å; L166-L171 HydrophobicContact CB-CD1 4.48Å; L166-L171 HydrophobicContact CD1-CD1 4.42Å; L166-D188 CarbonylContact C-O 3.55Å; L166-D188 WeakPolarHBondContact CA-O 3.38Å; L166-D188 PolarHBondContact N-O 2.82Å; L166-L189 HydrophobicContact CB-CD2 3.95Å; L166-L189 HydrophobicContact CD1-CD2 4.19Å; L166-N192 PolarHBondContact O-ND2 2.87Å
167	N	84.1	Confident	90.2	Very high	11 Å²	11	43.8 Å²	43.8	6%	0.059	23%	0.234	C	C	.	.			trans	-62.6	160.6	176.3	63.1	-75.5	0	0	0	112.3	D143 Y144 I165 N169 R190	D143-N167 WeakPolarHBondContact CA-O 3.21Å; D143-N167 WeakPolarHBondContact CB-OD1 3.49Å; Y144-N167 PolarHBondContact N-O 2.76Å; I165-N167 WeakPolarHBondContact CG2-OD1 3.23Å; N167-N169 PolarHBondContact O-N 3.33Å; N167-N169 PolarHBondContact O-ND2 3.37Å; N167-R190 CarbonylContact C-O 3.09Å; N167-R190 WeakPolarHBondContact CA-O 3.46Å; N167-R190 HydrophobicContact CB-CB 4.18Å
168	D	84.3	Confident	90.3	Very high	50 Å²	50	40.2 Å²	40.2	27%	0.267	22%	0.218	S	C	.	.	S	Bend	trans	52.8	53.6	174.6	-62.8	-67.7	0	0	0	112.9	Y144 N145 R190	Y144-D168 WeakPolarHBondContact CA-O 3.46Å; Y144-D168 HydrophobicContact CD1-CB 3.53Å; Y144-D168 HydrophobicContact CE1-CB 3.31Å; Y144-D168 WeakPolarHBondContact CE1-OD2 3.21Å; Y144-D168 HydrophobicContact CE2-CB 4.49Å; Y144-D168 HydrophobicContact CG-CB 4.18Å; Y144-D168 PolarHBondContact OH-OD2 2.78Å; N145-D168 PolarHBondContact N-O 2.85Å; D168-R190 PolarHBondContact N-O 3.04Å
169	N	91.6	Very high	90.3	Very high	3 Å²	3	40.4 Å²	40.4	2%	0.016	22%	0.219	C	C	.	.	S	Bend	trans	-130.5	-175.8	178.5	-89	-85.8	0	0	0	110.3	A142 N145 I147 L166 N167 N192	A142-N169 PolarHBondContact O-ND2 3.28Å; N145-N169 WeakPolarHBondContact CB-OD1 3.35Å; N145-N169 PolarHBondContact O-OD1 2.92Å; I147-N169 HydrophobicContact CB-CB 4.47Å; I147-N169 WeakPolarHBondContact CB-OD1 3.44Å; I147-N169 WeakPolarHBondContact CD1-OD1 3.47Å; I147-N169 WeakPolarHBondContact CG1-OD1 3.48Å; I147-N169 PolarHBondContact N-OD1 3.22Å; L166-N169 PolarHBondContact O-ND2 3.14Å; N167-N169 PolarHBondContact O-N 3.33Å; N167-N169 PolarHBondContact O-ND2 3.37Å; N169-N192 WeakPolarHBondContact CB-OD1 3.31Å; N169-N192 WeakPolarHBondContact O-CA 3.03Å; N169-N192 PolarHBondContact O-OD1 3Å
170	L	92.3	Very high	90.3	Very high	73 Å²	73	42.5 Å²	42.5	38%	0.382	22%	0.22	S	C	.	.			trans	-110.8	19.6	-172.2	-61.4	178.8	0	0	0	113.6	Y146 I147 L172	Y146-L170 HydrophobicContact CD1-CD1 4.26Å; I147-L170 CarbonylContact O-C 3.5Å; I147-L170 WeakPolarHBondContact O-CA 3.22Å; I147-L170 PolarHBondContact O-N 3.26Å; L170-L172 PolarHBondContact O-N 2.89Å
171	L	94.4	Very high	90.3	Very high	1 Å²	1	42.6 Å²	42.6	1%	0.005	22%	0.22	C	C	.	.			trans	-62.7	117	-171	-62	172.9	0	0	0	112	I147 I150 L166 L174 L189 N192 R193 L194	I147-L171 HydrophobicContact CB-CD2 4.4Å; I147-L171 HydrophobicContact CG2-CD2 3.76Å; I147-L171 WeakPolarHBondContact O-CD2 3.05Å; I147-L171 PolarHBondContact O-N 2.8Å; I147-L171 VanDerWaalsContact O-N 3.11Å; I150-L171 HydrophobicContact CD1-CD1 3.99Å; I150-L171 HydrophobicContact CD1-CD2 3.75Å; I150-L171 HydrophobicContact CG1-CD2 3.69Å; L166-L171 HydrophobicContact CB-CD1 4.48Å; L166-L171 HydrophobicContact CD1-CD1 4.42Å; L171-L174 HydrophobicContact CD1-CD2 4.38Å; L171-L189 HydrophobicContact CD1-CD2 3.96Å; L171-N192 HydrophobicContact CB-CB 4.35Å; L171-N192 WeakPolarHBondContact CB-OD1 3.5Å; L171-N192 VanDerWaalsContact CG-OD1 3.22Å; L171-N192 WeakPolarHBondContact CG-OD1 3.43Å; L171-N192 PolarHBondContact N-OD1 2.02Å; L171-R193 CarbonylContact O-C 3.53Å; L171-R193 VanDerWaalsContact O-CA 3.24Å; L171-R193 WeakPolarHBondContact O-CA 3.44Å; L171-R193 PolarHBondContact O-N 3.24Å; L171-L194 HydrophobicContact CB-CD2 4.16Å; L171-L194 PolarHBondContact O-N 3.25Å; L171-L194 VanDerWaalsContact O-N 3.08Å
172	L	90.9	Very high	90.2	Very high	103 Å²	103	42.9 Å²	42.9	54%	0.539	22%	0.222	S	C	.	.			trans	-80.7	-33.3	178	-67.8	168.4	0	0	0	113	L170 R193	L170-L172 PolarHBondContact O-N 2.89Å; L172-R193 HydrophobicContact CD2-CB 3.92Å
173	S	90.9	Very high	90.2	Very high	73 Å²	73	45.2 Å²	45.2	51%	0.51	24%	0.238	S	C	.	.			trans	-166.5	148.9	-178.3	56	0	0	0	0	110.5
174	L	93	Very high	90.4	Very high	13 Å²	13	44.3 Å²	44.3	7%	0.068	23%	0.232	C	C	.	.	P	Polyproline II helix	trans	-85.8	139.6	170.2	-61.4	176.5	0	0	0	110.9	I150 L171 V178 F179 L189 L194 M197 V202	I150-L174 HydrophobicContact CD1-CD2 4.28Å; L171-L174 HydrophobicContact CD1-CD2 4.38Å; L174-V178 HydrophobicContact CB-CG1 4.41Å; L174-F179 HydrophobicContact CD1-CE2 3.75Å; L174-F179 HydrophobicContact CD1-CZ 3.88Å; L174-L189 HydrophobicContact CD1-CD1 4.02Å; L174-L194 HydrophobicContact CG-CD2 4.43Å; L174-M197 HydrophobicContact CD1-CE 3.86Å; L174-M197 HydrophobicContact CD1-SD 4.3Å; L174-V202 HydrophobicContact CB-CG1 4.42Å; L174-V202 HydrophobicContact CB-CG2 4.37Å; L174-V202 HydrophobicContact CD1-CG1 4.04Å
175	P	92.1	Very high	90	Very high	29 Å²	29	46 Å²	46	19%	0.188	24%	0.242	C	C	.	.	P	Polyproline II helix	trans	-74.1	161.6	177.3	32.3	-35.6	0	0	0	111.8	I150 A152 V178	I150-P175 HydrophobicContact CB-CG 4.44Å; I150-P175 HydrophobicContact CG2-CG 4.44Å; I150-P175 VanDerWaalsContact O-CG 3.28Å; I150-P175 WeakPolarHBondContact O-CG 3.45Å; A152-P175 HydrophobicContact CB-CB 4.12Å; P175-V178 HydrophobicContact CG-CB 3.89Å; P175-V178 HydrophobicContact CG-CG2 3.79Å; P175-V178 WeakPolarHBondContact O-CB 3.49Å; P175-V178 WeakPolarHBondContact O-CG1 3.49Å
176	S	90.4	Very high	89.7	Confident	70 Å²	70	46.4 Å²	46.4	49%	0.49	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.4	143.9	-180	57.7	0	0	0	0	112.5	V178	S176-V178 PolarHBondContact O-N 2.59Å
177	N	90.1	Very high	89.6	Confident	58 Å²	58	46.5 Å²	46.5	31%	0.31	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	65.1	11.5	-173.4	-55.9	-91	0	0	0	115.5	F179 R180 G201	N177-F179 PolarHBondContact O-N 2.81Å; N177-F179 VanDerWaalsContact O-N 3.15Å; N177-R180 HydrophobicContact CB-CB 4.05Å; N177-R180 WeakPolarHBondContact O-CB 3.45Å; N177-R180 PolarHBondContact O-N 3.38Å; N177-G201 VanDerWaalsContact CA-O 3.22Å; N177-G201 WeakPolarHBondContact CA-O 3.44Å; N177-G201 PolarHBondContact N-O 2.98Å
178	V	92.4	Very high	89.7	Confident	3 Å²	3	46.7 Å²	46.7	2%	0.018	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-31.4	-175.5	75	0	0	0	0	114.1	I150 F155 L174 P175 S176	I150-V178 HydrophobicContact CG2-CG2 4.07Å; F155-V178 HydrophobicContact CD2-CG2 3.82Å; F155-V178 HydrophobicContact CE2-CG2 3.99Å; L174-V178 HydrophobicContact CB-CG1 4.41Å; P175-V178 HydrophobicContact CG-CB 3.89Å; P175-V178 HydrophobicContact CG-CG2 3.79Å; P175-V178 WeakPolarHBondContact O-CB 3.49Å; P175-V178 WeakPolarHBondContact O-CG1 3.49Å; S176-V178 PolarHBondContact O-N 2.59Å
179	F	92.3	Very high	90	Very high	4 Å²	4	44.3 Å²	44.3	2%	0.018	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.5	3.3	178.4	-57.5	-47.4	0	0	0	114.2	F155 L164 L174 N177 F181 V182 L184 L187 V202 H205 I206	F155-F179 HydrophobicContact CD2-CD1 4.38Å; F155-F179 HydrophobicContact CD2-CE1 4.25Å; F155-F179 HydrophobicContact CE2-CE1 4.22Å; L164-F179 HydrophobicContact CD2-CE1 3.85Å; L174-F179 HydrophobicContact CD1-CE2 3.75Å; L174-F179 HydrophobicContact CD1-CZ 3.88Å; N177-F179 PolarHBondContact O-N 2.81Å; N177-F179 VanDerWaalsContact O-N 3.15Å; F179-F181 PolarHBondContact O-N 3.49Å; F179-V182 HydrophobicContact CB-CG2 4.07Å; F179-V182 HydrophobicContact CD1-CG2 3.98Å; F179-V182 PolarHBondContact O-N 3.32Å; F179-V182 VanDerWaalsContact O-N 3.15Å; F179-V182 VanDerWaalsContact O-O 3.13Å; F179-L184 HydrophobicContact CD1-CD1 3.7Å; F179-L184 HydrophobicContact CE1-CD1 3.76Å; F179-L184 HydrophobicContact CG-CD1 4.37Å; F179-L184 HydrophobicContact CZ-CD1 4.45Å; F179-L187 HydrophobicContact CE2-CD2 3.97Å; F179-L187 HydrophobicContact CZ-CD1 4.28Å; F179-L187 HydrophobicContact CZ-CD2 3.82Å; F179-V202 HydrophobicContact CD2-CG1 3.98Å; F179-V202 HydrophobicContact CE2-CG1 3.9Å; F179-H205 HydrophobicContact CB-CB 4.12Å; F179-I206 HydrophobicContact CD2-CD1 3.7Å; F179-I206 HydrophobicContact CD2-CG1 3.81Å; F179-I206 HydrophobicContact CE2-CD1 3.8Å; F179-I206 HydrophobicContact CE2-CG1 4.41Å
180	R	89.8	Confident	89.8	Confident	145 Å²	145	46.5 Å²	46.5	55%	0.547	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-23.5	-171	177.5	173.7	171.1	-179.1	-3.3	115.1	N177	N177-R180 HydrophobicContact CB-CB 4.05Å; N177-R180 WeakPolarHBondContact O-CB 3.45Å; N177-R180 PolarHBondContact O-N 3.38Å
181	F	88.6	Confident	89.4	Confident	104 Å²	104	43.8 Å²	43.8	46%	0.456	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-115.2	6.9	-176.1	-57.9	-76.1	0	0	0	113.4	F179	F179-F181 PolarHBondContact O-N 3.49Å
182	V	90.9	Very high	89.3	Confident	5 Å²	5	43.7 Å²	43.7	3%	0.03	23%	0.229	C	C	.	.			trans	-125.5	137.3	-178.2	-61.9	0	0	0	0	111.1	F155 L158 L161 F179 L184	F155-V182 HydrophobicContact CB-CG1 4.07Å; F155-V182 WeakPolarHBondContact O-CG1 3.18Å; L158-V182 HydrophobicContact CB-CG1 4.1Å; L158-V182 WeakPolarHBondContact O-CG1 3.05Å; L161-V182 HydrophobicContact CB-CB 4.27Å; L161-V182 HydrophobicContact CB-CG1 4.02Å; L161-V182 HydrophobicContact CD2-CG1 4.27Å; F179-V182 HydrophobicContact CB-CG2 4.07Å; F179-V182 HydrophobicContact CD1-CG2 3.98Å; F179-V182 PolarHBondContact O-N 3.32Å; F179-V182 VanDerWaalsContact O-N 3.15Å; F179-V182 VanDerWaalsContact O-O 3.13Å; V182-L184 HydrophobicContact CB-CG 4.47Å; V182-L184 HydrophobicContact CG2-CD1 4.29Å; V182-L184 HydrophobicContact CG2-CD2 4.45Å; V182-L184 HydrophobicContact CG2-CG 4Å
183	L	88.1	Confident	89.3	Confident	143 Å²	143	45.1 Å²	45.1	75%	0.749	23%	0.227	S	C	*	.			trans	-106.9	71.1	-177.5	-66.2	176.5	0	0	0	109.5	L161 T185	L161-L183 CarbonylContact O-C 3.56Å; L161-L183 PolarHBondContact O-N 2.05Å; L183-T185 PolarHBondContact O-N 3.48Å
184	L	89.5	Confident	89.4	Confident	10 Å²	10	41.7 Å²	41.7	5%	0.052	20%	0.203	C	C	.	.			trans	-66.8	127.2	-176.9	-63.4	177.6	0	0	0	111.8	L161 K162 L164 F179 V182 L187	L161-L184 HydrophobicContact CB-CD2 4.5Å; L161-L184 HydrophobicContact CD2-CD2 3.97Å; L161-L184 HydrophobicContact CG-CD2 3.83Å; K162-L184 CarbonylContact O-C 3.57Å; K162-L184 WeakPolarHBondContact O-CA 3.16Å; L164-L184 HydrophobicContact CB-CD1 4.17Å; L164-L184 HydrophobicContact CB-CD2 3.82Å; L164-L184 HydrophobicContact CD2-CD1 4.09Å; F179-L184 HydrophobicContact CD1-CD1 3.7Å; F179-L184 HydrophobicContact CE1-CD1 3.76Å; F179-L184 HydrophobicContact CG-CD1 4.37Å; F179-L184 HydrophobicContact CZ-CD1 4.45Å; V182-L184 HydrophobicContact CB-CG 4.47Å; V182-L184 HydrophobicContact CG2-CD1 4.29Å; V182-L184 HydrophobicContact CG2-CD2 4.45Å; V182-L184 HydrophobicContact CG2-CG 4Å; L184-L187 HydrophobicContact CD1-CD1 4.29Å; L184-L187 HydrophobicContact CD1-CD2 4.47Å
185	T	85.6	Confident	89.2	Confident	35 Å²	35	46.4 Å²	46.4	22%	0.215	22%	0.223	C	C	.	.	S	Bend	trans	-95.9	-25.1	168.6	60.8	0	0	0	0	112.1	K162 L183 M210 E211	K162-T185 PolarHBondContact O-N 2.81Å; K162-T185 PolarHBondContact O-OG1 2.82Å; L183-T185 PolarHBondContact O-N 3.48Å; T185-M210 WeakPolarHBondContact O-CA 3.34Å; T185-M210 WeakPolarHBondContact O-CB 3.21Å; T185-M210 PolarHBondContact O-N 3.08Å; T185-E211 PolarHBondContact O-N 2.97Å
186	H	80.8	Confident	89.1	Confident	41 Å²	41	48.4 Å²	48.4	19%	0.19	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	133.2	176.1	-55.1	73.7	0	0	0	110.5	K162 V163 L164 M210 E211	K162-H186 PolarHBondContact O-N 3.23Å; K162-H186 VanDerWaalsContact O-N 3.09Å; V163-H186 HydrophobicContact CG1-CB 4.29Å; V163-H186 HydrophobicContact CG2-CB 4.23Å; L164-H186 PolarHBondContact N-O 3.27Å; L164-H186 VanDerWaalsContact N-O 3.1Å; H186-M210 VanDerWaalsContact CE1-CE 3.44Å; H186-M210 WeakPolarHBondContact CE1-CE 3.49Å; H186-E211 WeakPolarHBondContact CA-O 3.32Å; H186-E211 IonicContact CD2-OE2 3.65Å
187	L	90.3	Very high	89.1	Confident	3 Å²	3	45.2 Å²	45.2	2%	0.016	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	114.5	177	176.9	59.3	0	0	0	110.5	L164 F179 L184 L189 I206 I209 E211 I212 Q213	L164-L187 HydrophobicContact CB-CD1 4.12Å; L164-L187 HydrophobicContact CD2-CD1 3.97Å; L164-L187 HydrophobicContact CG-CD1 4.06Å; L164-L187 WeakPolarHBondContact O-CA 3.15Å; F179-L187 HydrophobicContact CE2-CD2 3.97Å; F179-L187 HydrophobicContact CZ-CD1 4.28Å; F179-L187 HydrophobicContact CZ-CD2 3.82Å; L184-L187 HydrophobicContact CD1-CD1 4.29Å; L184-L187 HydrophobicContact CD1-CD2 4.47Å; L187-L189 HydrophobicContact CD1-CD1 4.08Å; L187-L189 HydrophobicContact CD1-CD2 4.42Å; L187-L189 HydrophobicContact CD1-CG 3.96Å; L187-L189 HydrophobicContact CD2-CD1 3.84Å; L187-L189 HydrophobicContact CG-CD1 3.88Å; L187-L189 HydrophobicContact CG-CG 4.06Å; L187-I206 HydrophobicContact CD2-CD1 4.2Å; L187-I209 HydrophobicContact CB-CD1 3.77Å; L187-E211 PolarHBondContact N-O 3.13Å; L187-E211 VanDerWaalsContact N-O 3.12Å; L187-I212 HydrophobicContact CB-CG1 4.27Å; L187-I212 HydrophobicContact CD2-CD1 4.1Å; L187-I212 HydrophobicContact CD2-CG1 4.41Å; L187-I212 HydrophobicContact CG-CG1 4.45Å; L187-I212 WeakPolarHBondContact O-CA 3.24Å; L187-Q213 PolarHBondContact O-N 3.06Å
188	D	84.7	Confident	89	Confident	14 Å²	14	44.5 Å²	44.5	8%	0.075	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	122.4	172.9	-171	-1.2	0	0	0	110.8	L164 L166 R190 Q213	L164-D188 PolarHBondContact O-N 2.75Å; L164-D188 VanDerWaalsContact O-N 3.09Å; L166-D188 CarbonylContact C-O 3.55Å; L166-D188 WeakPolarHBondContact CA-O 3.38Å; L166-D188 PolarHBondContact N-O 2.82Å; D188-R190 WeakPolarHBondContact OD1-CB 3.37Å; D188-R190 VanDerWaalsContact OD1-CG 3.28Å; D188-R190 WeakPolarHBondContact OD1-CG 3.36Å; D188-R190 IonicContact OD1-CZ 3.47Å; D188-R190 PolarHBondContact OD1-N 3.47Å; D188-R190 IonicContact OD1-NE 2.78Å; D188-R190 PolarHBondContact OD1-NE 2.78Å; D188-R190 VanDerWaalsContact OD1-NE 3.08Å; D188-R190 IonicContact OD2-CZ 2.61Å; D188-R190 IonicContact OD2-NE 2.71Å; D188-R190 PolarHBondContact OD2-NE 3.39Å; D188-R190 IonicContact OD2-NH2 2.82Å; D188-R190 PolarHBondContact OD2-NH2 3.07Å; D188-Q213 HydrophobicContact CB-CB 4.45Å; D188-Q213 VanDerWaalsContact CG-OE1 3.27Å; D188-Q213 PolarHBondContact OD2-OE1 3.29Å
189	L	91.8	Very high	88.7	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	23%	0.226	C	C	.	.			trans	-129.3	18.9	179.5	-71.1	166.6	0	0	0	112	L166 L171 L174 L187 N192 L194 M197 Q213 L214 N217	L166-L189 HydrophobicContact CB-CD2 3.95Å; L166-L189 HydrophobicContact CD1-CD2 4.19Å; L171-L189 HydrophobicContact CD1-CD2 3.96Å; L174-L189 HydrophobicContact CD1-CD1 4.02Å; L187-L189 HydrophobicContact CD1-CD1 4.08Å; L187-L189 HydrophobicContact CD1-CD2 4.42Å; L187-L189 HydrophobicContact CD1-CG 3.96Å; L187-L189 HydrophobicContact CD2-CD1 3.84Å; L187-L189 HydrophobicContact CG-CD1 3.88Å; L187-L189 HydrophobicContact CG-CG 4.06Å; L189-N192 WeakPolarHBondContact O-CB 3.37Å; L189-N192 PolarHBondContact O-ND2 3.47Å; L189-L194 HydrophobicContact CB-CD1 4.22Å; L189-L194 HydrophobicContact CD1-CD1 4.23Å; L189-M197 HydrophobicContact CD1-CE 4.01Å; L189-Q213 PolarHBondContact N-O 3.12Å; L189-L214 HydrophobicContact CB-CD2 4.14Å; L189-L214 HydrophobicContact CD1-CD2 4.03Å; L189-N217 PolarHBondContact O-ND2 3.48Å
190	R	86.1	Confident	88.4	Confident	50 Å²	50	52 Å²	52	19%	0.189	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	159.2	179.7	-68.8	177.1	-64	145.9	0.2	113.1	N167 D168 D188 N192 Q213 E215	N167-R190 CarbonylContact C-O 3.09Å; N167-R190 WeakPolarHBondContact CA-O 3.46Å; N167-R190 HydrophobicContact CB-CB 4.18Å; D168-R190 PolarHBondContact N-O 3.04Å; D188-R190 WeakPolarHBondContact OD1-CB 3.37Å; D188-R190 VanDerWaalsContact OD1-CG 3.28Å; D188-R190 WeakPolarHBondContact OD1-CG 3.36Å; D188-R190 IonicContact OD1-CZ 3.47Å; D188-R190 PolarHBondContact OD1-N 3.47Å; D188-R190 IonicContact OD1-NE 2.78Å; D188-R190 PolarHBondContact OD1-NE 2.78Å; D188-R190 VanDerWaalsContact OD1-NE 3.08Å; D188-R190 IonicContact OD2-CZ 2.61Å; D188-R190 IonicContact OD2-NE 2.71Å; D188-R190 PolarHBondContact OD2-NE 3.39Å; D188-R190 IonicContact OD2-NH2 2.82Å; D188-R190 PolarHBondContact OD2-NH2 3.07Å; R190-N192 PolarHBondContact O-N 3.04Å; R190-N192 PolarHBondContact O-ND2 3.18Å; R190-Q213 HydrophobicContact CG-CB 3.81Å; R190-Q213 VanDerWaalsContact CZ-OE1 3.24Å; R190-E215 WeakPolarHBondContact CA-O 3.49Å; R190-E215 HydrophobicContact CG-CB 4.08Å
191	G	83.8	Confident	88.2	Confident	15 Å²	15	45.3 Å²	45.3	16%	0.155	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	65.7	7.4	175.6	0	0	0	0	0	115.7	E215	G191-E215 PolarHBondContact N-O 2.84Å
192	N	92.9	Very high	88.2	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.207	C	C	.	.	S	Bend	trans	-87.3	-175.1	-177.1	-85.1	-91.1	0	0	0	112.6	L166 N169 L171 L189 R190 L194 N217 P218	L166-N192 PolarHBondContact O-ND2 2.87Å; N169-N192 WeakPolarHBondContact CB-OD1 3.31Å; N169-N192 WeakPolarHBondContact O-CA 3.03Å; N169-N192 PolarHBondContact O-OD1 3Å; L171-N192 HydrophobicContact CB-CB 4.35Å; L171-N192 WeakPolarHBondContact CB-OD1 3.5Å; L171-N192 VanDerWaalsContact CG-OD1 3.22Å; L171-N192 WeakPolarHBondContact CG-OD1 3.43Å; L171-N192 PolarHBondContact N-OD1 2.02Å; L189-N192 WeakPolarHBondContact O-CB 3.37Å; L189-N192 PolarHBondContact O-ND2 3.47Å; R190-N192 PolarHBondContact O-N 3.04Å; R190-N192 PolarHBondContact O-ND2 3.18Å; N192-L194 HydrophobicContact CB-CG 4.32Å; N192-N217 WeakPolarHBondContact CA-OD1 3.36Å; N192-N217 WeakPolarHBondContact CB-OD1 3.42Å; N192-N217 PolarHBondContact O-OD1 2.96Å; N192-P218 VanDerWaalsContact O-CD 3.31Å; N192-P218 WeakPolarHBondContact O-CD 3.46Å
193	R	92.1	Very high	88.1	Confident	133 Å²	133	40.2 Å²	40.2	50%	0.502	21%	0.206	S	C	.	.			trans	-109.3	23.8	-177.4	-57.7	-52.8	-166.3	-166.7	4.9	113.3	L171 L172 K195 N217	L171-R193 CarbonylContact O-C 3.53Å; L171-R193 VanDerWaalsContact O-CA 3.24Å; L171-R193 WeakPolarHBondContact O-CA 3.44Å; L171-R193 PolarHBondContact O-N 3.24Å; L172-R193 HydrophobicContact CD2-CB 3.92Å; R193-K195 PolarHBondContact O-N 3.36Å; R193-N217 PolarHBondContact N-OD1 2.85Å
194	L	92.6	Very high	88.1	Confident	1 Å²	1	37.6 Å²	37.6	1%	0.005	19%	0.19	C	C	.	.			trans	-66.9	126.9	-177.5	-58	173.2	0	0	0	111	L171 L174 L189 N192 M197 N217 P218 W219	L171-L194 HydrophobicContact CB-CD2 4.16Å; L171-L194 PolarHBondContact O-N 3.25Å; L171-L194 VanDerWaalsContact O-N 3.08Å; L174-L194 HydrophobicContact CG-CD2 4.43Å; L189-L194 HydrophobicContact CB-CD1 4.22Å; L189-L194 HydrophobicContact CD1-CD1 4.23Å; N192-L194 HydrophobicContact CB-CG 4.32Å; L194-M197 HydrophobicContact CD1-CE 4.09Å; L194-N217 HydrophobicContact CB-CB 4.32Å; L194-N217 WeakPolarHBondContact CB-OD1 3.31Å; L194-N217 VanDerWaalsContact CG-OD1 3.28Å; L194-N217 WeakPolarHBondContact CG-OD1 3.27Å; L194-N217 PolarHBondContact N-OD1 3.09Å; L194-P218 CarbonylContact O-C 3.43Å; L194-P218 WeakPolarHBondContact O-CD 3.47Å; L194-W219 HydrophobicContact CB-CH2 3.74Å; L194-W219 HydrophobicContact CB-CZ2 4.24Å; L194-W219 HydrophobicContact CB-CZ3 4.01Å; L194-W219 HydrophobicContact CD1-CH2 4.05Å; L194-W219 HydrophobicContact CD1-CZ2 4.48Å
195	K	89.4	Confident	88	Confident	112 Å²	112	39.6 Å²	39.6	49%	0.487	20%	0.199	S	C	.	.			trans	-101.5	-26.1	177.5	-62.6	-177.6	-179.8	177.3	0	113.1	R193 P218 N220	R193-K195 PolarHBondContact O-N 3.36Å; K195-P218 HydrophobicContact CG-CG 4.37Å; K195-N220 HydrophobicContact CB-CB 4.21Å; K195-N220 PolarHBondContact O-N 3.42Å
196	M	89.4	Confident	88	Confident	70 Å²	70	38.3 Å²	38.3	35%	0.345	19%	0.19	S	C	.	.			trans	-159.4	155.9	178.7	60.2	179.5	-70.6	0	0	110.4	D224 L225	M196-D224 HydrophobicContact CE-CB 3.92Å; M196-D224 HydrophobicContact SD-CB 4.16Å; M196-L225 HydrophobicContact CB-CD1 4.07Å
197	M	89.9	Confident	87.5	Confident	3 Å²	3	40 Å²	40	2%	0.015	22%	0.219	C	C	.	.			trans	-127	116.6	171.3	-160.4	172.4	-64.5	0	0	109.1	L174 L189 L194 V202 L203 L214 W219 L228	L174-M197 HydrophobicContact CD1-CE 3.86Å; L174-M197 HydrophobicContact CD1-SD 4.3Å; L189-M197 HydrophobicContact CD1-CE 4.01Å; L194-M197 HydrophobicContact CD1-CE 4.09Å; M197-V202 HydrophobicContact CG-CB 4.39Å; M197-V202 HydrophobicContact CG-CG1 3.85Å; M197-V202 HydrophobicContact SD-CG1 3.93Å; M197-L203 HydrophobicContact CG-CD2 3.92Å; M197-L203 HydrophobicContact CG-CG 4.11Å; M197-L203 HydrophobicContact SD-CD2 3.39Å; M197-L203 WeakPolarHBondContact SD-CD2 3.19Å; M197-L203 HydrophobicContact SD-CG 4.22Å; M197-L214 HydrophobicContact CE-CD2 3.72Å; M197-W219 HydrophobicContact CB-CZ3 4.38Å; M197-W219 HydrophobicContact CE-CH2 4.24Å; M197-L228 HydrophobicContact CB-CD1 4.28Å; M197-L228 HydrophobicContact CB-CD2 4.31Å
198	P	87.2	Confident	86.8	Confident	44 Å²	44	42.6 Å²	42.6	29%	0.286	25%	0.246	S	C	.	.			trans	-75.9	148.6	-179.1	31.8	-34.5	0	0	0	110.7	V202 L203	P198-V202 HydrophobicContact CG-CB 4.41Å; P198-V202 HydrophobicContact CG-CG2 3.92Å; P198-V202 WeakPolarHBondContact O-CB 3.22Å; P198-L203 PolarHBondContact O-N 3.43Å
199	F	86.8	Confident	86.6	Confident	95 Å²	95	42.6 Å²	42.6	42%	0.417	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-54.8	174.1	-177.3	-85.2	0	0	0	111.4	G201 V202 L203 E204 P227 W231	F199-G201 PolarHBondContact O-N 3.16Å; F199-V202 PolarHBondContact O-N 3.46Å; F199-L203 HydrophobicContact CB-CD1 4.47Å; F199-L203 HydrophobicContact CD2-CB 3.95Å; F199-L203 HydrophobicContact CG-CB 4.47Å; F199-L203 PolarHBondContact O-N 2.95Å; F199-E204 HydrophobicContact CD1-CB 4.06Å; F199-E204 HydrophobicContact CE1-CB 3.64Å; F199-E204 HydrophobicContact CZ-CB 4.05Å; F199-E204 PolarHBondContact O-N 2.81Å; F199-P227 HydrophobicContact CB-CB 3.62Å; F199-W231 HydrophobicContact CD2-CB 4.34Å
200	A	86.3	Confident	85.9	Confident	69 Å²	69	48.1 Å²	48.1	57%	0.57	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	128.9	176.1	0	0	0	0	0	110.6	V202 E204	A200-V202 VanDerWaalsContact C-N 3.28Å; A200-V202 PolarHBondContact O-N 3.43Å; A200-E204 WeakPolarHBondContact CA-OE2 3.37Å
201	G	84.5	Confident	85.2	Confident	4 Å²	4	46.2 Å²	46.2	4%	0.041	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	78.2	-18.9	-176.5	0	0	0	0	0	116.5	N177 F199 E204 H205	N177-G201 VanDerWaalsContact CA-O 3.22Å; N177-G201 WeakPolarHBondContact CA-O 3.44Å; N177-G201 PolarHBondContact N-O 2.98Å; F199-G201 PolarHBondContact O-N 3.16Å; G201-E204 VanDerWaalsContact CA-OE1 3.23Å; G201-E204 WeakPolarHBondContact CA-OE1 3.45Å; G201-E204 PolarHBondContact N-OE1 3.46Å; G201-E204 PolarHBondContact N-OE2 3.18Å; G201-H205 PolarHBondContact O-CD2 2.98Å
202	V	89.6	Confident	85.3	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-123	-77.5	-178.4	-173.9	0	0	0	0	111	L174 F179 M197 P198 F199 A200 E204 H205 I206	L174-V202 HydrophobicContact CB-CG1 4.42Å; L174-V202 HydrophobicContact CB-CG2 4.37Å; L174-V202 HydrophobicContact CD1-CG1 4.04Å; F179-V202 HydrophobicContact CD2-CG1 3.98Å; F179-V202 HydrophobicContact CE2-CG1 3.9Å; M197-V202 HydrophobicContact CG-CB 4.39Å; M197-V202 HydrophobicContact CG-CG1 3.85Å; M197-V202 HydrophobicContact SD-CG1 3.93Å; P198-V202 HydrophobicContact CG-CB 4.41Å; P198-V202 HydrophobicContact CG-CG2 3.92Å; P198-V202 WeakPolarHBondContact O-CB 3.22Å; F199-V202 PolarHBondContact O-N 3.46Å; A200-V202 VanDerWaalsContact C-N 3.28Å; A200-V202 PolarHBondContact O-N 3.43Å; V202-E204 PolarHBondContact O-N 3.02Å; V202-H205 PolarHBondContact O-N 3.03Å; V202-H205 VanDerWaalsContact O-N 3.15Å; V202-I206 HydrophobicContact CG1-CD1 4.48Å
203	L	88.3	Confident	84.9	Confident	2 Å²	2	46.4 Å²	46.4	1%	0.01	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	-64.1	-26.3	-174.1	-55	167.5	0	0	0	113.3	M197 P198 F199 H205 I206 L228 W231	M197-L203 HydrophobicContact CG-CD2 3.92Å; M197-L203 HydrophobicContact CG-CG 4.11Å; M197-L203 HydrophobicContact SD-CD2 3.39Å; M197-L203 WeakPolarHBondContact SD-CD2 3.19Å; M197-L203 HydrophobicContact SD-CG 4.22Å; P198-L203 PolarHBondContact O-N 3.43Å; F199-L203 HydrophobicContact CB-CD1 4.47Å; F199-L203 HydrophobicContact CD2-CB 3.95Å; F199-L203 HydrophobicContact CG-CB 4.47Å; F199-L203 PolarHBondContact O-N 2.95Å; L203-H205 PolarHBondContact O-N 2.81Å; L203-H205 VanDerWaalsContact O-N 3.15Å; L203-I206 HydrophobicContact CD2-CD1 4.18Å; L203-I206 PolarHBondContact O-N 3.03Å; L203-L228 HydrophobicContact CD1-CB 4.19Å; L203-L228 HydrophobicContact CD1-CD1 3.95Å; L203-L228 HydrophobicContact CD2-CD1 4.07Å; L203-W231 HydrophobicContact CB-CB 4.43Å; L203-W231 HydrophobicContact CB-CD2 4.19Å; L203-W231 HydrophobicContact CB-CG 3.93Å; L203-W231 HydrophobicContact CD1-CB 3.88Å; L203-W231 HydrophobicContact CD1-CD2 4.34Å; L203-W231 HydrophobicContact CD1-CG 4.1Å; L203-W231 HydrophobicContact CD2-CD2 3.8Å; L203-W231 HydrophobicContact CD2-CE3 3.76Å; L203-W231 HydrophobicContact CD2-CG 4.31Å; L203-W231 HydrophobicContact CD2-CH2 4.34Å; L203-W231 HydrophobicContact CD2-CZ2 4.39Å; L203-W231 HydrophobicContact CD2-CZ3 4.03Å; L203-W231 HydrophobicContact CG-CD2 4.34Å; L203-W231 HydrophobicContact CG-CG 4.34Å
204	E	88.7	Confident	84.7	Confident	89 Å²	89	40.1 Å²	40.1	42%	0.416	24%	0.239	S	C	.	.	G	3₁₀ helix	trans	-60.4	-21.5	177.3	75.9	-171	177.4	0	0	113.8	F199 A200 G201 V202	F199-E204 HydrophobicContact CD1-CB 4.06Å; F199-E204 HydrophobicContact CE1-CB 3.64Å; F199-E204 HydrophobicContact CZ-CB 4.05Å; F199-E204 PolarHBondContact O-N 2.81Å; A200-E204 WeakPolarHBondContact CA-OE2 3.37Å; G201-E204 VanDerWaalsContact CA-OE1 3.23Å; G201-E204 WeakPolarHBondContact CA-OE1 3.45Å; G201-E204 PolarHBondContact N-OE1 3.46Å; G201-E204 PolarHBondContact N-OE2 3.18Å; V202-E204 PolarHBondContact O-N 3.02Å
205	H	87.6	Confident	84.3	Confident	52 Å²	52	40.7 Å²	40.7	24%	0.241	24%	0.242	C	C	.	.	G	3₁₀ helix	trans	-95.7	-13.7	176.6	-55.3	-71.3	0	0	0	112.6	F179 G201 V202 L203 G207	F179-H205 HydrophobicContact CB-CB 4.12Å; G201-H205 PolarHBondContact O-CD2 2.98Å; V202-H205 PolarHBondContact O-N 3.03Å; V202-H205 VanDerWaalsContact O-N 3.15Å; L203-H205 PolarHBondContact O-N 2.81Å; L203-H205 VanDerWaalsContact O-N 3.15Å; H205-G207 VanDerWaalsContact C-N 3.34Å; H205-G207 PolarHBondContact O-N 3.01Å; H205-G207 VanDerWaalsContact O-N 3.13Å
206	I	84.9	Confident	84	Confident	8 Å²	8	40.3 Å²	40.3	4%	0.041	24%	0.242	C	C	.	.			trans	-90.6	69.8	-178.8	-45.8	-179.5	0	0	0	109.6	F179 L187 V202 L203 I209 W231	F179-I206 HydrophobicContact CD2-CD1 3.7Å; F179-I206 HydrophobicContact CD2-CG1 3.81Å; F179-I206 HydrophobicContact CE2-CD1 3.8Å; F179-I206 HydrophobicContact CE2-CG1 4.41Å; L187-I206 HydrophobicContact CD2-CD1 4.2Å; V202-I206 HydrophobicContact CG1-CD1 4.48Å; L203-I206 HydrophobicContact CD2-CD1 4.18Å; L203-I206 PolarHBondContact O-N 3.03Å; I206-I209 HydrophobicContact CG2-CB 3.83Å; I206-I209 HydrophobicContact CG2-CD1 3.61Å; I206-I209 HydrophobicContact CG2-CG1 4.35Å; I206-I209 HydrophobicContact CG2-CG2 3.83Å; I206-W231 HydrophobicContact CB-CZ2 3.83Å; I206-W231 HydrophobicContact CG2-CH2 4.17Å; I206-W231 HydrophobicContact CG2-CZ2 3.65Å; I206-W231 PolarHBondContact O-NE1 3.05Å
207	G	71.1	Confident	84	Confident	76 Å²	76	37.3 Å²	37.3	78%	0.784	23%	0.228	S	C	*	.			trans	-103	-21.2	-177.6	0	0	0	0	0	116	H205	H205-G207 VanDerWaalsContact C-N 3.34Å; H205-G207 PolarHBondContact O-N 3.01Å; H205-G207 VanDerWaalsContact O-N 3.13Å
208	G	74.3	Confident	83.8	Confident	57 Å²	57	38.5 Å²	38.5	59%	0.588	24%	0.235	S	C	*	.	S	Bend	trans	-111	20.4	-173.7	0	0	0	0	0	114.8
209	I	81.9	Confident	84	Confident	15 Å²	15	36.4 Å²	36.4	8%	0.077	22%	0.222	C	C	.	.			trans	-78.7	143.2	-171.8	-160.9	152.5	0	0	0	111.9	L187 I206 E211 I212 W231 V237	L187-I209 HydrophobicContact CB-CD1 3.77Å; I206-I209 HydrophobicContact CG2-CB 3.83Å; I206-I209 HydrophobicContact CG2-CD1 3.61Å; I206-I209 HydrophobicContact CG2-CG1 4.35Å; I206-I209 HydrophobicContact CG2-CG2 3.83Å; I209-E211 WeakPolarHBondContact CD1-O 3.2Å; I209-E211 VanDerWaalsContact CG1-O 3.27Å; I209-E211 WeakPolarHBondContact CG1-O 3.35Å; I209-I212 HydrophobicContact CD1-CB 3.76Å; I209-I212 HydrophobicContact CD1-CD1 4.23Å; I209-I212 HydrophobicContact CD1-CG1 4.16Å; I209-I212 HydrophobicContact CG1-CB 4.38Å; I209-W231 HydrophobicContact CG2-CZ2 4.36Å; I209-V237 HydrophobicContact CG2-CG2 4.5Å; I209-V237 VanDerWaalsContact O-CG2 3.28Å; I209-V237 WeakPolarHBondContact O-CG2 3.46Å
210	M	76	Confident	84.1	Confident	116 Å²	116	34 Å²	34	57%	0.571	21%	0.213	S	C	*	.	S	Bend	trans	-108.1	-24.8	176.8	-54.7	-163	-51.4	0	0	112.3	T185 H186 V237	T185-M210 WeakPolarHBondContact O-CA 3.34Å; T185-M210 WeakPolarHBondContact O-CB 3.21Å; T185-M210 PolarHBondContact O-N 3.08Å; H186-M210 VanDerWaalsContact CE1-CE 3.44Å; H186-M210 WeakPolarHBondContact CE1-CE 3.49Å; M210-V237 WeakPolarHBondContact O-CG1 3.43Å
211	E	71.9	Confident	84.2	Confident	9 Å²	9	30.7 Å²	30.7	4%	0.042	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	132.1	176.3	-178.5	162.9	-159.1	0	0	111	T185 H186 L187 I209 Q213 R502	T185-E211 PolarHBondContact O-N 2.97Å; H186-E211 WeakPolarHBondContact CA-O 3.32Å; H186-E211 IonicContact CD2-OE2 3.65Å; L187-E211 PolarHBondContact N-O 3.13Å; L187-E211 VanDerWaalsContact N-O 3.12Å; I209-E211 WeakPolarHBondContact CD1-O 3.2Å; I209-E211 VanDerWaalsContact CG1-O 3.27Å; I209-E211 WeakPolarHBondContact CG1-O 3.35Å; E211-Q213 HydrophobicContact CG-CG 4.24Å; E211-Q213 PolarHBondContact OE1-NE2 3.16Å; E211-R502 IonicContact OE1-CZ 2.79Å; E211-R502 IonicContact OE1-NE 2.87Å; E211-R502 PolarHBondContact OE1-NE 2.92Å; E211-R502 IonicContact OE1-NH2 2.82Å; E211-R502 IonicContact OE2-CZ 2.67Å; E211-R502 VanDerWaalsContact OE2-CZ 3.23Å; E211-R502 IonicContact OE2-NE 3.45Å; E211-R502 PolarHBondContact OE2-NE 2.95Å; E211-R502 IonicContact OE2-NH2 3.23Å; E211-R502 PolarHBondContact OE2-NH2 3.08Å
212	I	85.8	Confident	84.4	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	126.1	172.5	-169	174.2	0	0	0	110.6	L187 I209 L214 W231 I235 V237 V239	L187-I212 HydrophobicContact CB-CG1 4.27Å; L187-I212 HydrophobicContact CD2-CD1 4.1Å; L187-I212 HydrophobicContact CD2-CG1 4.41Å; L187-I212 HydrophobicContact CG-CG1 4.45Å; L187-I212 WeakPolarHBondContact O-CA 3.24Å; I209-I212 HydrophobicContact CD1-CB 3.76Å; I209-I212 HydrophobicContact CD1-CD1 4.23Å; I209-I212 HydrophobicContact CD1-CG1 4.16Å; I209-I212 HydrophobicContact CG1-CB 4.38Å; I212-L214 HydrophobicContact CD1-CD1 3.86Å; I212-L214 HydrophobicContact CD1-CD2 4.49Å; I212-L214 HydrophobicContact CD1-CG 4.22Å; I212-L214 HydrophobicContact CG1-CD1 4.1Å; I212-L214 HydrophobicContact CG1-CG 4.04Å; I212-W231 HydrophobicContact CD1-CH2 3.63Å; I212-W231 HydrophobicContact CD1-CZ3 4.03Å; I212-W231 HydrophobicContact CG2-CH2 4.1Å; I212-W231 HydrophobicContact CG2-CZ3 4.38Å; I212-I235 HydrophobicContact CG2-CD1 4.24Å; I212-V237 HydrophobicContact CG2-CG1 4.33Å; I212-V239 HydrophobicContact CG2-CG1 4.36Å; I212-V239 HydrophobicContact CG2-CG2 3.65Å
213	Q	83.9	Confident	84.3	Confident	20 Å²	20	35 Å²	35	9%	0.093	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	125.4	-177.4	-59.5	178.3	-3.6	0	0	109.3	L187 D188 L189 R190 E211 E215	L187-Q213 PolarHBondContact O-N 3.06Å; D188-Q213 HydrophobicContact CB-CB 4.45Å; D188-Q213 VanDerWaalsContact CG-OE1 3.27Å; D188-Q213 PolarHBondContact OD2-OE1 3.29Å; L189-Q213 PolarHBondContact N-O 3.12Å; R190-Q213 HydrophobicContact CG-CB 3.81Å; R190-Q213 VanDerWaalsContact CZ-OE1 3.24Å; E211-Q213 HydrophobicContact CG-CG 4.24Å; E211-Q213 PolarHBondContact OE1-NE2 3.16Å; Q213-E215 VanDerWaalsContact CA-OE2 3.31Å; Q213-E215 WeakPolarHBondContact CA-OE2 3.35Å
214	L	89.1	Confident	84.2	Confident	0 Å²	0	39 Å²	39	0%	0	24%	0.235	C	C	.	.			trans	-141	9.4	-166	-71.8	172.6	0	0	0	112.9	L189 M197 I212 W219 V239 I242	L189-L214 HydrophobicContact CB-CD2 4.14Å; L189-L214 HydrophobicContact CD1-CD2 4.03Å; M197-L214 HydrophobicContact CE-CD2 3.72Å; I212-L214 HydrophobicContact CD1-CD1 3.86Å; I212-L214 HydrophobicContact CD1-CD2 4.49Å; I212-L214 HydrophobicContact CD1-CG 4.22Å; I212-L214 HydrophobicContact CG1-CD1 4.1Å; I212-L214 HydrophobicContact CG1-CG 4.04Å; L214-W219 HydrophobicContact CB-CZ2 4.06Å; L214-W219 HydrophobicContact CD2-CH2 4.18Å; L214-W219 HydrophobicContact CD2-CZ2 3.98Å; L214-W219 HydrophobicContact CG-CZ2 4.49Å; L214-W219 PolarHBondContact O-NE1 3.22Å; L214-V239 HydrophobicContact CB-CG1 4.47Å; L214-V239 HydrophobicContact CD1-CG1 4.33Å; L214-I242 HydrophobicContact CB-CD1 3.82Å; L214-I242 HydrophobicContact CB-CG1 3.8Å; L214-I242 HydrophobicContact CD1-CD1 3.71Å; L214-I242 HydrophobicContact CG-CD1 4.43Å
215	E	84	Confident	84.2	Confident	13 Å²	13	34.8 Å²	34.8	6%	0.061	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.1	167.3	176.4	-56.2	94.7	121.4	0	0	112.2	R190 G191 Q213 N217 G240	R190-E215 WeakPolarHBondContact CA-O 3.49Å; R190-E215 HydrophobicContact CG-CB 4.08Å; G191-E215 PolarHBondContact N-O 2.84Å; Q213-E215 VanDerWaalsContact CA-OE2 3.31Å; Q213-E215 WeakPolarHBondContact CA-OE2 3.35Å; E215-N217 PolarHBondContact O-N 2.69Å; E215-N217 PolarHBondContact O-ND2 3.06Å; E215-G240 WeakPolarHBondContact OE1-CA 3.42Å
216	E	83.1	Confident	84.3	Confident	104 Å²	104	33.5 Å²	33.5	49%	0.486	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	56	21.4	173.4	-56.4	-171.5	-173.5	0	0	115.5
217	N	88.6	Confident	84.4	Confident	8 Å²	8	35.3 Å²	35.3	4%	0.043	22%	0.222	C	C	.	.			trans	-104.4	142.7	175.5	-84.2	-96.9	0	0	0	111.3	L189 N192 R193 L194 E215 W219	L189-N217 PolarHBondContact O-ND2 3.48Å; N192-N217 WeakPolarHBondContact CA-OD1 3.36Å; N192-N217 WeakPolarHBondContact CB-OD1 3.42Å; N192-N217 PolarHBondContact O-OD1 2.96Å; R193-N217 PolarHBondContact N-OD1 2.85Å; L194-N217 HydrophobicContact CB-CB 4.32Å; L194-N217 WeakPolarHBondContact CB-OD1 3.31Å; L194-N217 VanDerWaalsContact CG-OD1 3.28Å; L194-N217 WeakPolarHBondContact CG-OD1 3.27Å; L194-N217 PolarHBondContact N-OD1 3.09Å; E215-N217 PolarHBondContact O-N 2.69Å; E215-N217 PolarHBondContact O-ND2 3.06Å; N217-W219 VanDerWaalsContact C-N 3.3Å; N217-W219 HydrophobicContact CB-CD2 4.35Å; N217-W219 HydrophobicContact CB-CZ2 3.81Å; N217-W219 PolarHBondContact O-N 3.22Å
218	P	87.3	Confident	85.3	Confident	27 Å²	27	31.7 Å²	31.7	18%	0.175	19%	0.185	C	C	.	.			trans	-80.7	65.4	-174	34.3	-38.2	0	0	0	113.1	N192 L194 K195 N220 E245	N192-P218 VanDerWaalsContact O-CD 3.31Å; N192-P218 WeakPolarHBondContact O-CD 3.46Å; L194-P218 CarbonylContact O-C 3.43Å; L194-P218 WeakPolarHBondContact O-CD 3.47Å; K195-P218 HydrophobicContact CG-CG 4.37Å; P218-N220 PolarHBondContact O-N 3.5Å; P218-E245 HydrophobicContact CB-CB 4.08Å; P218-E245 HydrophobicContact CB-CG 3.99Å
219	W	91.4	Very high	86	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.4	132.3	-171.9	-62.1	104.5	0	0	0	113.7	L194 M197 L214 N217 L225 L228 I242 E245 T246	L194-W219 HydrophobicContact CB-CH2 3.74Å; L194-W219 HydrophobicContact CB-CZ2 4.24Å; L194-W219 HydrophobicContact CB-CZ3 4.01Å; L194-W219 HydrophobicContact CD1-CH2 4.05Å; L194-W219 HydrophobicContact CD1-CZ2 4.48Å; M197-W219 HydrophobicContact CB-CZ3 4.38Å; M197-W219 HydrophobicContact CE-CH2 4.24Å; L214-W219 HydrophobicContact CB-CZ2 4.06Å; L214-W219 HydrophobicContact CD2-CH2 4.18Å; L214-W219 HydrophobicContact CD2-CZ2 3.98Å; L214-W219 HydrophobicContact CG-CZ2 4.49Å; L214-W219 PolarHBondContact O-NE1 3.22Å; N217-W219 VanDerWaalsContact C-N 3.3Å; N217-W219 HydrophobicContact CB-CD2 4.35Å; N217-W219 HydrophobicContact CB-CZ2 3.81Å; N217-W219 PolarHBondContact O-N 3.22Å; W219-L225 HydrophobicContact CB-CD2 4.23Å; W219-L225 HydrophobicContact CE3-CD1 3.75Å; W219-L225 HydrophobicContact CZ3-CD1 4.29Å; W219-L228 HydrophobicContact CE3-CD2 4.1Å; W219-L228 HydrophobicContact CH2-CD2 4.11Å; W219-L228 HydrophobicContact CZ3-CD2 3.81Å; W219-I242 HydrophobicContact CD2-CG2 4.01Å; W219-I242 HydrophobicContact CG-CG2 3.8Å; W219-E245 PolarHBondContact O-N 3.3Å; W219-T246 PolarHBondContact O-N 3.41Å; W219-T246 VanDerWaalsContact O-N 3.1Å
220	N	88.8	Confident	86.2	Confident	44 Å²	44	31.6 Å²	31.6	24%	0.235	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	89.9	177.1	174.5	43.3	0	0	0	110.8	K195 P218 T222 T246	K195-N220 HydrophobicContact CB-CB 4.21Å; K195-N220 PolarHBondContact O-N 3.42Å; P218-N220 PolarHBondContact O-N 3.5Å; N220-T222 PolarHBondContact ND2-OG1 3.34Å; N220-T222 PolarHBondContact O-N 2.88Å; N220-T222 PolarHBondContact O-OG1 3.23Å; N220-T222 WeakPolarHBondContact OD1-CG2 3.48Å; N220-T246 CarbonylContact C-O 3.07Å; N220-T246 WeakPolarHBondContact CA-O 3.26Å; N220-T246 WeakPolarHBondContact CA-OG1 3.25Å; N220-T246 WeakPolarHBondContact CB-OG1 3.48Å; N220-T246 PolarHBondContact OD1-OG1 2.98Å
221	C	88.1	Confident	86.8	Confident	1 Å²	1	26.6 Å²	26.6	1%	0.007	15%	0.152	C	C	.	.			trans	-72.3	64.5	-177.9	-63.7	0	0	0	0	113.3	L225 C244 T246 P247 L250 V255 L258 L263	C221-L225 HydrophobicContact CB-CD2 4.19Å; C221-L225 WeakPolarHBondContact SG-CD2 3.37Å; C221-C244 HydrophobicContact CB-CB 3.82Å; C221-C244 WeakPolarHBondContact CB-SG 3.44Å; C221-C244 WeakPolarHBondContact SG-CA 3.11Å; C221-C244 WeakPolarHBondContact SG-CB 3.41Å; C221-C244 CovalentContact SG-SG 2.01Å; C221-C244 PolarHBondContact SG-SG 3.17Å; C221-T246 WeakPolarHBondContact CB-O 3.09Å; C221-T246 PolarHBondContact N-O 3.36Å; C221-P247 VanDerWaalsContact O-CD 3.28Å; C221-P247 WeakPolarHBondContact O-CD 3.22Å; C221-L250 HydrophobicContact CB-CB 4.32Å; C221-L250 HydrophobicContact CB-CD1 3.97Å; C221-L250 VanDerWaalsContact O-CD1 3.3Å; C221-L250 WeakPolarHBondContact O-CD1 3.31Å; C221-V255 WeakPolarHBondContact SG-CG2 3.21Å; C221-L258 HydrophobicContact CB-CD1 4.21Å; C221-L263 HydrophobicContact CB-CD2 3.62Å
222	T	88.1	Confident	87.5	Confident	37 Å²	37	26.8 Å²	26.8	23%	0.227	15%	0.153	C	C	.	.	S	Bend	trans	-107	-174.6	171.1	47.1	0	0	0	0	110	N220 D224 L225 L263	N220-T222 PolarHBondContact ND2-OG1 3.34Å; N220-T222 PolarHBondContact O-N 2.88Å; N220-T222 PolarHBondContact O-OG1 3.23Å; N220-T222 WeakPolarHBondContact OD1-CG2 3.48Å; T222-D224 PolarHBondContact O-N 2.81Å; T222-D224 PolarHBondContact OG1-OD2 3.09Å; T222-L225 PolarHBondContact O-N 3.3Å; T222-L225 VanDerWaalsContact O-N 3.12Å; T222-L263 CarbonylContact C-O 3.59Å
223	C	86.9	Confident	87.4	Confident	57 Å²	57	31.6 Å²	31.6	39%	0.385	18%	0.179	S	C	.	.	G	3₁₀ helix	trans	-52	-27	172.3	-64.8	0	0	0	0	112.7	L225 L226 L263 C264	C223-L225 VanDerWaalsContact C-N 3.32Å; C223-L225 PolarHBondContact O-N 3.48Å; C223-L226 WeakPolarHBondContact O-CB 3.47Å; C223-L226 PolarHBondContact O-N 3.16Å; C223-L263 PolarHBondContact N-O 3.45Å; C223-C264 HydrophobicContact CB-CB 3.85Å; C223-C264 WeakPolarHBondContact CB-SG 3.41Å; C223-C264 WeakPolarHBondContact SG-CA 3.2Å; C223-C264 WeakPolarHBondContact SG-CB 3.16Å; C223-C264 CovalentContact SG-SG 2.05Å; C223-C264 PolarHBondContact SG-SG 3.01Å
224	D	86.3	Confident	87.3	Confident	86 Å²	86	35.7 Å²	35.7	46%	0.46	21%	0.206	S	C	.	.	G	3₁₀ helix	trans	-74.9	-19	-175.3	-47.9	-77.9	0	0	0	113.3	M196 T222 P227	M196-D224 HydrophobicContact CE-CB 3.92Å; M196-D224 HydrophobicContact SD-CB 4.16Å; T222-D224 PolarHBondContact O-N 2.81Å; T222-D224 PolarHBondContact OG1-OD2 3.09Å; D224-P227 WeakPolarHBondContact O-CD 3.06Å
225	L	89.9	Confident	86.7	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	22%	0.215	C	C	.	.	G	3₁₀ helix	trans	-89.5	-9.5	174.5	-159	66.9	0	0	0	113.2	M196 W219 C221 T222 C223 P227 L228 K229 V255 L263	M196-L225 HydrophobicContact CB-CD1 4.07Å; W219-L225 HydrophobicContact CB-CD2 4.23Å; W219-L225 HydrophobicContact CE3-CD1 3.75Å; W219-L225 HydrophobicContact CZ3-CD1 4.29Å; C221-L225 HydrophobicContact CB-CD2 4.19Å; C221-L225 WeakPolarHBondContact SG-CD2 3.37Å; T222-L225 PolarHBondContact O-N 3.3Å; T222-L225 VanDerWaalsContact O-N 3.12Å; C223-L225 VanDerWaalsContact C-N 3.32Å; C223-L225 PolarHBondContact O-N 3.48Å; L225-P227 VanDerWaalsContact C-N 3.31Å; L225-L228 HydrophobicContact CD1-CB 4.21Å; L225-L228 HydrophobicContact CD1-CD2 3.81Å; L225-L228 HydrophobicContact CG-CB 4.48Å; L225-L228 HydrophobicContact CG-CD2 4.43Å; L225-L228 PolarHBondContact O-N 3.47Å; L225-L228 VanDerWaalsContact O-N 3.1Å; L225-K229 PolarHBondContact O-N 3.25Å; L225-K229 VanDerWaalsContact O-N 3.08Å; L225-V255 HydrophobicContact CD2-CG1 4.29Å; L225-V255 HydrophobicContact CD2-CG2 3.62Å; L225-L263 HydrophobicContact CB-CD2 4.5Å
226	L	88.1	Confident	85.5	Confident	26 Å²	26	44 Å²	44	14%	0.136	26%	0.256	C	S	.	.	H	α-helix	trans	-54.6	-33.8	177.3	-174.1	63.5	0	0	0	114.9	C223 K229 A230 R260 L263	C223-L226 WeakPolarHBondContact O-CB 3.47Å; C223-L226 PolarHBondContact O-N 3.16Å; L226-K229 PolarHBondContact O-N 2.92Å; L226-A230 WeakPolarHBondContact O-CB 3.48Å; L226-A230 PolarHBondContact O-N 2.79Å; L226-R260 HydrophobicContact CD1-CB 3.98Å; L226-R260 HydrophobicContact CD1-CG 3.81Å; L226-R260 HydrophobicContact CD2-CG 3.93Å; L226-R260 VanDerWaalsContact CD2-CZ 3.49Å; L226-L263 HydrophobicContact CD1-CD1 4.25Å
227	P	88.9	Confident	84.5	Confident	45 Å²	45	40.5 Å²	40.5	29%	0.292	24%	0.241	S	C	.	.	H	α-helix	trans	-66.9	-37.4	175.7	-17.4	31.7	0	0	0	112.7	F199 D224 L225 W231	F199-P227 HydrophobicContact CB-CB 3.62Å; D224-P227 WeakPolarHBondContact O-CD 3.06Å; L225-P227 VanDerWaalsContact C-N 3.31Å; P227-W231 PolarHBondContact O-N 3.38Å; P227-W231 VanDerWaalsContact O-N 3.15Å
228	L	89.8	Confident	82.7	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-64.7	-48.9	172.5	177.4	62.5	0	0	0	110.4	M197 L203 W219 L225 A230 W231 L232	M197-L228 HydrophobicContact CB-CD1 4.28Å; M197-L228 HydrophobicContact CB-CD2 4.31Å; L203-L228 HydrophobicContact CD1-CB 4.19Å; L203-L228 HydrophobicContact CD1-CD1 3.95Å; L203-L228 HydrophobicContact CD2-CD1 4.07Å; W219-L228 HydrophobicContact CE3-CD2 4.1Å; W219-L228 HydrophobicContact CH2-CD2 4.11Å; W219-L228 HydrophobicContact CZ3-CD2 3.81Å; L225-L228 HydrophobicContact CD1-CB 4.21Å; L225-L228 HydrophobicContact CD1-CD2 3.81Å; L225-L228 HydrophobicContact CG-CB 4.48Å; L225-L228 HydrophobicContact CG-CD2 4.43Å; L225-L228 PolarHBondContact O-N 3.47Å; L225-L228 VanDerWaalsContact O-N 3.1Å; L228-A230 VanDerWaalsContact C-N 3.33Å; L228-A230 PolarHBondContact O-N 2.8Å; L228-W231 HydrophobicContact CD1-CE3 4.02Å; L228-W231 HydrophobicContact CD1-CZ3 4.42Å; L228-W231 PolarHBondContact O-N 3.28Å; L228-W231 VanDerWaalsContact O-N 3.07Å; L228-L232 HydrophobicContact CD1-CD1 4.25Å; L228-L232 HydrophobicContact CD1-CD2 4.39Å; L228-L232 HydrophobicContact CD1-CG 4.08Å; L228-L232 HydrophobicContact CG-CD1 3.9Å; L228-L232 HydrophobicContact CG-CG 4.21Å; L228-L232 VanDerWaalsContact O-CG 3.3Å; L228-L232 WeakPolarHBondContact O-CG 3.18Å; L228-L232 PolarHBondContact O-N 2.67Å
229	K	88.1	Confident	81.4	Confident	17 Å²	17	42 Å²	42	7%	0.074	25%	0.246	C	C	.	.	H	α-helix	trans	-55	-46.9	176	177.5	53.4	162	103.7	0	112.4	L225 L226 W231 L232 D233 V255 T256 L258 L263	L225-K229 PolarHBondContact O-N 3.25Å; L225-K229 VanDerWaalsContact O-N 3.08Å; L226-K229 PolarHBondContact O-N 2.92Å; K229-W231 PolarHBondContact O-N 2.82Å; K229-L232 PolarHBondContact O-N 2.89Å; K229-D233 IonicContact NZ-OD1 2.76Å; K229-D233 PolarHBondContact NZ-OD1 3.25Å; K229-D233 IonicContact NZ-OD2 2.82Å; K229-D233 PolarHBondContact NZ-OD2 3.38Å; K229-D233 VanDerWaalsContact O-CG 3.26Å; K229-D233 PolarHBondContact O-N 3.21Å; K229-V255 HydrophobicContact CB-CG1 4.16Å; K229-V255 HydrophobicContact CD-CG1 4.2Å; K229-V255 WeakPolarHBondContact CD-O 3.29Å; K229-V255 WeakPolarHBondContact CE-O 3.24Å; K229-T256 WeakPolarHBondContact CE-O 3.44Å; K229-T256 PolarHBondContact NZ-O 3Å; K229-L258 WeakPolarHBondContact CE-O 3.29Å; K229-L263 HydrophobicContact CB-CD1 3.91Å; K229-L263 HydrophobicContact CG-CD1 4.08Å
230	A	86.8	Confident	80	Confident	53 Å²	53	42 Å²	42	44%	0.438	25%	0.247	S	C	.	.	H	α-helix	trans	-64.8	-26.7	179.5	0	0	0	0	0	113.5	L226 L228 T234	L226-A230 WeakPolarHBondContact O-CB 3.48Å; L226-A230 PolarHBondContact O-N 2.79Å; L228-A230 VanDerWaalsContact C-N 3.33Å; L228-A230 PolarHBondContact O-N 2.8Å; A230-T234 WeakPolarHBondContact O-CG2 3.41Å
231	W	88.3	Confident	78.8	Confident	11 Å²	11	40.3 Å²	40.3	4%	0.042	24%	0.237	C	C	.	.	H	α-helix	trans	-81.7	-41.2	174.3	177.1	84	0	0	0	112.3	F199 L203 I206 I209 I212 P227 L228 K229 D233 T234 I235	F199-W231 HydrophobicContact CD2-CB 4.34Å; L203-W231 HydrophobicContact CB-CB 4.43Å; L203-W231 HydrophobicContact CB-CD2 4.19Å; L203-W231 HydrophobicContact CB-CG 3.93Å; L203-W231 HydrophobicContact CD1-CB 3.88Å; L203-W231 HydrophobicContact CD1-CD2 4.34Å; L203-W231 HydrophobicContact CD1-CG 4.1Å; L203-W231 HydrophobicContact CD2-CD2 3.8Å; L203-W231 HydrophobicContact CD2-CE3 3.76Å; L203-W231 HydrophobicContact CD2-CG 4.31Å; L203-W231 HydrophobicContact CD2-CH2 4.34Å; L203-W231 HydrophobicContact CD2-CZ2 4.39Å; L203-W231 HydrophobicContact CD2-CZ3 4.03Å; L203-W231 HydrophobicContact CG-CD2 4.34Å; L203-W231 HydrophobicContact CG-CG 4.34Å; I206-W231 HydrophobicContact CB-CZ2 3.83Å; I206-W231 HydrophobicContact CG2-CH2 4.17Å; I206-W231 HydrophobicContact CG2-CZ2 3.65Å; I206-W231 PolarHBondContact O-NE1 3.05Å; I209-W231 HydrophobicContact CG2-CZ2 4.36Å; I212-W231 HydrophobicContact CD1-CH2 3.63Å; I212-W231 HydrophobicContact CD1-CZ3 4.03Å; I212-W231 HydrophobicContact CG2-CH2 4.1Å; I212-W231 HydrophobicContact CG2-CZ3 4.38Å; P227-W231 PolarHBondContact O-N 3.38Å; P227-W231 VanDerWaalsContact O-N 3.15Å; L228-W231 HydrophobicContact CD1-CE3 4.02Å; L228-W231 HydrophobicContact CD1-CZ3 4.42Å; L228-W231 PolarHBondContact O-N 3.28Å; L228-W231 VanDerWaalsContact O-N 3.07Å; K229-W231 PolarHBondContact O-N 2.82Å; W231-D233 PolarHBondContact O-N 2.81Å; W231-T234 WeakPolarHBondContact CA-OG1 3.27Å; W231-T234 WeakPolarHBondContact O-CA 3.43Å; W231-T234 PolarHBondContact O-N 3.27Å; W231-T234 PolarHBondContact O-OG1 3.1Å; W231-I235 HydrophobicContact CE3-CD1 4.09Å; W231-I235 HydrophobicContact CH2-CD1 3.72Å; W231-I235 HydrophobicContact CZ2-CD1 4.26Å; W231-I235 HydrophobicContact CZ2-CG2 4.12Å; W231-I235 HydrophobicContact CZ3-CD1 3.62Å; W231-I235 PolarHBondContact O-N 3.12Å
232	L	86.6	Confident	78.5	Confident	13 Å²	13	40.2 Å²	40.2	7%	0.068	24%	0.237	C	C	.	.	H	α-helix	trans	-55.6	-37.6	171.8	-67.4	168.9	0	0	0	111.3	L228 K229 T234 I235 V239 I242 V255 T256	L228-L232 HydrophobicContact CD1-CD1 4.25Å; L228-L232 HydrophobicContact CD1-CD2 4.39Å; L228-L232 HydrophobicContact CD1-CG 4.08Å; L228-L232 HydrophobicContact CG-CD1 3.9Å; L228-L232 HydrophobicContact CG-CG 4.21Å; L228-L232 VanDerWaalsContact O-CG 3.3Å; L228-L232 WeakPolarHBondContact O-CG 3.18Å; L228-L232 PolarHBondContact O-N 2.67Å; K229-L232 PolarHBondContact O-N 2.89Å; L232-T234 PolarHBondContact O-N 2.98Å; L232-I235 HydrophobicContact CD2-CD1 4.29Å; L232-I235 WeakPolarHBondContact O-CG1 3.08Å; L232-V239 HydrophobicContact CD2-CB 4.38Å; L232-V239 HydrophobicContact CD2-CG1 4.09Å; L232-V239 HydrophobicContact CD2-CG2 3.97Å; L232-I242 HydrophobicContact CD1-CD1 3.6Å; L232-I242 HydrophobicContact CD2-CD1 3.75Å; L232-I242 HydrophobicContact CG-CD1 4.32Å; L232-V255 HydrophobicContact CD1-CG1 4Å; L232-T256 HydrophobicContact CD1-CG2 4.39Å
233	D	83.2	Confident	78.2	Confident	102 Å²	102	40 Å²	40	55%	0.545	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-8	175.6	-68.6	-17.8	0	0	0	114.4	K229 W231	K229-D233 IonicContact NZ-OD1 2.76Å; K229-D233 PolarHBondContact NZ-OD1 3.25Å; K229-D233 IonicContact NZ-OD2 2.82Å; K229-D233 PolarHBondContact NZ-OD2 3.38Å; K229-D233 VanDerWaalsContact O-CG 3.26Å; K229-D233 PolarHBondContact O-N 3.21Å; W231-D233 PolarHBondContact O-N 2.81Å
234	T	82.4	Confident	78	Confident	105 Å²	105	37.4 Å²	37.4	64%	0.644	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-106.4	-13.1	177.9	56.4	0	0	0	0	114.5	A230 W231 L232	A230-T234 WeakPolarHBondContact O-CG2 3.41Å; W231-T234 WeakPolarHBondContact CA-OG1 3.27Å; W231-T234 WeakPolarHBondContact O-CA 3.43Å; W231-T234 PolarHBondContact O-N 3.27Å; W231-T234 PolarHBondContact O-OG1 3.1Å; L232-T234 PolarHBondContact O-N 2.98Å
235	I	76.2	Confident	77.8	Confident	37 Å²	37	37.7 Å²	37.7	19%	0.19	22%	0.216	C	C	.	.			trans	-98.6	141.3	177.8	58.9	171.9	0	0	0	111	I212 W231 L232 V237 V239	I212-I235 HydrophobicContact CG2-CD1 4.24Å; W231-I235 HydrophobicContact CE3-CD1 4.09Å; W231-I235 HydrophobicContact CH2-CD1 3.72Å; W231-I235 HydrophobicContact CZ2-CD1 4.26Å; W231-I235 HydrophobicContact CZ2-CG2 4.12Å; W231-I235 HydrophobicContact CZ3-CD1 3.62Å; W231-I235 PolarHBondContact O-N 3.12Å; L232-I235 HydrophobicContact CD2-CD1 4.29Å; L232-I235 WeakPolarHBondContact O-CG1 3.08Å; I235-V237 VanDerWaalsContact C-N 3.34Å; I235-V237 HydrophobicContact CB-CB 4.47Å; I235-V237 HydrophobicContact CD1-CB 4.37Å; I235-V239 HydrophobicContact CD1-CG2 3.69Å
236	T	59.4	Low	77.1	Confident	151 Å²	151	40.4 Å²	40.4	93%	0.926	23%	0.233	S	C	*	.			trans	-96.8	9.2	173.1	57.3	0	0	0	0	112.6
237	V	60.4	Low	76.7	Confident	30 Å²	30	41.5 Å²	41.5	18%	0.182	24%	0.242	C	C	.	.	S	Bend	trans	-76	145.9	-178.8	164.3	0	0	0	0	110.1	I209 M210 I212 I235 V239	I209-V237 HydrophobicContact CG2-CG2 4.5Å; I209-V237 VanDerWaalsContact O-CG2 3.28Å; I209-V237 WeakPolarHBondContact O-CG2 3.46Å; M210-V237 WeakPolarHBondContact O-CG1 3.43Å; I212-V237 HydrophobicContact CG2-CG1 4.33Å; I235-V237 VanDerWaalsContact C-N 3.34Å; I235-V237 HydrophobicContact CB-CB 4.47Å; I235-V237 HydrophobicContact CD1-CB 4.37Å; V237-V239 PolarHBondContact O-N 2.96Å
238	F	51.2	Low	75.9	Confident	48 Å²	48	46.5 Å²	46.5	21%	0.211	26%	0.259	C	S	.	.			trans	-64.5	121.8	169.6	179.8	-98.8	0	0	0	110.1	Y455	F238-Y455 HydrophobicContact CD1-CE1 4.18Å; F238-Y455 AromaticContact CD2-CE1 3.81Å; F238-Y455 HydrophobicContact CD2-CE1 3.81Å; F238-Y455 HydrophobicContact CD2-CE2 4.15Å; F238-Y455 AromaticContact CD2-CZ 3.45Å; F238-Y455 VanDerWaalsContact CD2-CZ 3.45Å; F238-Y455 WeakPolarHBondContact CD2-OH 3.46Å; F238-Y455 HydrophobicContact CE1-CD1 4.15Å; F238-Y455 AromaticContact CE1-CE1 3.82Å; F238-Y455 HydrophobicContact CE1-CE1 3.82Å; F238-Y455 HydrophobicContact CE2-CD1 4.03Å; F238-Y455 HydrophobicContact CE2-CD2 4.08Å; F238-Y455 AromaticContact CE2-CE1 3.39Å; F238-Y455 HydrophobicContact CE2-CE1 3.39Å; F238-Y455 AromaticContact CE2-CE2 3.44Å; F238-Y455 HydrophobicContact CE2-CE2 3.44Å; F238-Y455 VanDerWaalsContact CE2-CE2 3.44Å; F238-Y455 HydrophobicContact CE2-CG 4.39Å; F238-Y455 AromaticContact CE2-CZ 3.09Å; F238-Y455 WeakPolarHBondContact CE2-OH 3.42Å; F238-Y455 HydrophobicContact CG-CE1 4.16Å; F238-Y455 AromaticContact CZ-CD1 3.65Å; F238-Y455 HydrophobicContact CZ-CD1 3.65Å; F238-Y455 HydrophobicContact CZ-CD2 4.24Å; F238-Y455 AromaticContact CZ-CE1 3.4Å; F238-Y455 HydrophobicContact CZ-CE1 3.4Å; F238-Y455 HydrophobicContact CZ-CE2 4.01Å; F238-Y455 HydrophobicContact CZ-CG 4.12Å; F238-Y455 AromaticContact CZ-CZ 3.63Å
239	V	61.3	Low	75.2	Confident	18 Å²	18	56.8 Å²	56.8	11%	0.109	30%	0.298	C	S	.	.			trans	-119.2	135.7	166	-165.9	0	0	0	0	107.1	I212 L214 L232 I235 V237 I242 R431	I212-V239 HydrophobicContact CG2-CG1 4.36Å; I212-V239 HydrophobicContact CG2-CG2 3.65Å; L214-V239 HydrophobicContact CB-CG1 4.47Å; L214-V239 HydrophobicContact CD1-CG1 4.33Å; L232-V239 HydrophobicContact CD2-CB 4.38Å; L232-V239 HydrophobicContact CD2-CG1 4.09Å; L232-V239 HydrophobicContact CD2-CG2 3.97Å; I235-V239 HydrophobicContact CD1-CG2 3.69Å; V237-V239 PolarHBondContact O-N 2.96Å; V239-I242 HydrophobicContact CG1-CD1 3.63Å; V239-I242 HydrophobicContact CG1-CG1 4.06Å; V239-R431 PolarHBondContact O-NH2 2.64Å
240	G	60.5	Low	74.7	Confident	1 Å²	1	56.6 Å²	56.6	1%	0.01	30%	0.298	C	S	.	.			trans	-69.5	-170	174.6	0	0	0	0	0	113.3	E215 I242	E215-G240 WeakPolarHBondContact OE1-CA 3.42Å; G240-I242 PolarHBondContact O-N 3.48Å
241	E	64	Low	74.2	Confident	8 Å²	8	55.5 Å²	55.5	4%	0.037	28%	0.284	C	S	.	.			trans	-74.1	95.6	-175.6	-63.7	-96.9	158.9	0	0	111.1	V243 K383 Y385 L407 R431	E241-V243 VanDerWaalsContact C-N 3.31Å; E241-V243 HydrophobicContact CB-CG2 4.03Å; E241-V243 PolarHBondContact O-N 3.29Å; E241-K383 IonicContact OE1-NZ 3.68Å; E241-K383 PolarHBondContact OE1-NZ 3Å; E241-K383 IonicContact OE2-NZ 2.76Å; E241-K383 PolarHBondContact OE2-NZ 3.32Å; E241-Y385 PolarHBondContact OE2-OH 3.26Å; E241-Y385 VanDerWaalsContact OE2-OH 3.05Å; E241-L407 HydrophobicContact CG-CD1 3.46Å; E241-L407 VanDerWaalsContact CG-CD1 3.46Å; E241-L407 WeakPolarHBondContact OE1-CD1 3.48Å; E241-R431 WeakPolarHBondContact OE1-CD 3.32Å; E241-R431 IonicContact OE1-CZ 3.79Å; E241-R431 IonicContact OE1-NE 3.43Å; E241-R431 IonicContact OE1-NH1 2.9Å; E241-R431 PolarHBondContact OE1-NH1 3.05Å
242	I	82.8	Confident	73.3	Confident	0 Å²	0	55 Å²	55	0%	0	28%	0.282	C	S	.	.			trans	-75.4	87.1	170.4	-63.6	177.1	0	0	0	107.8	L214 W219 L232 V239 G240 V255	L214-I242 HydrophobicContact CB-CD1 3.82Å; L214-I242 HydrophobicContact CB-CG1 3.8Å; L214-I242 HydrophobicContact CD1-CD1 3.71Å; L214-I242 HydrophobicContact CG-CD1 4.43Å; W219-I242 HydrophobicContact CD2-CG2 4.01Å; W219-I242 HydrophobicContact CG-CG2 3.8Å; L232-I242 HydrophobicContact CD1-CD1 3.6Å; L232-I242 HydrophobicContact CD2-CD1 3.75Å; L232-I242 HydrophobicContact CG-CD1 4.32Å; V239-I242 HydrophobicContact CG1-CD1 3.63Å; V239-I242 HydrophobicContact CG1-CG1 4.06Å; G240-I242 PolarHBondContact O-N 3.48Å; I242-V255 HydrophobicContact CB-CB 4.15Å; I242-V255 HydrophobicContact CB-CG2 4.41Å; I242-V255 HydrophobicContact CG2-CB 3.7Å; I242-V255 HydrophobicContact CG2-CG1 4.36Å; I242-V255 HydrophobicContact CG2-CG2 3.57Å; I242-V255 WeakPolarHBondContact O-CG2 3.34Å; I242-V255 PolarHBondContact O-N 3.47Å
243	V	80.8	Confident	72.3	Confident	33 Å²	33	55.3 Å²	55.3	20%	0.2	28%	0.282	C	S	.	.	B	Isolated β-bridge	trans	-85.2	129.3	-177	-179.7	0	0	0	0	111.4	E241 E245 Y385	E241-V243 VanDerWaalsContact C-N 3.31Å; E241-V243 HydrophobicContact CB-CG2 4.03Å; E241-V243 PolarHBondContact O-N 3.29Å; V243-E245 PolarHBondContact O-N 2.98Å; V243-Y385 HydrophobicContact CG2-CE1 4.15Å; V243-Y385 WeakPolarHBondContact CG2-OH 3.45Å
244	C	82.7	Confident	72.2	Confident	1 Å²	1	50.5 Å²	50.5	1%	0.007	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	125.4	169.7	-63	0	0	0	0	111.8	C221 L250 H251 G252 K253	C221-C244 HydrophobicContact CB-CB 3.82Å; C221-C244 WeakPolarHBondContact CB-SG 3.44Å; C221-C244 WeakPolarHBondContact SG-CA 3.11Å; C221-C244 WeakPolarHBondContact SG-CB 3.41Å; C221-C244 CovalentContact SG-SG 2.01Å; C221-C244 PolarHBondContact SG-SG 3.17Å; C244-L250 HydrophobicContact CB-CB 4.38Å; C244-L250 WeakPolarHBondContact CB-O 3.44Å; C244-H251 CarbonylContact O-C 3Å; C244-H251 VanDerWaalsContact O-CA 3.29Å; C244-H251 WeakPolarHBondContact O-CA 3.14Å; C244-G252 PolarHBondContact O-N 2.82Å; C244-K253 WeakPolarHBondContact CB-O 3.12Å; C244-K253 PolarHBondContact N-O 3.41Å; C244-K253 PolarHBondContact SG-O 3.3Å
245	E	83	Confident	72.3	Confident	93 Å²	93	45.5 Å²	45.5	44%	0.435	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	-44.5	167.5	176.7	61.8	-162.7	0	0	110.3	P218 W219 V243 H251	P218-E245 HydrophobicContact CB-CB 4.08Å; P218-E245 HydrophobicContact CB-CG 3.99Å; W219-E245 PolarHBondContact O-N 3.3Å; V243-E245 PolarHBondContact O-N 2.98Å; E245-H251 PolarHBondContact O-CD2 2.85Å
246	T	75.4	Confident	72.4	Confident	57 Å²	57	46.4 Å²	46.4	35%	0.35	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	157	-179.5	43.5	0	0	0	0	111.4	W219 N220 C221	W219-T246 PolarHBondContact O-N 3.41Å; W219-T246 VanDerWaalsContact O-N 3.1Å; N220-T246 CarbonylContact C-O 3.07Å; N220-T246 WeakPolarHBondContact CA-O 3.26Å; N220-T246 WeakPolarHBondContact CA-OG1 3.25Å; N220-T246 WeakPolarHBondContact CB-OG1 3.48Å; N220-T246 PolarHBondContact OD1-OG1 2.98Å; C221-T246 WeakPolarHBondContact CB-O 3.09Å; C221-T246 PolarHBondContact N-O 3.36Å
247	P	79	Confident	73.3	Confident	49 Å²	49	41.3 Å²	41.3	32%	0.318	20%	0.199	S	C	.	.	S	Bend	cis	-74.2	162.1	-13	33.8	-36	0	0	0	111.8	C221 R249 L250 H251	C221-P247 VanDerWaalsContact O-CD 3.28Å; C221-P247 WeakPolarHBondContact O-CD 3.22Å; P247-R249 PolarHBondContact O-N 3.31Å; P247-L250 PolarHBondContact O-N 3.47Å; P247-H251 PolarHBondContact O-N 3.36Å
248	F	71.6	Confident	74.2	Confident	149 Å²	149	40.3 Å²	40.3	65%	0.654	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	-46.6	-30.3	-177.6	-176.3	-94.8	0	0	0	115.9	L250 H251 I349	F248-L250 PolarHBondContact O-N 2.98Å; F248-H251 PolarHBondContact O-N 3.02Å; F248-I349 HydrophobicContact CD2-CD1 4.33Å; F248-I349 HydrophobicContact CE2-CD1 3.61Å; F248-I349 HydrophobicContact CE2-CG1 4.17Å; F248-I349 HydrophobicContact CZ-CD1 4.19Å; F248-I349 HydrophobicContact CZ-CG1 4.27Å
249	R	76.2	Confident	75.6	Confident	216 Å²	216	41 Å²	41	82%	0.815	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-22	176.3	-69.4	-178.5	177.4	151.9	-0.1	114.6	P247	P247-R249 PolarHBondContact O-N 3.31Å
250	L	77	Confident	76.6	Confident	13 Å²	13	48.1 Å²	48.1	7%	0.068	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-119	-2.5	-178.4	-57	177.1	0	0	0	111.9	C221 C244 P247 F248 G252 K253 L258 D262	C221-L250 HydrophobicContact CB-CB 4.32Å; C221-L250 HydrophobicContact CB-CD1 3.97Å; C221-L250 VanDerWaalsContact O-CD1 3.3Å; C221-L250 WeakPolarHBondContact O-CD1 3.31Å; C244-L250 HydrophobicContact CB-CB 4.38Å; C244-L250 WeakPolarHBondContact CB-O 3.44Å; P247-L250 PolarHBondContact O-N 3.47Å; F248-L250 PolarHBondContact O-N 2.98Å; L250-G252 PolarHBondContact O-N 3.5Å; L250-K253 HydrophobicContact CB-CD 4.44Å; L250-K253 HydrophobicContact CD2-CD 3.84Å; L250-K253 WeakPolarHBondContact O-CB 3.31Å; L250-K253 WeakPolarHBondContact O-CG 3.05Å; L250-K253 PolarHBondContact O-N 3.36Å; L250-L258 HydrophobicContact CD1-CD1 4.24Å; L250-L258 HydrophobicContact CD2-CD2 4.11Å; L250-D262 HydrophobicContact CD2-CB 4.36Å
251	H	76.4	Confident	77.6	Confident	31 Å²	31	54.6 Å²	54.6	14%	0.144	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-48.6	132.6	176.2	-179.3	-61.8	0	0	0	111.4	C244 E245 P247 F248 K253 N362	C244-H251 CarbonylContact O-C 3Å; C244-H251 VanDerWaalsContact O-CA 3.29Å; C244-H251 WeakPolarHBondContact O-CA 3.14Å; E245-H251 PolarHBondContact O-CD2 2.85Å; P247-H251 PolarHBondContact O-N 3.36Å; F248-H251 PolarHBondContact O-N 3.02Å; H251-K253 VanDerWaalsContact C-N 3.26Å; H251-K253 PolarHBondContact O-N 3.22Å; H251-N362 PolarHBondContact CE1-ND2 2.76Å
252	G	68.4	Low	78.4	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	79.5	-9	-176.3	0	0	0	0	0	115.3	C244 L250 N360	C244-G252 PolarHBondContact O-N 2.82Å; L250-G252 PolarHBondContact O-N 3.5Å; G252-N360 PolarHBondContact O-ND2 3.03Å
253	K	67.5	Low	78.4	Confident	19 Å²	19	57.5 Å²	57.5	8%	0.083	27%	0.271	C	S	.	.			trans	-78.4	140.5	177.3	-64.6	-171.7	177.6	-171.2	0	111.7	C244 L250 H251 L258 T351	C244-K253 WeakPolarHBondContact CB-O 3.12Å; C244-K253 PolarHBondContact N-O 3.41Å; C244-K253 PolarHBondContact SG-O 3.3Å; L250-K253 HydrophobicContact CB-CD 4.44Å; L250-K253 HydrophobicContact CD2-CD 3.84Å; L250-K253 WeakPolarHBondContact O-CB 3.31Å; L250-K253 WeakPolarHBondContact O-CG 3.05Å; L250-K253 PolarHBondContact O-N 3.36Å; H251-K253 VanDerWaalsContact C-N 3.26Å; H251-K253 PolarHBondContact O-N 3.22Å; K253-L258 HydrophobicContact CB-CD2 4.02Å; K253-L258 HydrophobicContact CD-CD2 3.57Å; K253-L258 HydrophobicContact CG-CD2 4.45Å; K253-T351 VanDerWaalsContact CE-CB 3.4Å; K253-T351 WeakPolarHBondContact CE-OG1 3.46Å; K253-T351 HydrophobicContact CG-CG2 4.49Å; K253-T351 WeakPolarHBondContact CG-OG1 3.46Å
254	D	79.8	Confident	78.6	Confident	2 Å²	2	57.7 Å²	57.7	1%	0.011	27%	0.274	C	S	.	.	B	Isolated β-bridge	trans	-73.4	124.4	170.4	174.2	-11.4	0	0	0	109.9	T256 Q257 K383	D254-T256 VanDerWaalsContact C-N 3.27Å; D254-T256 PolarHBondContact O-N 3.34Å; D254-T256 WeakPolarHBondContact OD1-CB 3.46Å; D254-T256 PolarHBondContact OD1-N 3.07Å; D254-T256 PolarHBondContact OD1-OG1 2.94Å; D254-T256 PolarHBondContact OD2-OG1 3Å; D254-Q257 HydrophobicContact CB-CB 4.36Å; D254-Q257 HydrophobicContact CB-CG 4Å; D254-Q257 PolarHBondContact O-N 3.17Å; D254-Q257 VanDerWaalsContact O-N 3.07Å; D254-Q257 PolarHBondContact OD2-NE2 3.03Å; D254-K383 IonicContact OD2-NZ 2.99Å; D254-K383 PolarHBondContact OD2-NZ 3.19Å
255	V	84.4	Confident	78.4	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	30%	0.302	C	S	.	.	G	3₁₀ helix	trans	-57.9	-38	-178.5	168.3	0	0	0	0	111.9	C221 L225 K229 L232 I242 Q257 L258	C221-V255 WeakPolarHBondContact SG-CG2 3.21Å; L225-V255 HydrophobicContact CD2-CG1 4.29Å; L225-V255 HydrophobicContact CD2-CG2 3.62Å; K229-V255 HydrophobicContact CB-CG1 4.16Å; K229-V255 HydrophobicContact CD-CG1 4.2Å; K229-V255 WeakPolarHBondContact CD-O 3.29Å; K229-V255 WeakPolarHBondContact CE-O 3.24Å; L232-V255 HydrophobicContact CD1-CG1 4Å; I242-V255 HydrophobicContact CB-CB 4.15Å; I242-V255 HydrophobicContact CB-CG2 4.41Å; I242-V255 HydrophobicContact CG2-CB 3.7Å; I242-V255 HydrophobicContact CG2-CG1 4.36Å; I242-V255 HydrophobicContact CG2-CG2 3.57Å; I242-V255 WeakPolarHBondContact O-CG2 3.34Å; I242-V255 PolarHBondContact O-N 3.47Å; V255-Q257 PolarHBondContact O-N 3.03Å; V255-Q257 VanDerWaalsContact O-N 3.15Å; V255-L258 PolarHBondContact O-N 2.97Å; V255-L258 VanDerWaalsContact O-N 3.15Å
256	T	79.6	Confident	77.7	Confident	55 Å²	55	69.2 Å²	69.2	34%	0.337	33%	0.325	S	S	.	.	G	3₁₀ helix	trans	-61.4	-25.6	179.8	68.6	0	0	0	0	112.1	K229 L232 D254	K229-T256 WeakPolarHBondContact CE-O 3.44Å; K229-T256 PolarHBondContact NZ-O 3Å; L232-T256 HydrophobicContact CD1-CG2 4.39Å; D254-T256 VanDerWaalsContact C-N 3.27Å; D254-T256 PolarHBondContact O-N 3.34Å; D254-T256 WeakPolarHBondContact OD1-CB 3.46Å; D254-T256 PolarHBondContact OD1-N 3.07Å; D254-T256 PolarHBondContact OD1-OG1 2.94Å; D254-T256 PolarHBondContact OD2-OG1 3Å
257	Q	77.9	Confident	76.6	Confident	45 Å²	45	76.2 Å²	76.2	21%	0.21	35%	0.351	C	S	.	.	G	3₁₀ helix	trans	-94.4	-2.9	-176.4	-55.3	-178.5	-13.5	0	0	113.4	D254 V255 K383	D254-Q257 HydrophobicContact CB-CB 4.36Å; D254-Q257 HydrophobicContact CB-CG 4Å; D254-Q257 PolarHBondContact O-N 3.17Å; D254-Q257 VanDerWaalsContact O-N 3.07Å; D254-Q257 PolarHBondContact OD2-NE2 3.03Å; V255-Q257 PolarHBondContact O-N 3.03Å; V255-Q257 VanDerWaalsContact O-N 3.15Å; Q257-K383 VanDerWaalsContact NE2-CE 3.33Å; Q257-K383 VanDerWaalsContact OE1-CE 3.31Å
258	L	78.9	Confident	74.8	Confident	8 Å²	8	78.2 Å²	78.2	4%	0.042	37%	0.366	C	S	.	.			trans	-84.5	144.3	177.3	-65.7	-178.1	0	0	0	112.8	C221 K229 L250 K253 V255 D262 L263	C221-L258 HydrophobicContact CB-CD1 4.21Å; K229-L258 WeakPolarHBondContact CE-O 3.29Å; L250-L258 HydrophobicContact CD1-CD1 4.24Å; L250-L258 HydrophobicContact CD2-CD2 4.11Å; K253-L258 HydrophobicContact CB-CD2 4.02Å; K253-L258 HydrophobicContact CD-CD2 3.57Å; K253-L258 HydrophobicContact CG-CD2 4.45Å; V255-L258 PolarHBondContact O-N 2.97Å; V255-L258 VanDerWaalsContact O-N 3.15Å; L258-D262 HydrophobicContact CB-CB 4.43Å; L258-D262 HydrophobicContact CD2-CB 4.13Å; L258-L263 HydrophobicContact CB-CD1 4.48Å; L258-L263 HydrophobicContact CB-CG 4.22Å; L258-L263 HydrophobicContact CD1-CD2 3.6Å; L258-L263 HydrophobicContact CD1-CG 3.96Å
259	T	81.2	Confident	73.4	Confident	63 Å²	63	77 Å²	77	39%	0.387	38%	0.376	S	S	.	.			trans	-84.2	162.7	168	75.5	0	0	0	0	111.3	Q261 D262 L263	T259-Q261 PolarHBondContact O-N 2.8Å; T259-Q261 PolarHBondContact OG1-N 3.08Å; T259-D262 VanDerWaalsContact CB-OD2 3.28Å; T259-D262 WeakPolarHBondContact CB-OD2 3.32Å; T259-D262 WeakPolarHBondContact CG2-OD2 3.42Å; T259-D262 PolarHBondContact N-OD2 3.16Å; T259-D262 PolarHBondContact O-N 3.01Å; T259-D262 VanDerWaalsContact O-N 3.11Å; T259-D262 PolarHBondContact OG1-N 3.06Å; T259-D262 PolarHBondContact OG1-OD2 2.77Å; T259-L263 PolarHBondContact O-N 2.72Å
260	R	81.9	Confident	71.8	Confident	168 Å²	168	71.1 Å²	71.1	63%	0.634	37%	0.368	S	S	*	.	H	α-helix	trans	-56.6	-30.1	171	175.4	170.4	179.8	138.3	10.2	112.4	L226 C264	L226-R260 HydrophobicContact CD1-CB 3.98Å; L226-R260 HydrophobicContact CD1-CG 3.81Å; L226-R260 HydrophobicContact CD2-CG 3.93Å; L226-R260 VanDerWaalsContact CD2-CZ 3.49Å; R260-C264 WeakPolarHBondContact O-CB 3.32Å; R260-C264 PolarHBondContact O-N 3.46Å
261	Q	80.8	Confident	70	Confident	137 Å²	137	77.9 Å²	77.9	64%	0.64	40%	0.404	S	S	*	.	H	α-helix	trans	-75.1	-30.9	179.5	-73.4	83	-34.3	0	0	112.3	T259 C264 P265	T259-Q261 PolarHBondContact O-N 2.8Å; T259-Q261 PolarHBondContact OG1-N 3.08Å; Q261-C264 CarbonylContact O-C 3.16Å; Q261-P265 WeakPolarHBondContact O-CA 3.42Å
262	D	80.9	Confident	68.2	Low	65 Å²	65	81.6 Å²	81.6	35%	0.348	43%	0.434	S	S	.	.	H	α-helix	trans	-69.9	-49.1	175.2	-62.8	-69.7	0	0	0	111.2	L250 L258 T259	L250-D262 HydrophobicContact CD2-CB 4.36Å; L258-D262 HydrophobicContact CB-CB 4.43Å; L258-D262 HydrophobicContact CD2-CB 4.13Å; T259-D262 VanDerWaalsContact CB-OD2 3.28Å; T259-D262 WeakPolarHBondContact CB-OD2 3.32Å; T259-D262 WeakPolarHBondContact CG2-OD2 3.42Å; T259-D262 PolarHBondContact N-OD2 3.16Å; T259-D262 PolarHBondContact O-N 3.01Å; T259-D262 VanDerWaalsContact O-N 3.11Å; T259-D262 PolarHBondContact OG1-N 3.06Å; T259-D262 PolarHBondContact OG1-OD2 2.77Å
263	L	83.1	Confident	66.8	Low	4 Å²	4	89.3 Å²	89.3	2%	0.021	48%	0.475	C	S	.	.	H	α-helix	trans	-65.6	-38.7	177.2	-73	170.7	0	0	0	112.3	C221 T222 C223 L225 L226 K229 L258 T259	C221-L263 HydrophobicContact CB-CD2 3.62Å; T222-L263 CarbonylContact C-O 3.59Å; C223-L263 PolarHBondContact N-O 3.45Å; L225-L263 HydrophobicContact CB-CD2 4.5Å; L226-L263 HydrophobicContact CD1-CD1 4.25Å; K229-L263 HydrophobicContact CB-CD1 3.91Å; K229-L263 HydrophobicContact CG-CD1 4.08Å; L258-L263 HydrophobicContact CB-CD1 4.48Å; L258-L263 HydrophobicContact CB-CG 4.22Å; L258-L263 HydrophobicContact CD1-CD2 3.6Å; L258-L263 HydrophobicContact CD1-CG 3.96Å; T259-L263 PolarHBondContact O-N 2.72Å
264	C	85.4	Confident	65.4	Low	36 Å²	36	98 Å²	98	24%	0.243	52%	0.516	C	S	.	.	S	Bend	trans	-134.8	72.6	-173.1	-156.7	0	0	0	0	112.1	C223 R260 Q261 R266	C223-C264 HydrophobicContact CB-CB 3.85Å; C223-C264 WeakPolarHBondContact CB-SG 3.41Å; C223-C264 WeakPolarHBondContact SG-CA 3.2Å; C223-C264 WeakPolarHBondContact SG-CB 3.16Å; C223-C264 CovalentContact SG-SG 2.05Å; C223-C264 PolarHBondContact SG-SG 3.01Å; R260-C264 WeakPolarHBondContact O-CB 3.32Å; R260-C264 PolarHBondContact O-N 3.46Å; Q261-C264 CarbonylContact O-C 3.16Å; C264-R266 PolarHBondContact O-N 3.46Å
265	P	78.5	Confident	63.1	Low	94 Å²	94	108.9 Å²	108.9	61%	0.61	56%	0.557	S	S	*	*	P	Polyproline II helix	trans	-64.3	121.7	179.1	25.6	-34.2	0	0	0	110.6	Q261 K267	Q261-P265 WeakPolarHBondContact O-CA 3.42Å; P265-K267 PolarHBondContact O-N 2.78Å
266	R	67	Low	60.5	Low	242 Å²	242	116.3 Å²	116.3	91%	0.913	59%	0.591	S	S	*	*	P	Polyproline II helix	trans	-61.8	124.6	175.7	-70.7	-177.9	174.1	179.1	-1.7	109.6	C264 S268	C264-R266 PolarHBondContact O-N 3.46Å; R266-S268 PolarHBondContact O-N 3.3Å
267	K	53.8	Low	58.3	Low	204 Å²	204	121.4 Å²	121.4	89%	0.887	61%	0.609	S	S	*	*	P	Polyproline II helix	trans	-55.7	138.4	164.6	-71.2	-173.4	176.6	-175.9	0	109.3	P265	P265-K267 PolarHBondContact O-N 2.78Å
268	S	40.2	Very low	56	Low	92 Å²	92	127.6 Å²	127.6	64%	0.643	64%	0.638	S	S	*	*	P	Polyproline II helix	trans	-60.4	140.1	172.8	51.1	0	0	0	0	110.2	R266 S270	R266-S268 PolarHBondContact O-N 3.3Å; S268-S270 PolarHBondContact O-N 3.25Å; S268-S270 PolarHBondContact OG-OG 2.8Å
269	S	42.1	Very low	53.7	Low	123 Å²	123	130.3 Å²	130.3	86%	0.86	66%	0.656	S	S	*	*	S	Bend	trans	-76	63.6	-179.8	56.1	0	0	0	0	111.7
270	S	44	Very low	51.3	Low	93 Å²	93	134 Å²	134	65%	0.65	68%	0.678	S	S	*	*	S	Bend	trans	-136.1	13.5	-176.1	62	0	0	0	0	113.3	S268	S268-S270 PolarHBondContact O-N 3.25Å; S268-S270 PolarHBondContact OG-OG 2.8Å
271	D	38.6	Very low	48.9	Very low	155 Å²	155	131.8 Å²	131.8	83%	0.829	68%	0.678	S	S	*	*	S	Bend	trans	-148.9	35.7	177.9	-139	-6	0	0	0	112.5
272	S	37.5	Very low	46.5	Very low	108 Å²	108	128.5 Å²	128.5	76%	0.755	67%	0.67	S	S	*	*			trans	-107.6	53.1	-179.3	-57.1	0	0	0	0	111.7
273	N	40.2	Very low	44	Very low	162 Å²	162	131.5 Å²	131.5	87%	0.866	69%	0.686	S	S	*	*			trans	-139.6	36.6	179.1	-130.3	-4.4	0	0	0	114.8
274	Q	37.2	Very low	42.4	Very low	202 Å²	202	134.5 Å²	134.5	94%	0.944	71%	0.706	S	S	*	*			trans	-128.8	133.3	152.4	-82.8	-177.3	19.1	0	0	109.7
275	R	32.1	Very low	39.8	Very low	230 Å²	230	140.3 Å²	140.3	87%	0.868	73%	0.73	S	S	*	*			trans	-124.4	85.6	-163.3	-177.4	-177	-178.3	-178.7	2.2	109.7
276	E	30.5	Very low	37.6	Very low	156 Å²	156	141.7 Å²	141.7	73%	0.729	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-64.4	139.7	166.2	-73.5	-152.4	138.2	0	0	110
277	K	33.5	Very low	35.8	Very low	163 Å²	163	135.1 Å²	135.1	71%	0.709	72%	0.721	S	S	*	*	P	Polyproline II helix	trans	-100	152.8	178.5	-62.7	176.6	-179.2	176	0	110	F796	K277-F796 HydrophobicContact CB-CZ 4.26Å; K277-F796 WeakPolarHBondContact O-CZ 3.13Å
278	Q	28.1	Very low	34.5	Very low	174 Å²	174	136.3 Å²	136.3	81%	0.813	72%	0.72	S	S	*	*	P	Polyproline II helix	trans	-103.4	154.9	152.9	-79.1	-178.8	-45	0	0	109.5
279	P	31.3	Very low	34	Very low	66 Å²	66	139.8 Å²	139.8	43%	0.429	73%	0.731	S	S	.	*	P	Polyproline II helix	trans	-82	147.7	176.8	30.1	-27.8	0	0	0	111.7	F796	P279-F796 HydrophobicContact CB-CD1 3.75Å; P279-F796 HydrophobicContact CB-CE1 3.53Å; P279-F796 HydrophobicContact CB-CG 4.44Å; P279-F796 HydrophobicContact CB-CZ 4.07Å; P279-F796 VanDerWaalsContact CD-CZ 3.46Å; P279-F796 HydrophobicContact CG-CD1 4.19Å; P279-F796 HydrophobicContact CG-CD2 4.49Å; P279-F796 HydrophobicContact CG-CE1 4.01Å; P279-F796 HydrophobicContact CG-CE2 4.32Å; P279-F796 HydrophobicContact CG-CG 4.44Å; P279-F796 HydrophobicContact CG-CZ 4.08Å
280	V	31.8	Very low	33.5	Very low	139 Å²	139	139.1 Å²	139.1	84%	0.842	73%	0.726	S	S	*	*			trans	-127.2	148.2	154.3	-178.2	0	0	0	0	106.3
281	L	31.1	Very low	33.5	Very low	122 Å²	122	140.3 Å²	140.3	64%	0.639	73%	0.732	S	S	*	*			trans	-72.2	168.7	-179.1	-75.1	58.2	0	0	0	111.2	S799	L281-S799 WeakPolarHBondContact CD2-OG 3.36Å; L281-S799 WeakPolarHBondContact CG-OG 3.32Å
282	S	30.6	Very low	33.2	Very low	68 Å²	68	139.4 Å²	139.4	48%	0.476	73%	0.732	S	S	.	*			trans	-74.4	170.5	177	61	0	0	0	0	111.5	Y800	S282-Y800 WeakPolarHBondContact O-CE2 2.91Å; S282-Y800 PolarHBondContact O-OH 2.87Å; S282-Y800 VanDerWaalsContact OG-CD2 3.31Å; S282-Y800 WeakPolarHBondContact OG-CD2 3.48Å; S282-Y800 WeakPolarHBondContact OG-CE2 3.49Å
283	D	27.3	Very low	32.9	Very low	128 Å²	128	137.9 Å²	137.9	68%	0.684	73%	0.726	S	S	*	*			cis	67.6	130.4	32	-166.8	83.1	0	0	0	111.6	Y800	D283-Y800 PolarHBondContact N-OH 3.38Å; D283-Y800 WeakPolarHBondContact O-CE2 3.48Å; D283-Y800 PolarHBondContact O-OH 2.95Å
284	P	49.4	Very low	32.6	Very low	68 Å²	68	137.8 Å²	137.8	44%	0.442	73%	0.725	S	S	.	*			cis	-123.2	177.2	32.9	45.9	-32.8	0	0	0	114.6
285	H	31.3	Very low	32.3	Very low	158 Å²	158	133.9 Å²	133.9	73%	0.731	72%	0.72	S	S	*	*				-174.3	164.8	59.3	-111.2	-2.9	0	0	0	108.4
286	I	32.3	Very low	32.2	Very low	123 Å²	123	126.8 Å²	126.8	63%	0.631	71%	0.711	S	S	*	*			cis	-171	137	-10.6	-176.5	169.1	0	0	0	111.3
287	S	29.5	Very low	32.3	Very low	103 Å²	103	127.4 Å²	127.4	72%	0.72	72%	0.718	S	S	*	*			trans	67.7	161.9	163.9	86.3	0	0	0	0	118
288	R	26.7	Very low	32.2	Very low	229 Å²	229	124.7 Å²	124.7	86%	0.864	72%	0.719	S	S	*	*			cis	-160.1	-180	-3.9	-138	173.6	-166.4	-166.9	5.6	110.5
289	L	29.9	Very low	33.3	Very low	165 Å²	165	121.9 Å²	121.9	86%	0.864	72%	0.716	S	S	*	*			trans	83.3	124.3	163.5	-65.8	158.7	0	0	0	119.1
290	S	30.2	Very low	33.4	Very low	109 Å²	109	125.6 Å²	125.6	76%	0.762	74%	0.738	S	S	*	*			trans	-92.9	177.5	157.3	-44.4	0	0	0	0	109.8
291	P	44.9	Very low	33.4	Very low	119 Å²	119	130.6 Å²	130.6	77%	0.773	74%	0.741	S	S	*	*				-141.6	171.9	99.1	37	-22.5	0	0	0	116.7
292	T	32.8	Very low	33.6	Very low	136 Å²	136	128.7 Å²	128.7	83%	0.834	74%	0.743	S	S	*	*			trans	-42.1	168.9	172.1	56	0	0	0	0	117.1
293	A	31.2	Very low	34.4	Very low	75 Å²	75	131.7 Å²	131.7	62%	0.62	76%	0.761	S	S	*	*			cis	-159.1	159	22.4	0	0	0	0	0	114.4
294	N	33.5	Very low	34.7	Very low	161 Å²	161	135.4 Å²	135.4	86%	0.861	77%	0.771	S	S	*	*			trans	45	151	135.2	-56.9	-5.5	0	0	0	121.4
295	S	30.8	Very low	33.9	Very low	119 Å²	119	136.3 Å²	136.3	83%	0.832	78%	0.784	S	S	*	*			cis	-148.7	176	13.5	46.8	0	0	0	0	112.9
296	A	29.1	Very low	33.9	Very low	82 Å²	82	134.8 Å²	134.8	68%	0.678	79%	0.791	S	S	*	*			trans	-75.6	173	177.9	0	0	0	0	0	113.2
297	I	32.8	Very low	34	Very low	169 Å²	169	140.4 Å²	140.4	87%	0.867	81%	0.805	S	S	*	*				-158.6	163.2	76.2	-84.6	161.7	0	0	0	112
298	S	31.2	Very low	35.1	Very low	105 Å²	105	140.5 Å²	140.5	73%	0.734	80%	0.803	S	S	*	*			trans	-99.1	-148.3	-167.4	-54.6	0	0	0	0	114.4
299	P	52.6	Low	36.3	Very low	115 Å²	115	134.4 Å²	134.4	75%	0.747	79%	0.793	S	S	*	*				-129	177.1	-93.7	39.9	-23.5	0	0	0	115.3
300	T	32	Very low	36.6	Very low	145 Å²	145	135.1 Å²	135.1	89%	0.89	79%	0.789	S	S	*	*			trans	-164	109.1	145.1	6.5	0	0	0	0	117.1
301	R	32.1	Very low	36.7	Very low	244 Å²	244	136 Å²	136	92%	0.921	79%	0.79	S	S	*	*			trans	12.6	137.3	138.9	-169.1	168.6	-178.6	167.8	-0.2	122.4
302	A	35.5	Very low	36.1	Very low	81 Å²	81	140.3 Å²	140.3	67%	0.669	79%	0.791	S	S	*	*			trans	-93.2	-178.6	168.2	0	0	0	0	0	114.3
303	P	48.4	Very low	36.1	Very low	132 Å²	132	140 Å²	140	86%	0.857	78%	0.784	S	S	*	*				-140.5	-175.9	123.9	39.1	-26	0	0	0	115.5
304	K	31.9	Very low	36.2	Very low	205 Å²	205	147.9 Å²	147.9	89%	0.891	80%	0.798	S	S	*	*			trans	-110.5	160.3	-174.3	-55	169.6	179.1	174.8	0	111.9
305	A	33.5	Very low	36.6	Very low	88 Å²	88	144.7 Å²	144.7	73%	0.727	79%	0.786	S	S	*	*				140.7	158.5	114.3	0	0	0	0	0	117.3
306	S	31.7	Very low	36.6	Very low	125 Å²	125	145 Å²	145	87%	0.874	78%	0.783	S	S	*	*			trans	90.1	149.9	154.3	-42	0	0	0	0	120.7
307	R	34.2	Very low	37	Very low	241 Å²	241	147.4 Å²	147.4	91%	0.909	79%	0.792	S	S	*	*			trans	-125.5	-175.8	-177	-135.3	-173.6	178.2	-175.7	0.8	106.5
308	P	53.1	Low	36.8	Very low	105 Å²	105	151 Å²	151	68%	0.682	79%	0.794	S	S	*	*			cis	-129.9	-136.2	-16.2	42.7	-21.8	0	0	0	109.5
309	P	52	Low	36.9	Very low	102 Å²	102	152.1 Å²	152.1	66%	0.662	80%	0.796	S	S	*	*			cis	-135.8	173.5	-28.8	38.9	-21.4	0	0	0	117.3
310	K	34.6	Very low	35.8	Very low	180 Å²	180	153.2 Å²	153.2	78%	0.783	80%	0.801	S	S	*	*			trans	77.7	129.6	141.1	-86.7	173.2	-179.8	-179.6	0	124.4
311	T	32.1	Very low	35.8	Very low	126 Å²	126	152.8 Å²	152.8	77%	0.773	80%	0.798	S	S	*	*			trans	70.8	154.1	143.5	57	0	0	0	0	119.7
312	R	32.7	Very low	35.7	Very low	210 Å²	210	146.6 Å²	146.6	79%	0.792	79%	0.792	S	S	*	*			cis	-157.1	167.6	-3.4	-127.8	173.5	102.3	165.5	6.3	112
313	N	34.1	Very low	35.5	Very low	129 Å²	129	151.5 Å²	151.5	69%	0.69	80%	0.798	S	S	*	*			trans	75.5	135.7	153.3	-61.7	-7.7	0	0	0	122.3
314	R	31.7	Very low	34.7	Very low	241 Å²	241	152.2 Å²	152.2	91%	0.909	80%	0.795	S	S	*	*			trans	-85.7	-179.2	156.5	-130.6	-177.1	174.9	-170.2	-0.1	108
315	P	42	Very low	34.8	Very low	95 Å²	95	153 Å²	153	62%	0.617	79%	0.792	S	S	*	*			cis	-142.1	-164.2	2.2	41.4	-19.6	0	0	0	116.3
316	T	32.3	Very low	34.8	Very low	125 Å²	125	157.9 Å²	157.9	77%	0.767	80%	0.8	S	S	*	*			trans	66.8	125.4	160.6	55.2	0	0	0	0	120.4
317	P	36.1	Very low	34.8	Very low	133 Å²	133	159.1 Å²	159.1	86%	0.864	80%	0.795	S	S	*	*			trans	-88.6	144	150.7	35.1	-29.2	0	0	0	110.8
318	R	29.3	Very low	34.7	Very low	243 Å²	243	157 Å²	157	92%	0.917	79%	0.793	S	S	*	*			trans	-125.9	138.7	167.4	-159	176.1	-168.1	174.8	3.6	108.5
319	V	33.2	Very low	33.9	Very low	129 Å²	129	154.5 Å²	154.5	78%	0.782	79%	0.787	S	S	*	*			trans	-74.6	132.2	-170.6	178.1	0	0	0	0	111.8	V321	V319-V321 HydrophobicContact CG1-CG2 4.16Å
320	T	29.5	Very low	33.2	Very low	138 Å²	138	155.7 Å²	155.7	85%	0.847	80%	0.795	S	S	*	*			trans	-136.7	127.2	156.6	50	0	0	0	0	109.1
321	V	31	Very low	33.3	Very low	136 Å²	136	154.4 Å²	154.4	82%	0.824	80%	0.795	S	S	*	*			trans	-95.7	133.9	-179.6	174.3	0	0	0	0	109.8	V319	V319-V321 HydrophobicContact CG1-CG2 4.16Å
322	S	30.1	Very low	33.3	Very low	114 Å²	114	155.3 Å²	155.3	80%	0.797	79%	0.792	S	S	*	*			trans	-143.2	149.9	152.3	-165.9	0	0	0	0	111.2
323	K	32.5	Very low	33.3	Very low	184 Å²	184	151 Å²	151	80%	0.8	79%	0.788	S	S	*	*			trans	-62.5	151	177.8	-59.5	161.6	-176.5	170.6	0	108.9
324	D	32	Very low	33.3	Very low	148 Å²	148	154 Å²	154	79%	0.791	79%	0.791	S	S	*	*				-150.6	176.9	69.3	-128.8	-43.1	0	0	0	117.1
325	R	32.3	Very low	33.3	Very low	220 Å²	220	151 Å²	151	83%	0.83	79%	0.788	S	S	*	*			trans	-80.9	138.9	-165.3	-65.2	161.6	158.7	170.9	-8.1	114.4
326	Q	34.2	Very low	33.4	Very low	191 Å²	191	152.8 Å²	152.8	89%	0.893	80%	0.797	S	S	*	*				-150.1	152.5	126.7	-112.8	170.3	27.1	0	0	110.6
327	I	31.7	Very low	33.8	Very low	151 Å²	151	155.9 Å²	155.9	77%	0.774	80%	0.8	S	S	*	*			trans	-107.7	120.3	-166.8	-63	167.3	0	0	0	109.8
328	F	33.2	Very low	33.8	Very low	197 Å²	197	154.6 Å²	154.6	86%	0.864	79%	0.794	S	S	*	*			trans	-118.3	147.3	150.3	-82	-88.5	0	0	0	108.1
329	G	35.8	Very low	34.6	Very low	53 Å²	53	148.7 Å²	148.7	55%	0.546	79%	0.787	S	S	.	*			trans	-64.1	163.5	-175.9	0	0	0	0	0	113.1	I331	G329-I331 PolarHBondContact O-N 2.9Å
330	P	37.1	Very low	35.5	Very low	127 Å²	127	147 Å²	147	83%	0.825	78%	0.777	S	S	*	*			trans	-67.8	94.5	-179.2	29.1	-34.7	0	0	0	110.6	M332	P330-M332 PolarHBondContact O-N 2.92Å
331	I	37.4	Very low	36.7	Very low	153 Å²	153	145.3 Å²	145.3	79%	0.785	77%	0.768	S	S	*	*			trans	-59.7	110	152.1	-63.6	176.8	0	0	0	105.2	G329 V333	G329-I331 PolarHBondContact O-N 2.9Å; I331-V333 PolarHBondContact O-N 3.43Å
332	M	31.5	Very low	38.3	Very low	144 Å²	144	143.5 Å²	143.5	71%	0.709	75%	0.753	S	S	*	*			trans	-61.7	89.7	171.1	-77.6	-85.2	-76.5	0	0	108.3	P330 Y334	P330-M332 PolarHBondContact O-N 2.92Å; M332-Y334 PolarHBondContact O-N 3.43Å
333	V	31.8	Very low	40.3	Very low	119 Å²	119	140 Å²	140	72%	0.721	73%	0.727	S	S	*	*			trans	-61.4	98.6	155	178.9	0	0	0	0	104.7	I331 Q335	I331-V333 PolarHBondContact O-N 3.43Å; V333-Q335 PolarHBondContact O-N 2.93Å
334	Y	34.8	Very low	42.5	Very low	193 Å²	193	133.3 Å²	133.3	76%	0.757	70%	0.702	S	S	*	*			trans	-49.6	111.6	162.9	-71.5	-83.2	0	0	0	106.1	M332 T336	M332-Y334 PolarHBondContact O-N 3.43Å; Y334-T336 VanDerWaalsContact C-N 3.32Å; Y334-T336 PolarHBondContact O-N 3.03Å
335	Q	32	Very low	45	Very low	178 Å²	178	126.4 Å²	126.4	83%	0.832	67%	0.666	S	S	*	*			trans	-61.4	103.8	173.8	-73.9	-177.8	-20.7	0	0	106	V333 K337	V333-Q335 PolarHBondContact O-N 2.93Å; Q335-K337 VanDerWaalsContact C-N 3.26Å; Q335-K337 PolarHBondContact O-N 2.99Å
336	T	44.3	Very low	47.2	Very low	133 Å²	133	120.2 Å²	120.2	82%	0.816	66%	0.662	S	S	*	*			trans	-58.3	101.6	162	39.4	0	0	0	0	105.2	Y334 S338	Y334-T336 VanDerWaalsContact C-N 3.32Å; Y334-T336 PolarHBondContact O-N 3.03Å; T336-S338 PolarHBondContact O-N 3.12Å
337	K	39.1	Very low	49.1	Very low	190 Å²	190	113.8 Å²	113.8	83%	0.826	65%	0.647	S	S	*	*	P	Polyproline II helix	trans	-46	122	174.8	-73.6	180	177.2	176.1	0	106	Q335 P339	Q335-K337 VanDerWaalsContact C-N 3.26Å; Q335-K337 PolarHBondContact O-N 2.99Å; K337-P339 VanDerWaalsContact O-N 3.13Å
338	S	36.6	Very low	51.6	Low	105 Å²	105	107.4 Å²	107.4	73%	0.734	62%	0.616	S	S	*	*	P	Polyproline II helix	trans	-50.1	126.3	-176.2	-55.3	0	0	0	0	107.7	T336 V340	T336-S338 PolarHBondContact O-N 3.12Å; S338-V340 PolarHBondContact O-N 3.15Å
339	P	46.8	Very low	53.9	Low	119 Å²	119	99.8 Å²	99.8	77%	0.773	58%	0.583	S	S	*	*	P	Polyproline II helix	trans	-55.3	116.3	-164.8	19.9	-32.4	0	0	0	108.6	K337	K337-P339 VanDerWaalsContact O-N 3.13Å
340	V	51.1	Low	56.2	Low	95 Å²	95	98.6 Å²	98.6	58%	0.576	57%	0.567	S	S	*	*	P	Polyproline II helix	trans	-55	131.5	-177.6	-176.1	0	0	0	0	106.8	S338 I342 T379	S338-V340 PolarHBondContact O-N 3.15Å; V340-I342 PolarHBondContact O-N 3.11Å; V340-T379 HydrophobicContact CG1-CG2 3.88Å
341	P	54.8	Low	58	Low	101 Å²	101	93.3 Å²	93.3	66%	0.656	53%	0.532	S	S	*	.			trans	-51.7	113	-176.6	-29.8	36.4	0	0	0	110.9	T343 T379	P341-T343 VanDerWaalsContact C-N 3.26Å; P341-T343 PolarHBondContact O-N 3.07Å; P341-T379 PolarHBondContact O-OG1 2.8Å; P341-T379 VanDerWaalsContact O-OG1 3.1Å
342	I	65.1	Low	59.6	Low	98 Å²	98	88.8 Å²	88.8	50%	0.503	51%	0.514	S	S	.	.			trans	-74.2	88.5	177.2	-61.2	162	0	0	0	106.1	V340 L359	V340-I342 PolarHBondContact O-N 3.11Å; I342-L359 HydrophobicContact CG2-CD1 3.55Å; I342-L359 HydrophobicContact CG2-CD2 4.06Å; I342-L359 HydrophobicContact CG2-CG 4.45Å
343	T	71.7	Confident	60.8	Low	42 Å²	42	82.8 Å²	82.8	26%	0.258	48%	0.484	S	S	.	.			trans	-67.5	130.2	168.3	50	0	0	0	0	108.3	P341 P376 K377 T379	P341-T343 VanDerWaalsContact C-N 3.26Å; P341-T343 PolarHBondContact O-N 3.07Å; T343-P376 HydrophobicContact CG2-CB 4.16Å; T343-P376 HydrophobicContact CG2-CG 4.21Å; T343-K377 WeakPolarHBondContact CB-O 3.33Å; T343-K377 PolarHBondContact OG1-O 3.04Å; T343-T379 PolarHBondContact OG1-N 2.92Å; T343-T379 PolarHBondContact OG1-OG1 3.37Å
344	C	79.9	Confident	61.8	Low	42 Å²	42	80.7 Å²	80.7	28%	0.284	48%	0.475	S	S	.	.			trans	-122.1	130.9	172.7	-172.9	0	0	0	0	108.1	C348 C350 P376	C344-C348 PolarHBondContact SG-O 3.39Å; C344-C350 WeakPolarHBondContact CA-SG 3.48Å; C344-C350 HydrophobicContact CB-CB 3.69Å; C344-C350 WeakPolarHBondContact CB-SG 3.33Å; C344-C350 WeakPolarHBondContact SG-CB 3.49Å; C344-C350 PolarHBondContact SG-N 2.98Å; C344-C350 VanDerWaalsContact SG-N 3.37Å; C344-C350 CovalentContact SG-SG 2.03Å; C344-C350 PolarHBondContact SG-SG 3.15Å; C344-P376 WeakPolarHBondContact O-CD 3.3Å
345	P	84.7	Confident	62.5	Low	3 Å²	3	77 Å²	77	2%	0.019	48%	0.477	C	S	.	.			trans	-59	143.5	176	-22.6	32.2	0	0	0	111.8	G347 C348 V361 L374 H375 P376	P345-G347 PolarHBondContact O-N 2.81Å; P345-C348 HydrophobicContact CB-CB 4.28Å; P345-C348 PolarHBondContact O-N 3.12Å; P345-C348 VanDerWaalsContact O-N 3.11Å; P345-V361 HydrophobicContact CG-CG1 4.44Å; P345-L374 HydrophobicContact CB-CB 4.09Å; P345-L374 HydrophobicContact CB-CD2 3.83Å; P345-L374 HydrophobicContact CG-CB 4.02Å; P345-L374 HydrophobicContact CG-CD2 4.07Å; P345-H375 WeakPolarHBondContact CA-O 3.27Å; P345-P376 WeakPolarHBondContact CG-O 3.48Å
346	A	76.8	Confident	63.5	Low	90 Å²	90	75.2 Å²	75.2	74%	0.744	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	127	179.8	0	0	0	0	0	111.4	C348 H375	A346-C348 VanDerWaalsContact C-N 3.32Å; A346-C348 PolarHBondContact O-N 3.02Å; A346-H375 PolarHBondContact N-O 3.29Å
347	G	74.4	Confident	64.2	Low	57 Å²	57	71.4 Å²	71.4	59%	0.588	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.2	-8.3	-178.9	0	0	0	0	0	115.6	P345 K366	P345-G347 PolarHBondContact O-N 2.81Å; G347-K366 WeakPolarHBondContact O-CD 3.21Å; G347-K366 WeakPolarHBondContact O-CE 3.46Å
348	C	84.4	Confident	65.7	Low	17 Å²	17	63.8 Å²	63.8	12%	0.115	42%	0.424	C	S	.	.			trans	-89.3	157	172.7	-60.2	0	0	0	0	112.2	C344 P345 A346 V361 N362 C363	C344-C348 PolarHBondContact SG-O 3.39Å; P345-C348 HydrophobicContact CB-CB 4.28Å; P345-C348 PolarHBondContact O-N 3.12Å; P345-C348 VanDerWaalsContact O-N 3.11Å; A346-C348 VanDerWaalsContact C-N 3.32Å; A346-C348 PolarHBondContact O-N 3.02Å; C348-V361 HydrophobicContact CB-CG1 4.4Å; C348-N362 CarbonylContact C-O 3.55Å; C348-N362 VanDerWaalsContact CA-O 3.32Å; C348-N362 WeakPolarHBondContact CA-O 3.35Å; C348-N362 VanDerWaalsContact CB-O 3.3Å; C348-N362 WeakPolarHBondContact CB-O 3.43Å; C348-C363 HydrophobicContact CB-CB 4.16Å; C348-C363 WeakPolarHBondContact CB-SG 3.13Å; C348-C363 WeakPolarHBondContact SG-CB 3.28Å; C348-C363 CovalentContact SG-SG 2.04Å; C348-C363 PolarHBondContact SG-SG 3.38Å
349	I	82.1	Confident	67.8	Low	36 Å²	36	59.2 Å²	59.2	19%	0.185	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	104.7	172.8	-58.5	166.6	0	0	0	107.7	F248 T351 N362	F248-I349 HydrophobicContact CD2-CD1 4.33Å; F248-I349 HydrophobicContact CE2-CD1 3.61Å; F248-I349 HydrophobicContact CE2-CG1 4.17Å; F248-I349 HydrophobicContact CZ-CD1 4.19Å; F248-I349 HydrophobicContact CZ-CG1 4.27Å; I349-T351 HydrophobicContact CG2-CG2 4.39Å; I349-N362 HydrophobicContact CB-CB 4.5Å; I349-N362 PolarHBondContact N-O 2.7Å; I349-N362 PolarHBondContact O-N 2.87Å
350	C	83.5	Confident	69.6	Low	29 Å²	29	53.7 Å²	53.7	20%	0.196	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	131.5	174.7	-47.2	0	0	0	0	110.6	C344 L359 N360 V361	C344-C350 WeakPolarHBondContact CA-SG 3.48Å; C344-C350 HydrophobicContact CB-CB 3.69Å; C344-C350 WeakPolarHBondContact CB-SG 3.33Å; C344-C350 WeakPolarHBondContact SG-CB 3.49Å; C344-C350 PolarHBondContact SG-N 2.98Å; C344-C350 VanDerWaalsContact SG-N 3.37Å; C344-C350 CovalentContact SG-SG 2.03Å; C344-C350 PolarHBondContact SG-SG 3.15Å; C350-L359 HydrophobicContact CB-CD1 4.02Å; C350-N360 CarbonylContact C-O 3.22Å; C350-N360 VanDerWaalsContact CA-O 3.25Å; C350-N360 WeakPolarHBondContact CA-O 3.32Å; C350-V361 HydrophobicContact CB-CG2 4.47Å
351	T	75.7	Confident	71.3	Confident	15 Å²	15	49.2 Å²	49.2	9%	0.092	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	117.8	172.2	67.7	0	0	0	0	109.9	K253 I349 Q353 N360	K253-T351 VanDerWaalsContact CE-CB 3.4Å; K253-T351 WeakPolarHBondContact CE-OG1 3.46Å; K253-T351 HydrophobicContact CG-CG2 4.49Å; K253-T351 WeakPolarHBondContact CG-OG1 3.46Å; I349-T351 HydrophobicContact CG2-CG2 4.39Å; T351-Q353 PolarHBondContact O-N 3.18Å; T351-N360 PolarHBondContact N-O 3.36Å; T351-N360 PolarHBondContact O-N 3.05Å
352	S	71.2	Confident	72.7	Confident	58 Å²	58	44.5 Å²	44.5	41%	0.406	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	132.3	159.9	-166.5	0	0	0	0	107.6
353	Q	54.9	Low	73.7	Confident	18 Å²	18	39.8 Å²	39.8	8%	0.084	27%	0.273	C	S	.	.			trans	-78.4	-175.9	155	-65.6	-175.4	12.2	0	0	108.6	T351 N357 G358	T351-Q353 PolarHBondContact O-N 3.18Å; Q353-N357 HydrophobicContact CB-CB 3.48Å; Q353-N357 VanDerWaalsContact CB-CB 3.48Å; Q353-N357 HydrophobicContact CG-CB 4.43Å; Q353-N357 PolarHBondContact OE1-ND2 3.05Å; Q353-G358 PolarHBondContact N-O 3.11Å
354	S	52.9	Low	74.3	Confident	76 Å²	76	40.1 Å²	40.1	53%	0.531	27%	0.272	S	S	.	.	S	Bend	trans	-55.8	164.2	174.1	36.3	0	0	0	0	111.9	D356 N357	S354-D356 PolarHBondContact O-N 2.73Å; S354-N357 PolarHBondContact O-N 2.88Å
355	S	50.4	Low	74.5	Confident	115 Å²	115	45 Å²	45	80%	0.804	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-41	-30.1	-165.7	35.8	0	0	0	0	117.5
356	D	52.3	Low	74.5	Confident	140 Å²	140	49.5 Å²	49.5	75%	0.749	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.4	-5.4	-168.6	-48.5	-83	0	0	0	113	S354	S354-D356 PolarHBondContact O-N 2.73Å
357	N	58.7	Low	74.9	Confident	53 Å²	53	52 Å²	52	28%	0.283	30%	0.303	S	S	.	.	S	Bend	trans	-97	-7.2	-174.6	-91.7	31.7	0	0	0	115.1	Q353 S354 K382	Q353-N357 HydrophobicContact CB-CB 3.48Å; Q353-N357 VanDerWaalsContact CB-CB 3.48Å; Q353-N357 HydrophobicContact CG-CB 4.43Å; Q353-N357 PolarHBondContact OE1-ND2 3.05Å; S354-N357 PolarHBondContact O-N 2.88Å; N357-K382 WeakPolarHBondContact O-CD 3.15Å
358	G	70.9	Confident	75.6	Confident	31 Å²	31	50.2 Å²	50.2	32%	0.32	28%	0.28	S	S	.	.			trans	79.6	-176.9	175.5	0	0	0	0	0	115.9	Q353	Q353-G358 PolarHBondContact N-O 3.11Å
359	L	81.7	Confident	75.8	Confident	9 Å²	9	51.8 Å²	51.8	5%	0.047	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	126.8	-173	-178.6	63.2	0	0	0	111.7	I342 C350 V361 P378 T379 P381 K382 K383	I342-L359 HydrophobicContact CG2-CD1 3.55Å; I342-L359 HydrophobicContact CG2-CD2 4.06Å; I342-L359 HydrophobicContact CG2-CG 4.45Å; C350-L359 HydrophobicContact CB-CD1 4.02Å; L359-V361 HydrophobicContact CD2-CG2 4.15Å; L359-V361 HydrophobicContact CG-CG2 3.99Å; L359-P378 HydrophobicContact CD2-CB 4.03Å; L359-T379 WeakPolarHBondContact CD2-O 3.36Å; L359-P381 CarbonylContact O-C 3.5Å; L359-P381 WeakPolarHBondContact O-CA 3.5Å; L359-K382 PolarHBondContact O-N 2.99Å; L359-K383 PolarHBondContact O-N 3.47Å
360	N	83.7	Confident	76.2	Confident	3 Å²	3	52.6 Å²	52.6	2%	0.016	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	130.7	172.5	178.8	-20.4	0	0	0	109.2	G252 C350 T351 K383 Y385	G252-N360 PolarHBondContact O-ND2 3.03Å; C350-N360 CarbonylContact C-O 3.22Å; C350-N360 VanDerWaalsContact CA-O 3.25Å; C350-N360 WeakPolarHBondContact CA-O 3.32Å; T351-N360 PolarHBondContact N-O 3.36Å; T351-N360 PolarHBondContact O-N 3.05Å; N360-K383 HydrophobicContact CB-CB 4.42Å; N360-Y385 WeakPolarHBondContact OD1-CE2 3.36Å
361	V	86.8	Confident	76.5	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	115.3	-174.3	-178.7	0	0	0	0	109.8	P345 C348 C350 L359 P378 P381 K383 L384 Y385	P345-V361 HydrophobicContact CG-CG1 4.44Å; C348-V361 HydrophobicContact CB-CG1 4.4Å; C350-V361 HydrophobicContact CB-CG2 4.47Å; L359-V361 HydrophobicContact CD2-CG2 4.15Å; L359-V361 HydrophobicContact CG-CG2 3.99Å; V361-P378 HydrophobicContact CG2-CB 3.78Å; V361-P378 HydrophobicContact CG2-CG 4.27Å; V361-P381 HydrophobicContact CG2-CB 4.08Å; V361-K383 PolarHBondContact N-O 2.92Å; V361-L384 HydrophobicContact CB-CD1 3.88Å; V361-L384 HydrophobicContact CG1-CD1 3.76Å; V361-L384 WeakPolarHBondContact O-CA 3.47Å; V361-Y385 PolarHBondContact O-N 3.28Å
362	N	84.8	Confident	77	Confident	2 Å²	2	52.7 Å²	52.7	1%	0.011	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	118.3	176.7	-175.2	-46.3	0	0	0	111.1	H251 C348 I349 Q364	H251-N362 PolarHBondContact CE1-ND2 2.76Å; C348-N362 CarbonylContact C-O 3.55Å; C348-N362 VanDerWaalsContact CA-O 3.32Å; C348-N362 WeakPolarHBondContact CA-O 3.35Å; C348-N362 VanDerWaalsContact CB-O 3.3Å; C348-N362 WeakPolarHBondContact CB-O 3.43Å; I349-N362 HydrophobicContact CB-CB 4.5Å; I349-N362 PolarHBondContact N-O 2.7Å; I349-N362 PolarHBondContact O-N 2.87Å; N362-Q364 PolarHBondContact ND2-OE1 3.13Å; N362-Q364 WeakPolarHBondContact OD1-CG 3.41Å; N362-Q364 PolarHBondContact OD1-N 3.04Å; N362-Q364 PolarHBondContact OD1-OE1 3.07Å
363	C	86.8	Confident	77.6	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	30%	0.297	C	S	.	.			trans	-126.1	27.8	-177.9	-63.3	0	0	0	0	111.8	C348 K366 I368 Y385 L386 N389	C348-C363 HydrophobicContact CB-CB 4.16Å; C348-C363 WeakPolarHBondContact CB-SG 3.13Å; C348-C363 WeakPolarHBondContact SG-CB 3.28Å; C348-C363 CovalentContact SG-SG 2.04Å; C348-C363 PolarHBondContact SG-SG 3.38Å; C363-K366 WeakPolarHBondContact O-CG 3.48Å; C363-I368 HydrophobicContact CB-CD1 3.76Å; C363-Y385 CarbonylContact C-O 3.14Å; C363-Y385 WeakPolarHBondContact CA-O 3.19Å; C363-Y385 WeakPolarHBondContact CB-O 3.3Å; C363-Y385 PolarHBondContact N-O 3.48Å; C363-L386 HydrophobicContact CB-CD2 3.7Å; C363-L386 HydrophobicContact CB-CG 4.47Å; C363-N389 PolarHBondContact O-ND2 3.28Å
364	Q	83.6	Confident	79	Confident	49 Å²	49	53 Å²	53	23%	0.229	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68	142.3	-174.3	-60.3	177.3	-71.2	0	0	112.1	N362 K366 T387	N362-Q364 PolarHBondContact ND2-OE1 3.13Å; N362-Q364 WeakPolarHBondContact OD1-CG 3.41Å; N362-Q364 PolarHBondContact OD1-N 3.04Å; N362-Q364 PolarHBondContact OD1-OE1 3.07Å; Q364-K366 WeakPolarHBondContact O-CG 3.5Å; Q364-K366 PolarHBondContact O-N 3.1Å; Q364-K366 PolarHBondContact O-NZ 3.08Å; Q364-T387 WeakPolarHBondContact CA-O 3.3Å; Q364-T387 WeakPolarHBondContact CG-OG1 3.49Å; Q364-T387 PolarHBondContact NE2-OG1 3.43Å
365	E	83.4	Confident	80.3	Confident	144 Å²	144	55.2 Å²	55.2	67%	0.673	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.2	26	177.9	-61.2	-173.2	179.3	0	0	115.8	T387 S388	E365-T387 PolarHBondContact N-O 3.31Å; E365-T387 VanDerWaalsContact N-O 3.13Å; E365-S388 WeakPolarHBondContact CA-O 3.29Å; E365-S388 VanDerWaalsContact CG-CB 3.49Å
366	K	84.6	Confident	81.8	Confident	97 Å²	97	53 Å²	53	42%	0.422	28%	0.279	S	S	.	.	S	Bend	trans	-90.6	3.9	-178.7	-59.6	-60.7	170.6	-80.6	0	114.4	G347 C363 Q364 I368 N389	G347-K366 WeakPolarHBondContact O-CD 3.21Å; G347-K366 WeakPolarHBondContact O-CE 3.46Å; C363-K366 WeakPolarHBondContact O-CG 3.48Å; Q364-K366 WeakPolarHBondContact O-CG 3.5Å; Q364-K366 PolarHBondContact O-N 3.1Å; Q364-K366 PolarHBondContact O-NZ 3.08Å; K366-I368 HydrophobicContact CB-CD1 3.88Å; K366-I368 HydrophobicContact CB-CG1 3.93Å; K366-I368 PolarHBondContact O-N 3.3Å; K366-N389 WeakPolarHBondContact CA-OD1 3.28Å; K366-N389 PolarHBondContact N-OD1 3.43Å
367	K	87.1	Confident	83.2	Confident	143 Å²	143	49.1 Å²	49.1	62%	0.622	26%	0.256	S	S	*	.			trans	59.4	27.1	-178.9	-54.9	-177.5	178.6	179.7	0	113.7	N389 Y390	K367-N389 PolarHBondContact N-OD1 3.08Å; K367-Y390 HydrophobicContact CB-CD2 3.92Å; K367-Y390 HydrophobicContact CB-CE2 3.65Å; K367-Y390 HydrophobicContact CD-CE2 4.05Å; K367-Y390 HydrophobicContact CG-CD2 4.39Å; K367-Y390 HydrophobicContact CG-CE2 3.64Å
368	I	88.8	Confident	84.3	Confident	20 Å²	20	47.1 Å²	47.1	10%	0.103	25%	0.246	C	C	.	.			trans	-62	139.8	178.4	-64.3	163.7	0	0	0	109.4	C363 K366 N370 D373 L374 L386 N389 Y390 L391	C363-I368 HydrophobicContact CB-CD1 3.76Å; K366-I368 HydrophobicContact CB-CD1 3.88Å; K366-I368 HydrophobicContact CB-CG1 3.93Å; K366-I368 PolarHBondContact O-N 3.3Å; I368-N370 WeakPolarHBondContact CG2-O 3.42Å; I368-D373 HydrophobicContact CG2-CB 4.28Å; I368-L374 HydrophobicContact CD1-CD2 3.92Å; I368-L386 HydrophobicContact CD1-CD2 3.84Å; I368-N389 HydrophobicContact CB-CB 4.31Å; I368-N389 PolarHBondContact N-OD1 2.95Å; I368-Y390 CarbonylContact O-C 3.57Å; I368-Y390 WeakPolarHBondContact O-CA 3.4Å; I368-Y390 PolarHBondContact O-N 3.07Å; I368-L391 HydrophobicContact CG2-CD2 3.94Å; I368-L391 PolarHBondContact O-N 3.29Å
369	S	89	Confident	84.6	Confident	50 Å²	50	48.1 Å²	48.1	35%	0.35	25%	0.246	S	C	.	.	S	Bend	trans	-109.1	-32.2	-175.8	-62.3	0	0	0	0	113	D373 L391	S369-D373 PolarHBondContact N-OD2 3.32Å; S369-D373 VanDerWaalsContact N-OD2 3.1Å; S369-L391 WeakPolarHBondContact O-CA 3.45Å
370	N	89.9	Confident	84.4	Confident	52 Å²	52	51 Å²	51	28%	0.278	27%	0.267	S	S	.	.			trans	-132.4	152.4	169.1	-47.6	-73.7	0	0	0	110.7	I368 S372 D373	I368-N370 WeakPolarHBondContact CG2-O 3.42Å; N370-S372 PolarHBondContact O-N 2.92Å; N370-D373 PolarHBondContact N-OD2 3.3Å; N370-D373 PolarHBondContact ND2-OD1 3.39Å; N370-D373 VanDerWaalsContact O-CB 3.26Å; N370-D373 WeakPolarHBondContact O-CB 3.39Å; N370-D373 PolarHBondContact O-N 2.91Å
371	I	88.6	Confident	84.5	Confident	1 Å²	1	50.8 Å²	50.8	1%	0.005	27%	0.266	C	S	.	.	G	3₁₀ helix	trans	-67.3	-30.6	175.7	-55.8	178.3	0	0	0	110.5	D373 L374 L386 L391 I394 D398 L399 L410	I371-D373 PolarHBondContact O-N 2.97Å; I371-L374 HydrophobicContact CG2-CD1 4.01Å; I371-L374 VanDerWaalsContact O-CB 3.32Å; I371-L374 WeakPolarHBondContact O-CB 3.44Å; I371-L374 VanDerWaalsContact O-CG 3.25Å; I371-L374 WeakPolarHBondContact O-CG 3.39Å; I371-L374 PolarHBondContact O-N 3.2Å; I371-L374 VanDerWaalsContact O-N 3.16Å; I371-L386 HydrophobicContact CD1-CD1 4.32Å; I371-L386 HydrophobicContact CG1-CD1 4.13Å; I371-L386 HydrophobicContact CG2-CD1 4.35Å; I371-L391 HydrophobicContact CD1-CD1 4.38Å; I371-L391 HydrophobicContact CG1-CD1 3.93Å; I371-L391 HydrophobicContact CG1-CD2 3.93Å; I371-I394 HydrophobicContact CD1-CG2 4.21Å; I371-D398 HydrophobicContact CB-CB 3.81Å; I371-D398 HydrophobicContact CD1-CB 4.45Å; I371-D398 HydrophobicContact CG2-CB 4.07Å; I371-L399 HydrophobicContact CD1-CD1 4.39Å; I371-L399 HydrophobicContact CD1-CD2 4.36Å; I371-L399 HydrophobicContact CD1-CG 4.45Å; I371-L399 HydrophobicContact CG2-CD2 4.24Å; I371-L410 HydrophobicContact CD1-CD2 3.99Å
372	S	86.2	Confident	84.4	Confident	45 Å²	45	53.7 Å²	53.7	32%	0.315	28%	0.278	S	S	.	.	G	3₁₀ helix	trans	-58.8	-19.3	169.8	-75.8	0	0	0	0	114.9	N370 L374 H375 D398	N370-S372 PolarHBondContact O-N 2.92Å; S372-L374 PolarHBondContact O-N 3.49Å; S372-L374 VanDerWaalsContact O-N 3.16Å; S372-H375 PolarHBondContact O-CE1 3.12Å; S372-H375 PolarHBondContact O-ND1 3Å; S372-D398 VanDerWaalsContact CB-OD1 3.31Å; S372-D398 WeakPolarHBondContact CB-OD1 3.15Å; S372-D398 PolarHBondContact N-OD1 3.43Å; S372-D398 PolarHBondContact OG-OD1 3.34Å
373	D	84.7	Confident	84.4	Confident	76 Å²	76	53.7 Å²	53.7	41%	0.406	28%	0.278	S	S	.	.	G	3₁₀ helix	trans	-66.6	-13.1	176	-53.3	-20.4	0	0	0	112.2	I368 S369 N370 I371 H375	I368-D373 HydrophobicContact CG2-CB 4.28Å; S369-D373 PolarHBondContact N-OD2 3.32Å; S369-D373 VanDerWaalsContact N-OD2 3.1Å; N370-D373 PolarHBondContact N-OD2 3.3Å; N370-D373 PolarHBondContact ND2-OD1 3.39Å; N370-D373 VanDerWaalsContact O-CB 3.26Å; N370-D373 WeakPolarHBondContact O-CB 3.39Å; N370-D373 PolarHBondContact O-N 2.91Å; I371-D373 PolarHBondContact O-N 2.97Å; D373-H375 PolarHBondContact O-N 2.95Å
374	L	83.9	Confident	84.6	Confident	6 Å²	6	53.7 Å²	53.7	3%	0.031	28%	0.278	C	S	.	.			trans	-69.9	91.5	179.5	-65.8	176.6	0	0	0	111.5	P345 I368 I371 S372 P376 K377 L384 L386	P345-L374 HydrophobicContact CB-CB 4.09Å; P345-L374 HydrophobicContact CB-CD2 3.83Å; P345-L374 HydrophobicContact CG-CB 4.02Å; P345-L374 HydrophobicContact CG-CD2 4.07Å; I368-L374 HydrophobicContact CD1-CD2 3.92Å; I371-L374 HydrophobicContact CG2-CD1 4.01Å; I371-L374 VanDerWaalsContact O-CB 3.32Å; I371-L374 WeakPolarHBondContact O-CB 3.44Å; I371-L374 VanDerWaalsContact O-CG 3.25Å; I371-L374 WeakPolarHBondContact O-CG 3.39Å; I371-L374 PolarHBondContact O-N 3.2Å; I371-L374 VanDerWaalsContact O-N 3.16Å; S372-L374 PolarHBondContact O-N 3.49Å; S372-L374 VanDerWaalsContact O-N 3.16Å; L374-P376 CarbonylContact O-C 3.03Å; L374-K377 PolarHBondContact O-N 2.92Å; L374-L384 HydrophobicContact CD1-CD1 4.48Å; L374-L386 HydrophobicContact CD1-CD2 4.39Å
375	H	79.7	Confident	84.8	Confident	124 Å²	124	51.6 Å²	51.6	57%	0.574	27%	0.268	S	S	*	.	S	Bend	trans	-119.7	131.6	179.3	-70.4	-3.7	0	0	0	112.3	P345 A346 S372 D373	P345-H375 WeakPolarHBondContact CA-O 3.27Å; A346-H375 PolarHBondContact N-O 3.29Å; S372-H375 PolarHBondContact O-CE1 3.12Å; S372-H375 PolarHBondContact O-ND1 3Å; D373-H375 PolarHBondContact O-N 2.95Å
376	P	82.6	Confident	85	Confident	67 Å²	67	44.7 Å²	44.7	44%	0.435	24%	0.236	S	C	.	.	S	Bend	cis	-64.2	150.8	-13.7	30.2	-37.1	0	0	0	111.8	T343 C344 P345 L374	T343-P376 HydrophobicContact CG2-CB 4.16Å; T343-P376 HydrophobicContact CG2-CG 4.21Å; C344-P376 WeakPolarHBondContact O-CD 3.3Å; P345-P376 WeakPolarHBondContact CG-O 3.48Å; L374-P376 CarbonylContact O-C 3.03Å
377	K	82.3	Confident	85.1	Confident	60 Å²	60	40.6 Å²	40.6	26%	0.261	22%	0.219	S	C	.	.	P	Polyproline II helix	trans	-57.5	139.4	171.8	-70.8	-170.3	178.2	-167.8	0	110	T343 L374 E401	T343-K377 WeakPolarHBondContact CB-O 3.33Å; T343-K377 PolarHBondContact OG1-O 3.04Å; L374-K377 PolarHBondContact O-N 2.92Å; K377-E401 WeakPolarHBondContact CD-OE1 3.36Å; K377-E401 VanDerWaalsContact CD-OE2 3.22Å; K377-E401 WeakPolarHBondContact CD-OE2 3.26Å; K377-E401 IonicContact NZ-OE1 3.73Å; K377-E401 PolarHBondContact NZ-OE1 2.99Å; K377-E401 IonicContact NZ-OE2 3.55Å
378	P	81.1	Confident	85	Confident	10 Å²	10	36 Å²	36	7%	0.065	21%	0.205	C	C	.	.	P	Polyproline II helix	trans	-73	133.6	-178.7	29.5	-33.6	0	0	0	111.6	L359 V361 S380 P381 Y402	L359-P378 HydrophobicContact CD2-CB 4.03Å; V361-P378 HydrophobicContact CG2-CB 3.78Å; V361-P378 HydrophobicContact CG2-CG 4.27Å; P378-S380 PolarHBondContact O-N 2.82Å; P378-P381 HydrophobicContact CB-CB 4.48Å; P378-P381 HydrophobicContact CB-CG 4.48Å; P378-P381 HydrophobicContact CG-CB 4.36Å; P378-P381 HydrophobicContact CG-CG 4Å; P378-P381 WeakPolarHBondContact O-CD 3.49Å; P378-Y402 WeakPolarHBondContact CD-OH 3.13Å; P378-Y402 HydrophobicContact CG-CE1 3.77Å
379	T	77.1	Confident	85.1	Confident	52 Å²	52	35.2 Å²	35.2	32%	0.319	20%	0.201	S	C	.	.	S	Bend	trans	-69.7	113.2	175.2	-50.8	0	0	0	0	110.7	V340 P341 T343 L359	V340-T379 HydrophobicContact CG1-CG2 3.88Å; P341-T379 PolarHBondContact O-OG1 2.8Å; P341-T379 VanDerWaalsContact O-OG1 3.1Å; T343-T379 PolarHBondContact OG1-N 2.92Å; T343-T379 PolarHBondContact OG1-OG1 3.37Å; L359-T379 WeakPolarHBondContact CD2-O 3.36Å
380	S	78.6	Confident	85.3	Confident	69 Å²	69	37 Å²	37	48%	0.483	20%	0.2	S	C	.	.	S	Bend	trans	44.6	64.7	174	58.8	0	0	0	0	114.5	P378 S404	P378-S380 PolarHBondContact O-N 2.82Å; S380-S404 WeakPolarHBondContact CA-OG 3.16Å
381	P	85.1	Confident	85.5	Confident	0 Å²	0	34.5 Å²	34.5	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	145.5	174.6	31.5	-36	0	0	0	111	L359 V361 P378 Y402 S404 L405	L359-P381 CarbonylContact O-C 3.5Å; L359-P381 WeakPolarHBondContact O-CA 3.5Å; V361-P381 HydrophobicContact CG2-CB 4.08Å; P378-P381 HydrophobicContact CB-CB 4.48Å; P378-P381 HydrophobicContact CB-CG 4.48Å; P378-P381 HydrophobicContact CG-CB 4.36Å; P378-P381 HydrophobicContact CG-CG 4Å; P378-P381 WeakPolarHBondContact O-CD 3.49Å; P381-Y402 HydrophobicContact CG-CD1 3.36Å; P381-Y402 HydrophobicContact CG-CE1 3.78Å; P381-Y402 HydrophobicContact CG-CG 4.26Å; P381-S404 CarbonylContact O-C 3.08Å; P381-S404 WeakPolarHBondContact O-CB 3.45Å; P381-S404 PolarHBondContact O-OG 2.84Å; P381-L405 HydrophobicContact CB-CD2 3.94Å; P381-L405 HydrophobicContact CG-CD2 3.98Å; P381-L405 HydrophobicContact CG-CG 4.43Å; P381-L405 PolarHBondContact O-N 2.98Å
382	K	84.8	Confident	85.7	Confident	60 Å²	60	39.7 Å²	39.7	26%	0.261	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	-32.3	171.6	-170.1	176.7	-177.1	-179	0	112.3	N357 L359 S404 D406 L407	N357-K382 WeakPolarHBondContact O-CD 3.15Å; L359-K382 PolarHBondContact O-N 2.99Å; K382-S404 WeakPolarHBondContact CA-O 3.45Å; K382-D406 HydrophobicContact CD-CB 4.32Å; K382-D406 WeakPolarHBondContact CE-OD2 3.41Å; K382-D406 HydrophobicContact CG-CB 3.56Å; K382-D406 WeakPolarHBondContact O-CB 3.46Å; K382-D406 PolarHBondContact O-N 2.76Å; K382-L407 PolarHBondContact O-N 3.34Å
383	K	85.8	Confident	86.1	Confident	3 Å²	3	39 Å²	39	1%	0.013	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	135.2	171.8	-54.6	-158.5	-171.1	-160.1	0	110	E241 D254 Q257 L359 N360 V361 Y385 L407	E241-K383 IonicContact OE1-NZ 3.68Å; E241-K383 PolarHBondContact OE1-NZ 3Å; E241-K383 IonicContact OE2-NZ 2.76Å; E241-K383 PolarHBondContact OE2-NZ 3.32Å; D254-K383 IonicContact OD2-NZ 2.99Å; D254-K383 PolarHBondContact OD2-NZ 3.19Å; Q257-K383 VanDerWaalsContact NE2-CE 3.33Å; Q257-K383 VanDerWaalsContact OE1-CE 3.31Å; L359-K383 PolarHBondContact O-N 3.47Å; N360-K383 HydrophobicContact CB-CB 4.42Å; V361-K383 PolarHBondContact N-O 2.92Å; K383-Y385 HydrophobicContact CB-CE2 4Å; K383-L407 WeakPolarHBondContact CA-O 3.38Å; K383-L407 HydrophobicContact CB-CB 4.42Å; K383-L407 HydrophobicContact CB-CD2 4.28Å; K383-L407 HydrophobicContact CD-CB 4.24Å; K383-L407 HydrophobicContact CG-CB 4.17Å
384	L	89.1	Confident	86.5	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	115.2	178.6	178.9	60.3	0	0	0	110.7	V361 L374 L386 Y402 L405 L407 L408 H409	V361-L384 HydrophobicContact CB-CD1 3.88Å; V361-L384 HydrophobicContact CG1-CD1 3.76Å; V361-L384 WeakPolarHBondContact O-CA 3.47Å; L374-L384 HydrophobicContact CD1-CD1 4.48Å; L384-L386 HydrophobicContact CD1-CD1 4.21Å; L384-L386 HydrophobicContact CD1-CG 4.18Å; L384-L386 HydrophobicContact CD2-CD1 3.78Å; L384-L386 HydrophobicContact CG-CD1 3.84Å; L384-L386 HydrophobicContact CG-CG 4.15Å; L384-Y402 HydrophobicContact CD2-CD1 4.02Å; L384-Y402 HydrophobicContact CD2-CE1 3.73Å; L384-L405 HydrophobicContact CB-CD1 4.43Å; L384-L405 HydrophobicContact CB-CD2 3.82Å; L384-L407 PolarHBondContact N-O 3.13Å; L384-L407 VanDerWaalsContact N-O 3.11Å; L384-L408 HydrophobicContact CB-CD1 4.14Å; L384-L408 HydrophobicContact CD2-CD1 3.89Å; L384-L408 HydrophobicContact CG-CD1 4.12Å; L384-H409 PolarHBondContact O-N 2.82Å
385	Y	87.7	Confident	86.9	Confident	4 Å²	4	39.3 Å²	39.3	2%	0.016	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	116.3	177.7	-58	-90.3	0	0	0	110.6	E241 V243 N360 V361 C363 K383 L407 H409	E241-Y385 PolarHBondContact OE2-OH 3.26Å; E241-Y385 VanDerWaalsContact OE2-OH 3.05Å; V243-Y385 HydrophobicContact CG2-CE1 4.15Å; V243-Y385 WeakPolarHBondContact CG2-OH 3.45Å; N360-Y385 WeakPolarHBondContact OD1-CE2 3.36Å; V361-Y385 PolarHBondContact O-N 3.28Å; C363-Y385 CarbonylContact C-O 3.14Å; C363-Y385 WeakPolarHBondContact CA-O 3.19Å; C363-Y385 WeakPolarHBondContact CB-O 3.3Å; C363-Y385 PolarHBondContact N-O 3.48Å; K383-Y385 HydrophobicContact CB-CE2 4Å; Y385-L407 HydrophobicContact CD1-CD2 4.09Å; Y385-L407 HydrophobicContact CE1-CD1 4.34Å; Y385-L407 HydrophobicContact CE1-CD2 3.71Å; Y385-L407 HydrophobicContact CE2-CD2 4.35Å; Y385-H409 HydrophobicContact CD1-CB 3.94Å; Y385-H409 AromaticContact CD1-CD2 3.88Å
386	L	89.3	Confident	87.4	Confident	0 Å²	0	40 Å²	40	0%	0	20%	0.199	C	C	.	.			trans	-125.2	20.7	-178.1	-79.3	163.9	0	0	0	112	C363 I368 I371 L374 L384 N389 L391 H409 L410 N413	C363-L386 HydrophobicContact CB-CD2 3.7Å; C363-L386 HydrophobicContact CB-CG 4.47Å; I368-L386 HydrophobicContact CD1-CD2 3.84Å; I371-L386 HydrophobicContact CD1-CD1 4.32Å; I371-L386 HydrophobicContact CG1-CD1 4.13Å; I371-L386 HydrophobicContact CG2-CD1 4.35Å; L374-L386 HydrophobicContact CD1-CD2 4.39Å; L384-L386 HydrophobicContact CD1-CD1 4.21Å; L384-L386 HydrophobicContact CD1-CG 4.18Å; L384-L386 HydrophobicContact CD2-CD1 3.78Å; L384-L386 HydrophobicContact CG-CD1 3.84Å; L384-L386 HydrophobicContact CG-CG 4.15Å; L386-N389 VanDerWaalsContact C-ND2 3.32Å; L386-N389 PolarHBondContact O-ND2 3.39Å; L386-L391 HydrophobicContact CB-CD1 4.18Å; L386-L391 HydrophobicContact CD1-CD1 4.37Å; L386-H409 PolarHBondContact N-O 3.46Å; L386-L410 HydrophobicContact CB-CD2 3.96Å; L386-L410 HydrophobicContact CD1-CD2 3.88Å; L386-N413 PolarHBondContact O-ND2 2.86Å
387	T	86.4	Confident	87.7	Confident	11 Å²	11	41.1 Å²	41.1	7%	0.067	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	156.7	-176.6	69.8	0	0	0	0	113.5	Q364 E365 N389 H409 G411	Q364-T387 WeakPolarHBondContact CA-O 3.3Å; Q364-T387 WeakPolarHBondContact CG-OG1 3.49Å; Q364-T387 PolarHBondContact NE2-OG1 3.43Å; E365-T387 PolarHBondContact N-O 3.31Å; E365-T387 VanDerWaalsContact N-O 3.13Å; T387-N389 PolarHBondContact O-N 2.92Å; T387-N389 PolarHBondContact O-ND2 3.05Å; T387-H409 HydrophobicContact CG2-CB 4.25Å; T387-H409 VanDerWaalsContact CG2-CE1 3.41Å; T387-H409 WeakPolarHBondContact CG2-CE1 3.43Å; T387-H409 VanDerWaalsContact CG2-CG 3.41Å; T387-H409 VanDerWaalsContact CG2-ND1 3.31Å; T387-H409 WeakPolarHBondContact CG2-ND1 3.14Å; T387-G411 WeakPolarHBondContact CA-O 3.47Å; T387-G411 WeakPolarHBondContact CB-O 3.09Å
388	S	84.6	Confident	88	Confident	46 Å²	46	38.3 Å²	38.3	32%	0.322	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.4	34.2	174.4	-49.2	0	0	0	0	113.2	E365 G411 N412	E365-S388 WeakPolarHBondContact CA-O 3.29Å; E365-S388 VanDerWaalsContact CG-CB 3.49Å; S388-G411 PolarHBondContact N-O 3.41Å; S388-N412 WeakPolarHBondContact CA-O 3.42Å; S388-N412 PolarHBondContact N-O 3.27Å; S388-N412 VanDerWaalsContact N-O 3.13Å
389	N	90.2	Very high	88.4	Confident	3 Å²	3	37.9 Å²	37.9	2%	0.016	19%	0.189	C	C	.	.	S	Bend	trans	-108.7	-168.5	174.9	-76.9	-69.2	0	0	0	110.4	C363 K366 K367 I368 L386 T387 N413	C363-N389 PolarHBondContact O-ND2 3.28Å; K366-N389 WeakPolarHBondContact CA-OD1 3.28Å; K366-N389 PolarHBondContact N-OD1 3.43Å; K367-N389 PolarHBondContact N-OD1 3.08Å; I368-N389 HydrophobicContact CB-CB 4.31Å; I368-N389 PolarHBondContact N-OD1 2.95Å; L386-N389 VanDerWaalsContact C-ND2 3.32Å; L386-N389 PolarHBondContact O-ND2 3.39Å; T387-N389 PolarHBondContact O-N 2.92Å; T387-N389 PolarHBondContact O-ND2 3.05Å; N389-N413 WeakPolarHBondContact CA-OD1 3.41Å; N389-N413 WeakPolarHBondContact CB-OD1 3.17Å; N389-N413 PolarHBondContact N-OD1 3.21Å; N389-N413 PolarHBondContact O-OD1 3.03Å
390	Y	93.3	Very high	88.8	Confident	87 Å²	87	38 Å²	38	34%	0.341	19%	0.19	S	C	.	.			trans	-117.8	28.9	-177.2	-54.2	-40.4	0	0	0	112.6	K367 I368 Q392	K367-Y390 HydrophobicContact CB-CD2 3.92Å; K367-Y390 HydrophobicContact CB-CE2 3.65Å; K367-Y390 HydrophobicContact CD-CE2 4.05Å; K367-Y390 HydrophobicContact CG-CD2 4.39Å; K367-Y390 HydrophobicContact CG-CE2 3.64Å; I368-Y390 CarbonylContact O-C 3.57Å; I368-Y390 WeakPolarHBondContact O-CA 3.4Å; I368-Y390 PolarHBondContact O-N 3.07Å; Y390-Q392 PolarHBondContact O-N 3.01Å
391	L	94.4	Very high	89	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	19%	0.193	C	C	.	.			trans	-58.3	124.7	174.9	-60.2	176.7	0	0	0	109.8	I368 S369 I371 L386 L410 N413 R414 I415	I368-L391 HydrophobicContact CG2-CD2 3.94Å; I368-L391 PolarHBondContact O-N 3.29Å; S369-L391 WeakPolarHBondContact O-CA 3.45Å; I371-L391 HydrophobicContact CD1-CD1 4.38Å; I371-L391 HydrophobicContact CG1-CD1 3.93Å; I371-L391 HydrophobicContact CG1-CD2 3.93Å; L386-L391 HydrophobicContact CB-CD1 4.18Å; L386-L391 HydrophobicContact CD1-CD1 4.37Å; L391-L410 HydrophobicContact CD1-CD2 3.52Å; L391-N413 HydrophobicContact CB-CB 4.24Å; L391-N413 WeakPolarHBondContact CB-OD1 3.18Å; L391-N413 WeakPolarHBondContact CG-OD1 3.28Å; L391-N413 PolarHBondContact N-OD1 3.45Å; L391-R414 CarbonylContact O-C 3.53Å; L391-R414 VanDerWaalsContact O-CA 3.26Å; L391-R414 WeakPolarHBondContact O-CA 3.35Å; L391-R414 WeakPolarHBondContact O-CB 3.13Å; L391-R414 PolarHBondContact O-N 3.3Å; L391-I415 HydrophobicContact CB-CD1 4.24Å; L391-I415 HydrophobicContact CB-CG1 3.89Å; L391-I415 WeakPolarHBondContact O-CG1 3.33Å; L391-I415 PolarHBondContact O-N 2.96Å; L391-I415 VanDerWaalsContact O-N 3.07Å
392	Q	93.3	Very high	89.1	Confident	111 Å²	111	40.4 Å²	40.4	52%	0.519	19%	0.193	S	C	.	.			trans	-109.7	-32.8	-179.8	-76.9	163.8	75.3	0	0	113	Y390 R414 I415 A416	Y390-Q392 PolarHBondContact O-N 3.01Å; Q392-R414 HydrophobicContact CG-CB 4.02Å; Q392-I415 WeakPolarHBondContact O-CA 3.12Å; Q392-A416 PolarHBondContact O-N 2.67Å
393	V	93.9	Very high	89.1	Confident	31 Å²	31	40.5 Å²	40.5	19%	0.188	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	140.2	-179	-175.7	0	0	0	0	108.9	Y395 V417 Q419	V393-Y395 HydrophobicContact CB-CD2 4.41Å; V393-Y395 HydrophobicContact CB-CE2 3.82Å; V393-Y395 HydrophobicContact CG1-CD1 4.21Å; V393-Y395 HydrophobicContact CG1-CD2 4.23Å; V393-Y395 HydrophobicContact CG1-CE1 3.92Å; V393-Y395 HydrophobicContact CG1-CE2 3.95Å; V393-Y395 HydrophobicContact CG1-CG 4.35Å; V393-V417 VanDerWaalsContact CA-O 3.25Å; V393-V417 WeakPolarHBondContact CA-O 3.35Å; V393-V417 HydrophobicContact CG1-CB 4.39Å; V393-V417 HydrophobicContact CG1-CG1 4.42Å; V393-V417 HydrophobicContact CG2-CB 4.37Å; V393-Q419 HydrophobicContact CG1-CG 4.45Å
394	I	94.3	Very high	89.2	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	113.7	164.8	-51.4	179.9	0	0	0	107.8	I371 L399 L410 I415 V417 I418 Q419 A422 F423 L434	I371-I394 HydrophobicContact CD1-CG2 4.21Å; I394-L399 HydrophobicContact CG2-CD1 3.84Å; I394-L410 HydrophobicContact CD1-CD1 3.68Å; I394-I415 HydrophobicContact CD1-CD1 4.24Å; I394-I415 HydrophobicContact CD1-CG2 4.36Å; I394-I415 HydrophobicContact CG1-CD1 4.28Å; I394-I415 HydrophobicContact CG1-CG2 4.09Å; I394-V417 PolarHBondContact N-O 3.36Å; I394-I418 HydrophobicContact CB-CG2 4.31Å; I394-I418 HydrophobicContact CD1-CD1 3.96Å; I394-I418 HydrophobicContact CD1-CG1 3.88Å; I394-I418 HydrophobicContact CD1-CG2 4.47Å; I394-I418 HydrophobicContact CG1-CG1 4.29Å; I394-Q419 WeakPolarHBondContact O-CB 3.2Å; I394-Q419 WeakPolarHBondContact O-CG 3.22Å; I394-Q419 PolarHBondContact O-N 3.24Å; I394-A422 HydrophobicContact CG2-CB 4.01Å; I394-F423 HydrophobicContact CD1-CE1 4.06Å; I394-F423 HydrophobicContact CD1-CZ 3.79Å; I394-F423 HydrophobicContact CG2-CE1 4.39Å; I394-L434 HydrophobicContact CD1-CD2 4.38Å
395	Y	92.3	Very high	89.2	Confident	88 Å²	88	42.3 Å²	42.3	35%	0.345	22%	0.215	S	C	.	.			trans	-84.9	149.1	-179.6	-65	-86.4	0	0	0	111.7	V393 T397 D398	V393-Y395 HydrophobicContact CB-CD2 4.41Å; V393-Y395 HydrophobicContact CB-CE2 3.82Å; V393-Y395 HydrophobicContact CG1-CD1 4.21Å; V393-Y395 HydrophobicContact CG1-CD2 4.23Å; V393-Y395 HydrophobicContact CG1-CE1 3.92Å; V393-Y395 HydrophobicContact CG1-CE2 3.95Å; V393-Y395 HydrophobicContact CG1-CG 4.35Å; Y395-T397 PolarHBondContact O-N 2.87Å; Y395-D398 WeakPolarHBondContact CB-OD2 3.48Å; Y395-D398 PolarHBondContact N-OD2 2.95Å; Y395-D398 WeakPolarHBondContact O-CB 3.21Å; Y395-D398 PolarHBondContact O-N 3.09Å
396	R	90.2	Very high	89.2	Confident	138 Å²	138	43.3 Å²	43.3	52%	0.521	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-25.3	178.5	-170	176.6	-178	161.6	-0.6	113.2	T400 Q419 E420	R396-T400 WeakPolarHBondContact O-CG2 3.04Å; R396-Q419 HydrophobicContact CB-CB 4.34Å; R396-E420 WeakPolarHBondContact CD-O 3.44Å
397	T	88.2	Confident	89.2	Confident	90 Å²	90	43.4 Å²	43.4	55%	0.552	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.7	-11.3	177.8	48.2	0	0	0	0	114.8	Y395	Y395-T397 PolarHBondContact O-N 2.87Å
398	D	88.1	Confident	89.5	Confident	1 Å²	1	42.9 Å²	42.9	1%	0.005	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-44.3	-174.5	-78.6	-31.2	0	0	0	112.1	I371 S372 Y395 Y402	I371-D398 HydrophobicContact CB-CB 3.81Å; I371-D398 HydrophobicContact CD1-CB 4.45Å; I371-D398 HydrophobicContact CG2-CB 4.07Å; S372-D398 VanDerWaalsContact CB-OD1 3.31Å; S372-D398 WeakPolarHBondContact CB-OD1 3.15Å; S372-D398 PolarHBondContact N-OD1 3.43Å; S372-D398 PolarHBondContact OG-OD1 3.34Å; Y395-D398 WeakPolarHBondContact CB-OD2 3.48Å; Y395-D398 PolarHBondContact N-OD2 2.95Å; Y395-D398 WeakPolarHBondContact O-CB 3.21Å; Y395-D398 PolarHBondContact O-N 3.09Å; D398-Y402 WeakPolarHBondContact O-CE2 3.23Å
399	L	89.6	Confident	89.7	Confident	1 Å²	1	41.8 Å²	41.8	1%	0.005	21%	0.207	C	C	.	.	S	Bend	trans	-109	9.1	-166	-64.2	168.6	0	0	0	113.9	I371 I394 E401 Y402 L408 F423 L426	I371-L399 HydrophobicContact CD1-CD1 4.39Å; I371-L399 HydrophobicContact CD1-CD2 4.36Å; I371-L399 HydrophobicContact CD1-CG 4.45Å; I371-L399 HydrophobicContact CG2-CD2 4.24Å; I394-L399 HydrophobicContact CG2-CD1 3.84Å; L399-E401 VanDerWaalsContact C-N 3.29Å; L399-E401 PolarHBondContact O-N 2.89Å; L399-Y402 HydrophobicContact CD2-CD1 4.4Å; L399-Y402 HydrophobicContact CD2-CD2 4.28Å; L399-Y402 HydrophobicContact CD2-CG 4.16Å; L399-Y402 WeakPolarHBondContact O-CB 3.37Å; L399-Y402 PolarHBondContact O-N 3Å; L399-Y402 VanDerWaalsContact O-N 3.15Å; L399-L408 HydrophobicContact CD1-CD2 3.94Å; L399-L408 HydrophobicContact CD2-CD2 4.47Å; L399-F423 HydrophobicContact CD1-CD1 3.76Å; L399-F423 HydrophobicContact CD1-CE1 3.63Å; L399-L426 HydrophobicContact CB-CD1 4.47Å; L399-L426 HydrophobicContact CB-CD2 4.37Å; L399-L426 HydrophobicContact CD1-CD1 4.23Å
400	T	85.1	Confident	89.8	Confident	56 Å²	56	41.6 Å²	41.6	34%	0.344	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-33.2	-175.9	53.3	0	0	0	0	114.5	R396 N425	R396-T400 WeakPolarHBondContact O-CG2 3.04Å; T400-N425 PolarHBondContact O-ND2 2.67Å
401	E	82.5	Confident	89.6	Confident	114 Å²	114	37.5 Å²	37.5	53%	0.533	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.6	-0	-177.5	-70.3	162.9	-124.6	0	0	113.2	K377 L399	K377-E401 WeakPolarHBondContact CD-OE1 3.36Å; K377-E401 VanDerWaalsContact CD-OE2 3.22Å; K377-E401 WeakPolarHBondContact CD-OE2 3.26Å; K377-E401 IonicContact NZ-OE1 3.73Å; K377-E401 PolarHBondContact NZ-OE1 2.99Å; K377-E401 IonicContact NZ-OE2 3.55Å; L399-E401 VanDerWaalsContact C-N 3.29Å; L399-E401 PolarHBondContact O-N 2.89Å
402	Y	87.3	Confident	89.2	Confident	4 Å²	4	41.8 Å²	41.8	2%	0.016	21%	0.214	C	C	.	.			trans	-101.3	25.3	-166.2	-68.8	-108.2	0	0	0	113.6	P378 P381 L384 D398 L399 S404 L405 L426	P378-Y402 WeakPolarHBondContact CD-OH 3.13Å; P378-Y402 HydrophobicContact CG-CE1 3.77Å; P381-Y402 HydrophobicContact CG-CD1 3.36Å; P381-Y402 HydrophobicContact CG-CE1 3.78Å; P381-Y402 HydrophobicContact CG-CG 4.26Å; L384-Y402 HydrophobicContact CD2-CD1 4.02Å; L384-Y402 HydrophobicContact CD2-CE1 3.73Å; D398-Y402 WeakPolarHBondContact O-CE2 3.23Å; L399-Y402 HydrophobicContact CD2-CD1 4.4Å; L399-Y402 HydrophobicContact CD2-CD2 4.28Å; L399-Y402 HydrophobicContact CD2-CG 4.16Å; L399-Y402 WeakPolarHBondContact O-CB 3.37Å; L399-Y402 PolarHBondContact O-N 3Å; L399-Y402 VanDerWaalsContact O-N 3.15Å; Y402-S404 PolarHBondContact O-N 3.33Å; Y402-L405 HydrophobicContact CD1-CD1 4.02Å; Y402-L405 HydrophobicContact CD1-CG 4.38Å; Y402-L405 HydrophobicContact CG-CD1 4.34Å; Y402-L405 WeakPolarHBondContact O-CB 3.4Å; Y402-L405 WeakPolarHBondContact O-CG 3.22Å; Y402-L405 PolarHBondContact O-N 3.18Å; Y402-L426 VanDerWaalsContact O-CD2 3.29Å; Y402-L426 WeakPolarHBondContact O-CD2 3.22Å
403	S	86.4	Confident	89.1	Confident	62 Å²	62	37 Å²	37	43%	0.434	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63	-14.4	-172.7	57.7	0	0	0	0	116	N425 S428	S403-N425 WeakPolarHBondContact CA-O 3.28Å; S403-N425 WeakPolarHBondContact CB-O 3.49Å; S403-S428 WeakPolarHBondContact O-CB 3.41Å; S403-S428 PolarHBondContact O-OG 2.94Å
404	S	87.1	Confident	89.1	Confident	41 Å²	41	40.9 Å²	40.9	29%	0.287	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84	-1.9	173.5	54.2	0	0	0	0	114.7	S380 P381 K382 Y402	S380-S404 WeakPolarHBondContact CA-OG 3.16Å; P381-S404 CarbonylContact O-C 3.08Å; P381-S404 WeakPolarHBondContact O-CB 3.45Å; P381-S404 PolarHBondContact O-OG 2.84Å; K382-S404 WeakPolarHBondContact CA-O 3.45Å; Y402-S404 PolarHBondContact O-N 3.33Å
405	L	90.1	Very high	89.2	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	20%	0.203	C	C	.	.			trans	-64.9	136.7	179.2	-74.5	179.3	0	0	0	112.1	P381 L384 Y402 L408 L426 S428 L429	P381-L405 HydrophobicContact CB-CD2 3.94Å; P381-L405 HydrophobicContact CG-CD2 3.98Å; P381-L405 HydrophobicContact CG-CG 4.43Å; P381-L405 PolarHBondContact O-N 2.98Å; L384-L405 HydrophobicContact CB-CD1 4.43Å; L384-L405 HydrophobicContact CB-CD2 3.82Å; Y402-L405 HydrophobicContact CD1-CD1 4.02Å; Y402-L405 HydrophobicContact CD1-CG 4.38Å; Y402-L405 HydrophobicContact CG-CD1 4.34Å; Y402-L405 WeakPolarHBondContact O-CB 3.4Å; Y402-L405 WeakPolarHBondContact O-CG 3.22Å; Y402-L405 PolarHBondContact O-N 3.18Å; L405-L408 HydrophobicContact CD1-CB 4.38Å; L405-L408 HydrophobicContact CD1-CD1 4.35Å; L405-L426 HydrophobicContact CD1-CD2 4.16Å; L405-S428 CarbonylContact O-C 3.04Å; L405-S428 WeakPolarHBondContact O-CB 3.2Å; L405-L429 HydrophobicContact CB-CD1 3.73Å; L405-L429 VanDerWaalsContact O-CA 3.22Å; L405-L429 WeakPolarHBondContact O-CA 3.42Å; L405-L429 PolarHBondContact O-N 3.08Å; L405-L429 VanDerWaalsContact O-N 3.09Å
406	D	86.3	Confident	89.2	Confident	26 Å²	26	39.1 Å²	39.1	14%	0.139	21%	0.206	C	C	.	.	S	Bend	trans	-111.5	-35.4	177.2	-174.2	50.8	0	0	0	109.2	K382 R430 R431	K382-D406 HydrophobicContact CD-CB 4.32Å; K382-D406 WeakPolarHBondContact CE-OD2 3.41Å; K382-D406 HydrophobicContact CG-CB 3.56Å; K382-D406 WeakPolarHBondContact O-CB 3.46Å; K382-D406 PolarHBondContact O-N 2.76Å; D406-R430 PolarHBondContact O-N 3.03Å; D406-R430 VanDerWaalsContact OD1-CD 3.23Å; D406-R430 WeakPolarHBondContact OD1-CD 3.43Å; D406-R430 IonicContact OD1-NE 2.61Å; D406-R430 PolarHBondContact OD1-NE 3.13Å; D406-R431 PolarHBondContact O-N 3.27Å; D406-R431 VanDerWaalsContact O-N 3.14Å
407	L	88.6	Confident	89.4	Confident	1 Å²	1	36.3 Å²	36.3	1%	0.005	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	138.8	169.7	171.6	151.1	0	0	0	112.4	E241 K382 K383 L384 Y385 H409 R431 Y433	E241-L407 HydrophobicContact CG-CD1 3.46Å; E241-L407 VanDerWaalsContact CG-CD1 3.46Å; E241-L407 WeakPolarHBondContact OE1-CD1 3.48Å; K382-L407 PolarHBondContact O-N 3.34Å; K383-L407 WeakPolarHBondContact CA-O 3.38Å; K383-L407 HydrophobicContact CB-CB 4.42Å; K383-L407 HydrophobicContact CB-CD2 4.28Å; K383-L407 HydrophobicContact CD-CB 4.24Å; K383-L407 HydrophobicContact CG-CB 4.17Å; L384-L407 PolarHBondContact N-O 3.13Å; L384-L407 VanDerWaalsContact N-O 3.11Å; Y385-L407 HydrophobicContact CD1-CD2 4.09Å; Y385-L407 HydrophobicContact CE1-CD1 4.34Å; Y385-L407 HydrophobicContact CE1-CD2 3.71Å; Y385-L407 HydrophobicContact CE2-CD2 4.35Å; L407-H409 HydrophobicContact CD2-CB 3.96Å; L407-R431 WeakPolarHBondContact CA-O 3.32Å; L407-R431 HydrophobicContact CB-CB 4.21Å; L407-R431 HydrophobicContact CD1-CB 4.23Å; L407-R431 HydrophobicContact CG-CB 4.28Å; L407-Y433 HydrophobicContact CD1-CD2 4.41Å; L407-Y433 HydrophobicContact CD1-CE2 3.8Å; L407-Y433 HydrophobicContact CG-CE2 4.42Å
408	L	93.1	Very high	89.7	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	117.5	169.8	177.7	56.6	0	0	0	109.3	L384 L399 L405 L410 F423 L426 L429 R431 L432 Y433	L384-L408 HydrophobicContact CB-CD1 4.14Å; L384-L408 HydrophobicContact CD2-CD1 3.89Å; L384-L408 HydrophobicContact CG-CD1 4.12Å; L399-L408 HydrophobicContact CD1-CD2 3.94Å; L399-L408 HydrophobicContact CD2-CD2 4.47Å; L405-L408 HydrophobicContact CD1-CB 4.38Å; L405-L408 HydrophobicContact CD1-CD1 4.35Å; L408-L410 HydrophobicContact CD1-CD1 4.17Å; L408-L410 HydrophobicContact CD1-CD2 4.38Å; L408-L410 HydrophobicContact CD1-CG 4.02Å; L408-L410 HydrophobicContact CD2-CD1 3.86Å; L408-L410 HydrophobicContact CG-CD1 3.82Å; L408-L410 HydrophobicContact CG-CG 4.03Å; L408-F423 HydrophobicContact CD2-CE1 4.16Å; L408-L426 HydrophobicContact CD2-CD1 3.94Å; L408-L429 HydrophobicContact CB-CD1 3.79Å; L408-L429 HydrophobicContact CB-CD2 4.18Å; L408-R431 PolarHBondContact N-O 2.98Å; L408-L432 HydrophobicContact CB-CD1 4.15Å; L408-L432 HydrophobicContact CD2-CD1 4.07Å; L408-L432 HydrophobicContact CG-CD1 4.08Å; L408-Y433 PolarHBondContact O-N 3.34Å; L408-Y433 VanDerWaalsContact O-N 3.08Å
409	H	88.8	Confident	89.9	Confident	23 Å²	23	35.8 Å²	35.8	11%	0.106	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	106	-177.4	-167.7	4.2	0	0	0	111.1	L384 Y385 L386 T387 L407 Y433	L384-H409 PolarHBondContact O-N 2.82Å; Y385-H409 HydrophobicContact CD1-CB 3.94Å; Y385-H409 AromaticContact CD1-CD2 3.88Å; L386-H409 PolarHBondContact N-O 3.46Å; T387-H409 HydrophobicContact CG2-CB 4.25Å; T387-H409 VanDerWaalsContact CG2-CE1 3.41Å; T387-H409 WeakPolarHBondContact CG2-CE1 3.43Å; T387-H409 VanDerWaalsContact CG2-CG 3.41Å; T387-H409 VanDerWaalsContact CG2-ND1 3.31Å; T387-H409 WeakPolarHBondContact CG2-ND1 3.14Å; L407-H409 HydrophobicContact CD2-CB 3.96Å; H409-Y433 HydrophobicContact CB-CD2 4.19Å; H409-Y433 AromaticContact CE1-CG 3.86Å; H409-Y433 WeakPolarHBondContact ND1-CB 3.26Å; H409-Y433 AromaticContact ND1-CG 3.64Å
410	L	93.6	Very high	89.9	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	22%	0.224	C	C	.	.			trans	-114.7	13.8	-175.4	-68.5	163.7	0	0	0	112	I371 L386 L391 I394 L408 N413 I415 Y433 L434 N437	I371-L410 HydrophobicContact CD1-CD2 3.99Å; L386-L410 HydrophobicContact CB-CD2 3.96Å; L386-L410 HydrophobicContact CD1-CD2 3.88Å; L391-L410 HydrophobicContact CD1-CD2 3.52Å; I394-L410 HydrophobicContact CD1-CD1 3.68Å; L408-L410 HydrophobicContact CD1-CD1 4.17Å; L408-L410 HydrophobicContact CD1-CD2 4.38Å; L408-L410 HydrophobicContact CD1-CG 4.02Å; L408-L410 HydrophobicContact CD2-CD1 3.86Å; L408-L410 HydrophobicContact CG-CD1 3.82Å; L408-L410 HydrophobicContact CG-CG 4.03Å; L410-N413 WeakPolarHBondContact O-CB 3.31Å; L410-N413 PolarHBondContact O-ND2 2.71Å; L410-I415 HydrophobicContact CB-CD1 3.89Å; L410-I415 HydrophobicContact CD2-CD1 4.36Å; L410-Y433 CarbonylContact C-O 3.5Å; L410-Y433 WeakPolarHBondContact CA-O 3.21Å; L410-Y433 WeakPolarHBondContact CB-O 3.42Å; L410-Y433 PolarHBondContact N-O 2.79Å; L410-L434 HydrophobicContact CB-CD2 4.02Å; L410-L434 HydrophobicContact CD1-CD2 3.96Å; L410-N437 PolarHBondContact O-ND2 2.83Å
411	G	87.8	Confident	90	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	21%	0.209	C	C	.	.			trans	-66.8	158.5	-175.3	0	0	0	0	0	113.7	T387 S388 N413 Y433 N435	T387-G411 WeakPolarHBondContact CA-O 3.47Å; T387-G411 WeakPolarHBondContact CB-O 3.09Å; S388-G411 PolarHBondContact N-O 3.41Å; G411-N413 PolarHBondContact O-N 3.43Å; G411-N413 PolarHBondContact O-ND2 3.17Å; G411-N413 VanDerWaalsContact O-ND2 3.12Å; G411-Y433 PolarHBondContact N-O 3.22Å; G411-N435 CarbonylContact C-O 3.4Å; G411-N435 WeakPolarHBondContact CA-O 3.25Å; G411-N435 WeakPolarHBondContact CA-OD1 3.42Å
412	N	85.8	Confident	90.5	Very high	91 Å²	91	34.1 Å²	34.1	49%	0.487	19%	0.185	S	C	.	.	S	Bend	trans	52	50.5	-178.3	-65.8	-40.8	0	0	0	112.5	S388 N435 G436	S388-N412 WeakPolarHBondContact CA-O 3.42Å; S388-N412 PolarHBondContact N-O 3.27Å; S388-N412 VanDerWaalsContact N-O 3.13Å; N412-N435 PolarHBondContact N-O 3.05Å; N412-G436 WeakPolarHBondContact CA-O 3.49Å; N412-G436 PolarHBondContact N-O 3.45Å
413	N	91.4	Very high	90.8	Very high	9 Å²	9	33.9 Å²	33.9	5%	0.048	18%	0.184	C	C	.	.	S	Bend	trans	-114.9	-147.1	175.7	-90.9	-90.1	0	0	0	109.5	L386 N389 L391 L410 G411 I415 G436 N437	L386-N413 PolarHBondContact O-ND2 2.86Å; N389-N413 WeakPolarHBondContact CA-OD1 3.41Å; N389-N413 WeakPolarHBondContact CB-OD1 3.17Å; N389-N413 PolarHBondContact N-OD1 3.21Å; N389-N413 PolarHBondContact O-OD1 3.03Å; L391-N413 HydrophobicContact CB-CB 4.24Å; L391-N413 WeakPolarHBondContact CB-OD1 3.18Å; L391-N413 WeakPolarHBondContact CG-OD1 3.28Å; L391-N413 PolarHBondContact N-OD1 3.45Å; L410-N413 WeakPolarHBondContact O-CB 3.31Å; L410-N413 PolarHBondContact O-ND2 2.71Å; G411-N413 PolarHBondContact O-N 3.43Å; G411-N413 PolarHBondContact O-ND2 3.17Å; G411-N413 VanDerWaalsContact O-ND2 3.12Å; N413-I415 HydrophobicContact CB-CD1 4.12Å; N413-I415 HydrophobicContact CB-CG1 4.01Å; N413-G436 PolarHBondContact N-O 2.79Å; N413-N437 WeakPolarHBondContact CA-OD1 3.49Å; N413-N437 WeakPolarHBondContact CB-OD1 3.12Å; N413-N437 PolarHBondContact N-OD1 3.39Å
414	R	93.9	Very high	91	Very high	114 Å²	114	33.1 Å²	33.1	43%	0.43	18%	0.177	S	C	.	.			trans	-132.8	25.2	176.8	-58.9	-173.4	173.9	179.4	-2.1	111.3	L391 Q392 A416 N437 Y438	L391-R414 CarbonylContact O-C 3.53Å; L391-R414 VanDerWaalsContact O-CA 3.26Å; L391-R414 WeakPolarHBondContact O-CA 3.35Å; L391-R414 WeakPolarHBondContact O-CB 3.13Å; L391-R414 PolarHBondContact O-N 3.3Å; Q392-R414 HydrophobicContact CG-CB 4.02Å; R414-A416 PolarHBondContact O-N 2.97Å; R414-A416 VanDerWaalsContact O-N 3.13Å; R414-N437 PolarHBondContact N-OD1 3.06Å; R414-Y438 HydrophobicContact CB-CD2 3.96Å; R414-Y438 HydrophobicContact CB-CE2 3.8Å; R414-Y438 HydrophobicContact CG-CE2 3.89Å
415	I	96.1	Very high	91.1	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	18%	0.181	C	C	.	.			trans	-70.4	112.7	-167.9	-58.5	166.5	0	0	0	108.2	L391 Q392 I394 L410 N413 I418 L434 N437 Y438 L439	L391-I415 HydrophobicContact CB-CD1 4.24Å; L391-I415 HydrophobicContact CB-CG1 3.89Å; L391-I415 WeakPolarHBondContact O-CG1 3.33Å; L391-I415 PolarHBondContact O-N 2.96Å; L391-I415 VanDerWaalsContact O-N 3.07Å; Q392-I415 WeakPolarHBondContact O-CA 3.12Å; I394-I415 HydrophobicContact CD1-CD1 4.24Å; I394-I415 HydrophobicContact CD1-CG2 4.36Å; I394-I415 HydrophobicContact CG1-CD1 4.28Å; I394-I415 HydrophobicContact CG1-CG2 4.09Å; L410-I415 HydrophobicContact CB-CD1 3.89Å; L410-I415 HydrophobicContact CD2-CD1 4.36Å; N413-I415 HydrophobicContact CB-CD1 4.12Å; N413-I415 HydrophobicContact CB-CG1 4.01Å; I415-I418 HydrophobicContact CG2-CG1 4.13Å; I415-L434 HydrophobicContact CD1-CD2 4.36Å; I415-N437 HydrophobicContact CB-CB 4.28Å; I415-N437 WeakPolarHBondContact CB-OD1 3.38Å; I415-N437 WeakPolarHBondContact CG1-OD1 3.24Å; I415-N437 PolarHBondContact N-OD1 2.93Å; I415-Y438 CarbonylContact O-C 3.59Å; I415-Y438 VanDerWaalsContact O-C 3.28Å; I415-Y438 WeakPolarHBondContact O-CA 3.26Å; I415-Y438 PolarHBondContact O-N 2.97Å; I415-L439 HydrophobicContact CG2-CD2 4.13Å; I415-L439 PolarHBondContact O-N 2.92Å
416	A	94	Very high	91.2	Very high	51 Å²	51	34.4 Å²	34.4	42%	0.421	18%	0.181	S	C	.	.			trans	-106.6	-24.5	175.9	0	0	0	0	0	112	Q392 R414 Y438	Q392-A416 PolarHBondContact O-N 2.67Å; R414-A416 PolarHBondContact O-N 2.97Å; R414-A416 VanDerWaalsContact O-N 3.13Å; A416-Y438 WeakPolarHBondContact CA-O 3.36Å
417	V	93.3	Very high	91.4	Very high	79 Å²	79	36.4 Å²	36.4	48%	0.479	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	127.4	-177.9	-178.9	0	0	0	0	110.2	V393 I394	V393-V417 VanDerWaalsContact CA-O 3.25Å; V393-V417 WeakPolarHBondContact CA-O 3.35Å; V393-V417 HydrophobicContact CG1-CB 4.39Å; V393-V417 HydrophobicContact CG1-CG1 4.42Å; V393-V417 HydrophobicContact CG2-CB 4.37Å; I394-V417 PolarHBondContact N-O 3.36Å
418	I	94.6	Very high	91.4	Very high	5 Å²	5	38.8 Å²	38.8	3%	0.026	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	146.7	160.9	-56.4	-174.3	0	0	0	105.8	I394 I415 A422 F423 L434 L439 Y443 M446	I394-I418 HydrophobicContact CB-CG2 4.31Å; I394-I418 HydrophobicContact CD1-CD1 3.96Å; I394-I418 HydrophobicContact CD1-CG1 3.88Å; I394-I418 HydrophobicContact CD1-CG2 4.47Å; I394-I418 HydrophobicContact CG1-CG1 4.29Å; I415-I418 HydrophobicContact CG2-CG1 4.13Å; I418-A422 HydrophobicContact CG2-CB 3.97Å; I418-F423 HydrophobicContact CD1-CE2 3.97Å; I418-F423 HydrophobicContact CD1-CZ 3.99Å; I418-F423 HydrophobicContact CG2-CE2 4.12Å; I418-F423 HydrophobicContact CG2-CZ 4.23Å; I418-L434 HydrophobicContact CD1-CD1 4.01Å; I418-L434 HydrophobicContact CD1-CD2 4.25Å; I418-L439 HydrophobicContact CD1-CD2 4.26Å; I418-L439 HydrophobicContact CG1-CD2 4.1Å; I418-Y443 PolarHBondContact O-OH 3.48Å; I418-M446 HydrophobicContact CB-CE 4.47Å; I418-M446 HydrophobicContact CB-CG 4.1Å; I418-M446 HydrophobicContact CD1-CG 4.07Å; I418-M446 HydrophobicContact CD1-SD 3.92Å; I418-M446 HydrophobicContact CG2-CG 4.09Å
419	Q	92.5	Very high	91.4	Very high	75 Å²	75	38.8 Å²	38.8	35%	0.35	21%	0.211	S	C	.	.	P	Polyproline II helix	trans	-87.6	148.4	172.8	-72.8	-166.8	-27.5	0	0	111.6	V393 I394 R396 G421 A422	V393-Q419 HydrophobicContact CG1-CG 4.45Å; I394-Q419 WeakPolarHBondContact O-CB 3.2Å; I394-Q419 WeakPolarHBondContact O-CG 3.22Å; I394-Q419 PolarHBondContact O-N 3.24Å; R396-Q419 HydrophobicContact CB-CB 4.34Å; Q419-G421 PolarHBondContact O-N 3.19Å; Q419-A422 HydrophobicContact CB-CB 4.48Å; Q419-A422 WeakPolarHBondContact O-CB 3.45Å; Q419-A422 PolarHBondContact O-N 3.08Å
420	E	89.3	Confident	91.4	Very high	129 Å²	129	42.9 Å²	42.9	60%	0.603	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.4	124.2	175.5	-60.4	-176.5	-175.3	0	0	111.7	R396 A422 Y443	R396-E420 WeakPolarHBondContact CD-O 3.44Å; E420-A422 VanDerWaalsContact C-N 3.29Å; E420-A422 PolarHBondContact O-N 3.01Å; E420-Y443 HydrophobicContact CG-CE2 3.99Å
421	G	88.3	Confident	91.1	Very high	3 Å²	3	44.7 Å²	44.7	3%	0.031	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	66.8	21.4	-178	0	0	0	0	0	115.2	Q419 F423 T424 S445	Q419-G421 PolarHBondContact O-N 3.19Å; G421-F423 PolarHBondContact O-N 2.81Å; G421-F423 VanDerWaalsContact O-N 3.17Å; G421-T424 WeakPolarHBondContact O-CG2 3.45Å; G421-T424 PolarHBondContact O-N 3.37Å; G421-T424 PolarHBondContact O-OG1 2.81Å; G421-S445 PolarHBondContact N-O 2.84Å
422	A	92.3	Very high	91.4	Very high	3 Å²	3	44.7 Å²	44.7	3%	0.025	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-18.7	174.7	0	0	0	0	0	113.9	I394 I418 Q419 E420	I394-A422 HydrophobicContact CG2-CB 4.01Å; I418-A422 HydrophobicContact CG2-CB 3.97Å; Q419-A422 HydrophobicContact CB-CB 4.48Å; Q419-A422 WeakPolarHBondContact O-CB 3.45Å; Q419-A422 PolarHBondContact O-N 3.08Å; E420-A422 VanDerWaalsContact C-N 3.29Å; E420-A422 PolarHBondContact O-N 3.01Å
423	F	94.1	Very high	91.6	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.9	5.2	177.1	-55.9	-41.7	0	0	0	114.6	I394 L399 L408 I418 G421 N425 L426 L432 M446 F447 D448 L450	I394-F423 HydrophobicContact CD1-CE1 4.06Å; I394-F423 HydrophobicContact CD1-CZ 3.79Å; I394-F423 HydrophobicContact CG2-CE1 4.39Å; L399-F423 HydrophobicContact CD1-CD1 3.76Å; L399-F423 HydrophobicContact CD1-CE1 3.63Å; L408-F423 HydrophobicContact CD2-CE1 4.16Å; I418-F423 HydrophobicContact CD1-CE2 3.97Å; I418-F423 HydrophobicContact CD1-CZ 3.99Å; I418-F423 HydrophobicContact CG2-CE2 4.12Å; I418-F423 HydrophobicContact CG2-CZ 4.23Å; G421-F423 PolarHBondContact O-N 2.81Å; G421-F423 VanDerWaalsContact O-N 3.17Å; F423-N425 PolarHBondContact O-N 3.19Å; F423-L426 HydrophobicContact CB-CD1 4.21Å; F423-L426 HydrophobicContact CD1-CD1 3.67Å; F423-L426 HydrophobicContact CE1-CD1 4.49Å; F423-L426 HydrophobicContact CG-CD1 4.29Å; F423-L426 WeakPolarHBondContact O-CB 3.5Å; F423-L426 PolarHBondContact O-N 3.1Å; F423-L432 HydrophobicContact CD2-CD2 4.46Å; F423-L432 HydrophobicContact CE2-CD2 4.03Å; F423-L432 HydrophobicContact CZ-CD2 4.33Å; F423-M446 WeakPolarHBondContact CD2-O 3.28Å; F423-F447 HydrophobicContact CD2-CD1 4.35Å; F423-F447 HydrophobicContact CE2-CD1 4.35Å; F423-D448 CarbonylContact C-O 3.32Å; F423-L450 HydrophobicContact CB-CD1 3.95Å; F423-L450 HydrophobicContact CB-CD2 3.95Å; F423-L450 HydrophobicContact CB-CG 3.79Å; F423-L450 HydrophobicContact CD2-CD1 3.71Å; F423-L450 HydrophobicContact CD2-CG 4.49Å; F423-L450 HydrophobicContact CG-CD1 4.06Å; F423-L450 HydrophobicContact CG-CG 4.42Å
424	T	90.7	Very high	91.8	Very high	46 Å²	46	40.4 Å²	40.4	28%	0.282	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.2	-31.3	-171.4	52.8	0	0	0	0	114.6	G421 D448	G421-T424 WeakPolarHBondContact O-CG2 3.45Å; G421-T424 PolarHBondContact O-N 3.37Å; G421-T424 PolarHBondContact O-OG1 2.81Å; T424-D448 VanDerWaalsContact CA-O 3.29Å; T424-D448 WeakPolarHBondContact CA-O 3.33Å; T424-D448 HydrophobicContact CG2-CB 4.06Å; T424-D448 PolarHBondContact N-O 2.88Å
425	N	88.9	Confident	91.6	Very high	67 Å²	67	35.5 Å²	35.5	36%	0.358	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.2	-7.6	-174.6	-64.5	18.2	0	0	0	112.7	T400 S403 F423 T427	T400-N425 PolarHBondContact O-ND2 2.67Å; S403-N425 WeakPolarHBondContact CA-O 3.28Å; S403-N425 WeakPolarHBondContact CB-O 3.49Å; F423-N425 PolarHBondContact O-N 3.19Å; N425-T427 PolarHBondContact O-N 3.01Å
426	L	91.8	Very high	91.1	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	20%	0.199	C	C	.	.			trans	-85.2	44.6	-173.6	-57.8	-171.8	0	0	0	112.6	L399 Y402 L405 L408 F423 S428 L429 L450	L399-L426 HydrophobicContact CB-CD1 4.47Å; L399-L426 HydrophobicContact CB-CD2 4.37Å; L399-L426 HydrophobicContact CD1-CD1 4.23Å; Y402-L426 VanDerWaalsContact O-CD2 3.29Å; Y402-L426 WeakPolarHBondContact O-CD2 3.22Å; L405-L426 HydrophobicContact CD1-CD2 4.16Å; L408-L426 HydrophobicContact CD2-CD1 3.94Å; F423-L426 HydrophobicContact CB-CD1 4.21Å; F423-L426 HydrophobicContact CD1-CD1 3.67Å; F423-L426 HydrophobicContact CE1-CD1 4.49Å; F423-L426 HydrophobicContact CG-CD1 4.29Å; F423-L426 WeakPolarHBondContact O-CB 3.5Å; F423-L426 PolarHBondContact O-N 3.1Å; L426-S428 PolarHBondContact O-N 3.42Å; L426-L429 HydrophobicContact CB-CB 4.16Å; L426-L429 HydrophobicContact CD1-CD2 4.22Å; L426-L429 VanDerWaalsContact O-CB 3.29Å; L426-L429 WeakPolarHBondContact O-CB 3.4Å; L426-L429 PolarHBondContact O-N 2.89Å; L426-L450 HydrophobicContact CB-CD2 3.75Å; L426-L450 HydrophobicContact CD1-CD2 4.48Å
427	T	89.6	Confident	91.1	Very high	69 Å²	69	34 Å²	34	42%	0.423	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-18.1	-172.2	56.4	0	0	0	0	114.6	N425 S452	N425-T427 PolarHBondContact O-N 3.01Å; T427-S452 VanDerWaalsContact O-CB 3.25Å; T427-S452 WeakPolarHBondContact O-CB 3.45Å; T427-S452 PolarHBondContact O-OG 2.81Å
428	S	89.9	Confident	91.2	Very high	51 Å²	51	36.3 Å²	36.3	36%	0.357	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.3	-6.8	178.4	-49.4	0	0	0	0	114	S403 L405 L426 R430	S403-S428 WeakPolarHBondContact O-CB 3.41Å; S403-S428 PolarHBondContact O-OG 2.94Å; L405-S428 CarbonylContact O-C 3.04Å; L405-S428 WeakPolarHBondContact O-CB 3.2Å; L426-S428 PolarHBondContact O-N 3.42Å; S428-R430 PolarHBondContact O-N 2.87Å
429	L	93.4	Very high	91.3	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	18%	0.18	C	C	.	.			trans	-71.4	127.9	-168.3	-165.6	76.6	0	0	0	111.5	L405 L408 L426 L432 L450 S452 L453	L405-L429 HydrophobicContact CB-CD1 3.73Å; L405-L429 VanDerWaalsContact O-CA 3.22Å; L405-L429 WeakPolarHBondContact O-CA 3.42Å; L405-L429 PolarHBondContact O-N 3.08Å; L405-L429 VanDerWaalsContact O-N 3.09Å; L408-L429 HydrophobicContact CB-CD1 3.79Å; L408-L429 HydrophobicContact CB-CD2 4.18Å; L426-L429 HydrophobicContact CB-CB 4.16Å; L426-L429 HydrophobicContact CD1-CD2 4.22Å; L426-L429 VanDerWaalsContact O-CB 3.29Å; L426-L429 WeakPolarHBondContact O-CB 3.4Å; L426-L429 PolarHBondContact O-N 2.89Å; L429-L432 HydrophobicContact CD2-CB 4.06Å; L429-L432 HydrophobicContact CD2-CD1 4.38Å; L429-L450 HydrophobicContact CB-CD2 3.94Å; L429-L450 HydrophobicContact CD2-CD2 3.57Å; L429-L450 HydrophobicContact CG-CD2 4.36Å; L429-S452 CarbonylContact O-C 3.52Å; L429-L453 HydrophobicContact CD2-CD1 4.07Å; L429-L453 HydrophobicContact CG-CD1 4.17Å; L429-L453 WeakPolarHBondContact O-CA 3.42Å; L429-L453 PolarHBondContact O-N 2.65Å
430	R	87.7	Confident	91.3	Very high	108 Å²	108	37 Å²	37	41%	0.408	18%	0.184	S	C	.	.			trans	-106.3	-32.4	178.6	-62.9	-177.2	-177.8	-84.3	-11.1	113.8	D406 S428 Q454 Y455	D406-R430 PolarHBondContact O-N 3.03Å; D406-R430 VanDerWaalsContact OD1-CD 3.23Å; D406-R430 WeakPolarHBondContact OD1-CD 3.43Å; D406-R430 IonicContact OD1-NE 2.61Å; D406-R430 PolarHBondContact OD1-NE 3.13Å; S428-R430 PolarHBondContact O-N 2.87Å; R430-Q454 PolarHBondContact O-N 3.26Å; R430-Y455 PolarHBondContact O-N 3.16Å
431	R	87	Confident	91.6	Very high	38 Å²	38	34.7 Å²	34.7	14%	0.143	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	118	-172.7	-69.8	172.5	166.7	158.7	-9.6	109.9	V239 E241 D406 L407 L408 Y433 Y455	V239-R431 PolarHBondContact O-NH2 2.64Å; E241-R431 WeakPolarHBondContact OE1-CD 3.32Å; E241-R431 IonicContact OE1-CZ 3.79Å; E241-R431 IonicContact OE1-NE 3.43Å; E241-R431 IonicContact OE1-NH1 2.9Å; E241-R431 PolarHBondContact OE1-NH1 3.05Å; D406-R431 PolarHBondContact O-N 3.27Å; D406-R431 VanDerWaalsContact O-N 3.14Å; L407-R431 WeakPolarHBondContact CA-O 3.32Å; L407-R431 HydrophobicContact CB-CB 4.21Å; L407-R431 HydrophobicContact CD1-CB 4.23Å; L407-R431 HydrophobicContact CG-CB 4.28Å; L408-R431 PolarHBondContact N-O 2.98Å; R431-Y433 HydrophobicContact CB-CE2 4.05Å; R431-Y455 HydrophobicContact CG-CD2 3.81Å; R431-Y455 HydrophobicContact CG-CG 4.34Å
432	L	94.8	Very high	91.9	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	120.4	176.7	178.3	56.7	0	0	0	109.8	L408 F423 L429 L434 F447 L450 L453 Y455 L456 Y457	L408-L432 HydrophobicContact CB-CD1 4.15Å; L408-L432 HydrophobicContact CD2-CD1 4.07Å; L408-L432 HydrophobicContact CG-CD1 4.08Å; F423-L432 HydrophobicContact CD2-CD2 4.46Å; F423-L432 HydrophobicContact CE2-CD2 4.03Å; F423-L432 HydrophobicContact CZ-CD2 4.33Å; L429-L432 HydrophobicContact CD2-CB 4.06Å; L429-L432 HydrophobicContact CD2-CD1 4.38Å; L432-L434 HydrophobicContact CD1-CD1 4.36Å; L432-L434 HydrophobicContact CD1-CG 4.16Å; L432-L434 HydrophobicContact CD2-CD1 3.97Å; L432-L434 HydrophobicContact CG-CD1 4.07Å; L432-L434 HydrophobicContact CG-CG 4.19Å; L432-F447 HydrophobicContact CD2-CD1 4.48Å; L432-F447 HydrophobicContact CD2-CE1 4.41Å; L432-L450 HydrophobicContact CD2-CD1 3.78Å; L432-L453 HydrophobicContact CB-CD1 3.64Å; L432-L453 HydrophobicContact CB-CD2 4.27Å; L432-Y455 PolarHBondContact N-O 3.4Å; L432-L456 HydrophobicContact CB-CD1 4.15Å; L432-L456 HydrophobicContact CD2-CD1 4Å; L432-L456 HydrophobicContact CG-CD1 4.01Å; L432-Y457 PolarHBondContact O-N 2.89Å
433	Y	90.6	Very high	91.9	Very high	11 Å²	11	36.7 Å²	36.7	4%	0.043	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	113	177.5	-61.1	-103	0	0	0	110.2	L407 L408 H409 L410 G411 R431 Y457	L407-Y433 HydrophobicContact CD1-CD2 4.41Å; L407-Y433 HydrophobicContact CD1-CE2 3.8Å; L407-Y433 HydrophobicContact CG-CE2 4.42Å; L408-Y433 PolarHBondContact O-N 3.34Å; L408-Y433 VanDerWaalsContact O-N 3.08Å; H409-Y433 HydrophobicContact CB-CD2 4.19Å; H409-Y433 AromaticContact CE1-CG 3.86Å; H409-Y433 WeakPolarHBondContact ND1-CB 3.26Å; H409-Y433 AromaticContact ND1-CG 3.64Å; L410-Y433 CarbonylContact C-O 3.5Å; L410-Y433 WeakPolarHBondContact CA-O 3.21Å; L410-Y433 WeakPolarHBondContact CB-O 3.42Å; L410-Y433 PolarHBondContact N-O 2.79Å; G411-Y433 PolarHBondContact N-O 3.22Å; R431-Y433 HydrophobicContact CB-CE2 4.05Å; Y433-Y457 HydrophobicContact CD1-CD1 4.32Å; Y433-Y457 AromaticContact CD1-CD2 3.34Å; Y433-Y457 HydrophobicContact CD1-CD2 3.34Å; Y433-Y457 AromaticContact CD1-CE2 3.89Å; Y433-Y457 HydrophobicContact CD1-CE2 3.89Å; Y433-Y457 AromaticContact CD1-CG 3.58Å; Y433-Y457 HydrophobicContact CD1-CG 3.58Å; Y433-Y457 HydrophobicContact CD2-CD2 4.36Å; Y433-Y457 HydrophobicContact CE1-CD1 4.21Å; Y433-Y457 AromaticContact CE1-CD2 3.3Å; Y433-Y457 HydrophobicContact CE1-CD2 3.3Å; Y433-Y457 HydrophobicContact CE1-CE1 4.23Å; Y433-Y457 AromaticContact CE1-CE2 3.31Å; Y433-Y457 HydrophobicContact CE1-CE2 3.31Å; Y433-Y457 AromaticContact CE1-CG 3.77Å; Y433-Y457 HydrophobicContact CE1-CG 3.77Å; Y433-Y457 AromaticContact CE1-CZ 3.8Å; Y433-Y457 HydrophobicContact CE2-CD2 4.33Å; Y433-Y457 HydrophobicContact CE2-CE2 4.26Å; Y433-Y457 AromaticContact CG-CD2 3.89Å; Y433-Y457 HydrophobicContact CG-CD2 3.89Å; Y433-Y457 HydrophobicContact CG-CG 4.37Å; Y433-Y457 AromaticContact CZ-CD2 3.82Å; Y433-Y457 AromaticContact CZ-CE2 3.52Å
434	L	94.8	Very high	91.7	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	20%	0.197	C	C	.	.			trans	-119.1	11.3	176.2	-73.3	165.6	0	0	0	111.5	I394 L410 I415 I418 L432 N437 L439 F447 Y457 L458 N461	I394-L434 HydrophobicContact CD1-CD2 4.38Å; L410-L434 HydrophobicContact CB-CD2 4.02Å; L410-L434 HydrophobicContact CD1-CD2 3.96Å; I415-L434 HydrophobicContact CD1-CD2 4.36Å; I418-L434 HydrophobicContact CD1-CD1 4.01Å; I418-L434 HydrophobicContact CD1-CD2 4.25Å; L432-L434 HydrophobicContact CD1-CD1 4.36Å; L432-L434 HydrophobicContact CD1-CG 4.16Å; L432-L434 HydrophobicContact CD2-CD1 3.97Å; L432-L434 HydrophobicContact CG-CD1 4.07Å; L432-L434 HydrophobicContact CG-CG 4.19Å; L434-N437 WeakPolarHBondContact O-CB 3.45Å; L434-N437 PolarHBondContact O-ND2 3.1Å; L434-L439 HydrophobicContact CB-CD1 4.31Å; L434-L439 HydrophobicContact CD1-CD1 4.41Å; L434-F447 HydrophobicContact CD1-CE1 4.22Å; L434-Y457 CarbonylContact C-O 3.51Å; L434-Y457 WeakPolarHBondContact CA-O 3.37Å; L434-Y457 PolarHBondContact N-O 3.32Å; L434-L458 HydrophobicContact CB-CD2 3.7Å; L434-L458 HydrophobicContact CD1-CD2 4.03Å; L434-N461 PolarHBondContact O-ND2 2.69Å
435	N	89.8	Confident	91.6	Very high	11 Å²	11	38.3 Å²	38.3	6%	0.059	19%	0.193	C	C	.	.			trans	-59.8	149.2	179.5	61.8	-17.6	0	0	0	113.7	G411 N412 N437 Y457 E459	G411-N435 CarbonylContact C-O 3.4Å; G411-N435 WeakPolarHBondContact CA-O 3.25Å; G411-N435 WeakPolarHBondContact CA-OD1 3.42Å; N412-N435 PolarHBondContact N-O 3.05Å; N435-N437 PolarHBondContact O-ND2 3.06Å; N435-Y457 PolarHBondContact N-O 3.26Å; N435-E459 CarbonylContact C-O 3.58Å; N435-E459 WeakPolarHBondContact CA-O 3.36Å; N435-E459 HydrophobicContact CB-CG 3.89Å; N435-E459 WeakPolarHBondContact CB-O 3.31Å; N435-E459 WeakPolarHBondContact CB-OE1 3.32Å; N435-E459 PolarHBondContact ND2-OE1 3.12Å
436	G	85.9	Confident	91.8	Very high	17 Å²	17	35.3 Å²	35.3	18%	0.175	18%	0.177	C	C	.	.	S	Bend	trans	63.6	47.2	-179.2	0	0	0	0	0	113.6	N412 N413 E459 Y460	N412-G436 WeakPolarHBondContact CA-O 3.49Å; N412-G436 PolarHBondContact N-O 3.45Å; N413-G436 PolarHBondContact N-O 2.79Å; G436-E459 PolarHBondContact N-O 2.98Å; G436-Y460 VanDerWaalsContact CA-O 3.22Å; G436-Y460 WeakPolarHBondContact CA-O 3.31Å; G436-Y460 PolarHBondContact N-O 2.86Å
437	N	93.8	Very high	91.9	Very high	3 Å²	3	35.3 Å²	35.3	2%	0.016	18%	0.177	C	C	.	.	S	Bend	trans	-128.5	-168.9	178.1	-83.6	-73.2	0	0	0	110.9	L410 N413 R414 I415 L434 N435 Y460 N461	L410-N437 PolarHBondContact O-ND2 2.83Å; N413-N437 WeakPolarHBondContact CA-OD1 3.49Å; N413-N437 WeakPolarHBondContact CB-OD1 3.12Å; N413-N437 PolarHBondContact N-OD1 3.39Å; R414-N437 PolarHBondContact N-OD1 3.06Å; I415-N437 HydrophobicContact CB-CB 4.28Å; I415-N437 WeakPolarHBondContact CB-OD1 3.38Å; I415-N437 WeakPolarHBondContact CG1-OD1 3.24Å; I415-N437 PolarHBondContact N-OD1 2.93Å; L434-N437 WeakPolarHBondContact O-CB 3.45Å; L434-N437 PolarHBondContact O-ND2 3.1Å; N435-N437 PolarHBondContact O-ND2 3.06Å; N437-Y460 PolarHBondContact N-O 3.03Å; N437-N461 WeakPolarHBondContact CA-OD1 3.04Å; N437-N461 WeakPolarHBondContact CB-OD1 3.36Å; N437-N461 PolarHBondContact O-OD1 3.3Å
438	Y	95.1	Very high	91.9	Very high	127 Å²	127	35.2 Å²	35.2	50%	0.498	17%	0.174	S	C	.	.			trans	-118.1	31.4	-175.5	-56.8	-43.7	0	0	0	113	R414 I415 A416 E440 N461	R414-Y438 HydrophobicContact CB-CD2 3.96Å; R414-Y438 HydrophobicContact CB-CE2 3.8Å; R414-Y438 HydrophobicContact CG-CE2 3.89Å; I415-Y438 CarbonylContact O-C 3.59Å; I415-Y438 VanDerWaalsContact O-C 3.28Å; I415-Y438 WeakPolarHBondContact O-CA 3.26Å; I415-Y438 PolarHBondContact O-N 2.97Å; A416-Y438 WeakPolarHBondContact CA-O 3.36Å; Y438-E440 PolarHBondContact O-N 3.22Å; Y438-N461 PolarHBondContact N-OD1 3.19Å
439	L	96.1	Very high	91.9	Very high	2 Å²	2	33.1 Å²	33.1	1%	0.01	16%	0.16	C	C	.	.			trans	-66.9	124.7	176.8	-61.1	174.7	0	0	0	110.1	I415 I418 L434 L442 L458 N461 V462 I463	I415-L439 HydrophobicContact CG2-CD2 4.13Å; I415-L439 PolarHBondContact O-N 2.92Å; I418-L439 HydrophobicContact CD1-CD2 4.26Å; I418-L439 HydrophobicContact CG1-CD2 4.1Å; L434-L439 HydrophobicContact CB-CD1 4.31Å; L434-L439 HydrophobicContact CD1-CD1 4.41Å; L439-L442 HydrophobicContact CD1-CD2 4.42Å; L439-L458 HydrophobicContact CD1-CD2 3.73Å; L439-N461 WeakPolarHBondContact CB-OD1 3.41Å; L439-N461 WeakPolarHBondContact CG-OD1 3.28Å; L439-N461 PolarHBondContact N-OD1 2.76Å; L439-V462 CarbonylContact O-C 3.05Å; L439-V462 WeakPolarHBondContact O-CG2 3.41Å; L439-V462 PolarHBondContact O-N 2.76Å; L439-I463 HydrophobicContact CB-CG1 4.12Å; L439-I463 WeakPolarHBondContact O-CA 3.31Å; L439-I463 VanDerWaalsContact O-CG1 3.27Å; L439-I463 WeakPolarHBondContact O-CG1 3.41Å; L439-I463 PolarHBondContact O-N 3.05Å
440	E	94.5	Very high	91.9	Very high	93 Å²	93	33.1 Å²	33.1	44%	0.435	16%	0.16	S	C	.	.			trans	-100.4	-33.1	179.6	-64.2	-154.6	157	0	0	114.4	Y438 V462 I463 K464	Y438-E440 PolarHBondContact O-N 3.22Å; E440-V462 HydrophobicContact CG-CG2 3.93Å; E440-I463 CarbonylContact O-C 3.5Å; E440-I463 WeakPolarHBondContact O-CA 3.39Å; E440-K464 PolarHBondContact O-N 2.87Å; E440-K464 IonicContact OE1-NZ 3.88Å; E440-K464 PolarHBondContact OE1-NZ 3.12Å; E440-K464 IonicContact OE2-NZ 3.62Å; E440-K464 PolarHBondContact OE2-NZ 2.88Å
441	I	94.3	Very high	92	Very high	80 Å²	80	32.5 Å²	32.5	41%	0.41	16%	0.162	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	135.7	-175.4	-55.5	177.7	0	0	0	108.7	M446 E465	I441-M446 WeakPolarHBondContact O-CE 3.42Å; I441-E465 WeakPolarHBondContact CA-O 3.49Å; I441-E465 HydrophobicContact CG2-CB 4.46Å
442	L	95.2	Very high	92.2	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	139	170.2	-48.2	-176.9	0	0	0	110.6	L439 M446 F447 L458 I463 E465 I466 L467 T470 F471	L439-L442 HydrophobicContact CD1-CD2 4.42Å; L442-M446 HydrophobicContact CD2-CE 4.01Å; L442-M446 HydrophobicContact CD2-SD 3.75Å; L442-F447 HydrophobicContact CB-CE2 4.43Å; L442-F447 HydrophobicContact CD1-CE2 4.23Å; L442-F447 HydrophobicContact CD1-CZ 4.45Å; L442-F447 HydrophobicContact CD2-CZ 4.4Å; L442-L458 HydrophobicContact CD1-CD1 3.88Å; L442-I463 HydrophobicContact CD1-CD1 4.19Å; L442-I463 HydrophobicContact CD2-CD1 4.11Å; L442-I463 HydrophobicContact CD2-CG1 4.43Å; L442-I463 HydrophobicContact CG-CD1 4.27Å; L442-I463 HydrophobicContact CG-CG2 4Å; L442-E465 PolarHBondContact N-O 3.02Å; L442-E465 VanDerWaalsContact N-O 3.1Å; L442-I466 HydrophobicContact CB-CG1 4.25Å; L442-I466 HydrophobicContact CB-CG2 4.37Å; L442-I466 HydrophobicContact CD1-CD1 4.04Å; L442-I466 HydrophobicContact CD1-CG1 3.96Å; L442-I466 HydrophobicContact CG-CG1 4.17Å; L442-L467 PolarHBondContact O-N 3.34Å; L442-T470 HydrophobicContact CB-CG2 3.71Å; L442-F471 HydrophobicContact CD1-CE1 4.15Å; L442-F471 HydrophobicContact CD1-CZ 3.93Å
443	Y	92.3	Very high	92.2	Very high	47 Å²	47	32.4 Å²	32.4	18%	0.184	17%	0.167	C	C	.	.			trans	-136.4	157.7	-175.6	61.2	-94.1	0	0	0	111.2	I418 E420 S445 M446	I418-Y443 PolarHBondContact O-OH 3.48Å; E420-Y443 HydrophobicContact CG-CE2 3.99Å; Y443-S445 WeakPolarHBondContact CD2-OG 3.47Å; Y443-S445 WeakPolarHBondContact CE2-OG 3.29Å; Y443-S445 PolarHBondContact O-N 3.19Å; Y443-M446 HydrophobicContact CD1-CB 4.4Å; Y443-M446 HydrophobicContact CD1-CE 3.64Å; Y443-M446 HydrophobicContact CD2-CB 4.04Å; Y443-M446 HydrophobicContact CE1-CB 4.12Å; Y443-M446 HydrophobicContact CE1-CE 3.29Å; Y443-M446 HydrophobicContact CE1-CG 4.46Å; Y443-M446 HydrophobicContact CE2-CB 3.72Å; Y443-M446 HydrophobicContact CG-CB 4.33Å; Y443-M446 WeakPolarHBondContact O-CB 3.46Å; Y443-M446 PolarHBondContact O-N 2.93Å
444	P	89.4	Confident	92.1	Very high	52 Å²	52	33.8 Å²	33.8	34%	0.338	17%	0.174	S	C	.	.	G	3₁₀ helix	trans	-57.4	-50.1	-168.3	-29.1	38.4	0	0	0	115.4	M446 F447 P468	P444-M446 PolarHBondContact O-N 3.06Å; P444-F447 PolarHBondContact O-N 2.85Å; P444-P468 VanDerWaalsContact CG-O 3.29Å; P444-P468 WeakPolarHBondContact CG-O 3.42Å
445	S	89.3	Confident	91.7	Very high	29 Å²	29	35.1 Å²	35.1	20%	0.203	18%	0.179	C	C	.	.	G	3₁₀ helix	trans	-72.3	8	179.8	58	0	0	0	0	114.6	G421 Y443 D448	G421-S445 PolarHBondContact N-O 2.84Å; Y443-S445 WeakPolarHBondContact CD2-OG 3.47Å; Y443-S445 WeakPolarHBondContact CE2-OG 3.29Å; Y443-S445 PolarHBondContact O-N 3.19Å; S445-D448 WeakPolarHBondContact CA-OD2 3.31Å; S445-D448 WeakPolarHBondContact CB-OD2 3.41Å
446	M	92.5	Very high	92	Very high	3 Å²	3	34.6 Å²	34.6	2%	0.015	18%	0.177	C	C	.	.	G	3₁₀ helix	trans	-71.8	-40.7	171.1	-172.7	-179.8	-71.8	0	0	110.9	I418 F423 I441 L442 Y443 P444	I418-M446 HydrophobicContact CB-CE 4.47Å; I418-M446 HydrophobicContact CB-CG 4.1Å; I418-M446 HydrophobicContact CD1-CG 4.07Å; I418-M446 HydrophobicContact CD1-SD 3.92Å; I418-M446 HydrophobicContact CG2-CG 4.09Å; F423-M446 WeakPolarHBondContact CD2-O 3.28Å; I441-M446 WeakPolarHBondContact O-CE 3.42Å; L442-M446 HydrophobicContact CD2-CE 4.01Å; L442-M446 HydrophobicContact CD2-SD 3.75Å; Y443-M446 HydrophobicContact CD1-CB 4.4Å; Y443-M446 HydrophobicContact CD1-CE 3.64Å; Y443-M446 HydrophobicContact CD2-CB 4.04Å; Y443-M446 HydrophobicContact CE1-CB 4.12Å; Y443-M446 HydrophobicContact CE1-CE 3.29Å; Y443-M446 HydrophobicContact CE1-CG 4.46Å; Y443-M446 HydrophobicContact CE2-CB 3.72Å; Y443-M446 HydrophobicContact CG-CB 4.33Å; Y443-M446 WeakPolarHBondContact O-CB 3.46Å; Y443-M446 PolarHBondContact O-N 2.93Å; P444-M446 PolarHBondContact O-N 3.06Å
447	F	93.1	Very high	92.3	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	17%	0.169	C	C	.	.	S	Bend	trans	-109.1	8.9	-170.9	-58.2	-66.9	0	0	0	114.3	F423 L432 L434 L442 P444 G449 L450 L456 L458 T470 F471 L474	F423-F447 HydrophobicContact CD2-CD1 4.35Å; F423-F447 HydrophobicContact CE2-CD1 4.35Å; L432-F447 HydrophobicContact CD2-CD1 4.48Å; L432-F447 HydrophobicContact CD2-CE1 4.41Å; L434-F447 HydrophobicContact CD1-CE1 4.22Å; L442-F447 HydrophobicContact CB-CE2 4.43Å; L442-F447 HydrophobicContact CD1-CE2 4.23Å; L442-F447 HydrophobicContact CD1-CZ 4.45Å; L442-F447 HydrophobicContact CD2-CZ 4.4Å; P444-F447 PolarHBondContact O-N 2.85Å; F447-G449 PolarHBondContact O-N 3.06Å; F447-L450 HydrophobicContact CB-CD1 4.23Å; F447-L450 HydrophobicContact CD1-CD1 4.02Å; F447-L450 WeakPolarHBondContact O-CB 3.01Å; F447-L450 PolarHBondContact O-N 3.01Å; F447-L456 HydrophobicContact CE1-CD1 4.35Å; F447-L456 HydrophobicContact CE1-CD2 4.2Å; F447-L456 HydrophobicContact CZ-CD2 4.23Å; F447-L458 HydrophobicContact CZ-CD1 4.27Å; F447-T470 HydrophobicContact CD2-CG2 3.95Å; F447-T470 HydrophobicContact CE2-CG2 3.9Å; F447-F471 HydrophobicContact CD2-CD1 4.19Å; F447-F471 HydrophobicContact CD2-CE1 4.25Å; F447-F471 HydrophobicContact CE2-CD1 4.23Å; F447-F471 AromaticContact CE2-CE1 3.82Å; F447-F471 HydrophobicContact CE2-CE1 3.82Å; F447-L474 HydrophobicContact CB-CD1 4.32Å; F447-L474 HydrophobicContact CB-CD2 4.02Å; F447-L474 HydrophobicContact CB-CG 4.38Å; F447-L474 HydrophobicContact CG-CD1 4.43Å
448	D	91.6	Very high	92.3	Very high	67 Å²	67	34 Å²	34	36%	0.358	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-48.5	135.3	173.8	-80.3	-22.2	0	0	0	112.4	F423 T424 S445	F423-D448 CarbonylContact C-O 3.32Å; T424-D448 VanDerWaalsContact CA-O 3.29Å; T424-D448 WeakPolarHBondContact CA-O 3.33Å; T424-D448 HydrophobicContact CG2-CB 4.06Å; T424-D448 PolarHBondContact N-O 2.88Å; S445-D448 WeakPolarHBondContact CA-OD2 3.31Å; S445-D448 WeakPolarHBondContact CB-OD2 3.41Å
449	G	88.3	Confident	91.9	Very high	7 Å²	7	28.5 Å²	28.5	7%	0.072	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	93.9	-20.3	178.8	0	0	0	0	0	115.3	F447 H451	F447-G449 PolarHBondContact O-N 3.06Å; G449-H451 VanDerWaalsContact C-ND1 3.34Å; G449-H451 PolarHBondContact O-N 3.07Å; G449-H451 PolarHBondContact O-ND1 2.92Å
450	L	93.4	Very high	91.5	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	17%	0.166	C	C	.	.			trans	-79.5	37.2	-172.9	-65.6	-179.6	0	0	0	114.8	F423 L426 L429 L432 F447 S452 L453 L474	F423-L450 HydrophobicContact CB-CD1 3.95Å; F423-L450 HydrophobicContact CB-CD2 3.95Å; F423-L450 HydrophobicContact CB-CG 3.79Å; F423-L450 HydrophobicContact CD2-CD1 3.71Å; F423-L450 HydrophobicContact CD2-CG 4.49Å; F423-L450 HydrophobicContact CG-CD1 4.06Å; F423-L450 HydrophobicContact CG-CG 4.42Å; L426-L450 HydrophobicContact CB-CD2 3.75Å; L426-L450 HydrophobicContact CD1-CD2 4.48Å; L429-L450 HydrophobicContact CB-CD2 3.94Å; L429-L450 HydrophobicContact CD2-CD2 3.57Å; L429-L450 HydrophobicContact CG-CD2 4.36Å; L432-L450 HydrophobicContact CD2-CD1 3.78Å; F447-L450 HydrophobicContact CB-CD1 4.23Å; F447-L450 HydrophobicContact CD1-CD1 4.02Å; F447-L450 WeakPolarHBondContact O-CB 3.01Å; F447-L450 PolarHBondContact O-N 3.01Å; L450-S452 PolarHBondContact O-N 3.13Å; L450-S452 VanDerWaalsContact O-N 3.1Å; L450-L453 HydrophobicContact CB-CB 4.16Å; L450-L453 HydrophobicContact CD1-CD2 4.34Å; L450-L453 WeakPolarHBondContact O-CB 3.39Å; L450-L453 PolarHBondContact O-N 3.37Å; L450-L474 HydrophobicContact CB-CD2 3.42Å; L450-L474 VanDerWaalsContact CB-CD2 3.42Å; L450-L474 HydrophobicContact CD1-CD2 4.38Å
451	H	90.4	Very high	91.4	Very high	96 Å²	96	29.3 Å²	29.3	44%	0.444	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-29.4	-176.1	-50.2	92.9	0	0	0	114.5	G449 L453 A473 S475 N476	G449-H451 VanDerWaalsContact C-ND1 3.34Å; G449-H451 PolarHBondContact O-N 3.07Å; G449-H451 PolarHBondContact O-ND1 2.92Å; H451-L453 VanDerWaalsContact C-N 3.35Å; H451-A473 WeakPolarHBondContact CA-O 3.43Å; H451-S475 PolarHBondContact O-OG 2.97Å; H451-N476 PolarHBondContact O-ND2 3.14Å
452	S	91.4	Very high	91.4	Very high	36 Å²	36	27.8 Å²	27.8	25%	0.252	14%	0.142	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.5	0.4	178.4	-62.8	0	0	0	0	114.1	T427 L429 L450 Q454	T427-S452 VanDerWaalsContact O-CB 3.25Å; T427-S452 WeakPolarHBondContact O-CB 3.45Å; T427-S452 PolarHBondContact O-OG 2.81Å; L429-S452 CarbonylContact O-C 3.52Å; L450-S452 PolarHBondContact O-N 3.13Å; L450-S452 VanDerWaalsContact O-N 3.1Å; S452-Q454 PolarHBondContact O-N 3.17Å
453	L	94.5	Very high	91.5	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	14%	0.142	C	C	.	.			trans	-70.4	130.2	-172.4	-164.7	77	0	0	0	110.9	L429 L432 L450 H451 L456 L474 N476 L477	L429-L453 HydrophobicContact CD2-CD1 4.07Å; L429-L453 HydrophobicContact CG-CD1 4.17Å; L429-L453 WeakPolarHBondContact O-CA 3.42Å; L429-L453 PolarHBondContact O-N 2.65Å; L432-L453 HydrophobicContact CB-CD1 3.64Å; L432-L453 HydrophobicContact CB-CD2 4.27Å; L450-L453 HydrophobicContact CB-CB 4.16Å; L450-L453 HydrophobicContact CD1-CD2 4.34Å; L450-L453 WeakPolarHBondContact O-CB 3.39Å; L450-L453 PolarHBondContact O-N 3.37Å; H451-L453 VanDerWaalsContact C-N 3.35Å; L453-L456 HydrophobicContact CD2-CB 4.04Å; L453-L456 HydrophobicContact CD2-CD1 4.39Å; L453-L456 HydrophobicContact CD2-CD2 4.36Å; L453-L474 HydrophobicContact CB-CD2 4.18Å; L453-L474 HydrophobicContact CD2-CD1 4.27Å; L453-L474 HydrophobicContact CD2-CD2 4Å; L453-N476 CarbonylContact O-C 3.38Å; L453-L477 HydrophobicContact CD2-CD1 4.17Å; L453-L477 HydrophobicContact CG-CD1 4.35Å; L453-L477 VanDerWaalsContact O-CA 3.24Å; L453-L477 WeakPolarHBondContact O-CA 3.29Å; L453-L477 PolarHBondContact O-N 3.15Å
454	Q	88.8	Confident	91.6	Very high	39 Å²	39	29.9 Å²	29.9	18%	0.182	15%	0.152	C	C	.	.			trans	-115.6	-27.6	-177.5	-63.2	-177.6	-65.7	0	0	112.2	R430 S452 N476 H478 L479	R430-Q454 PolarHBondContact O-N 3.26Å; S452-Q454 PolarHBondContact O-N 3.17Å; Q454-N476 WeakPolarHBondContact CA-O 3.32Å; Q454-N476 HydrophobicContact CG-CB 4.31Å; Q454-H478 PolarHBondContact O-N 3.03Å; Q454-L479 PolarHBondContact O-N 3.38Å; Q454-L479 VanDerWaalsContact O-N 3.09Å
455	Y	87	Confident	91.8	Very high	29 Å²	29	32.3 Å²	32.3	11%	0.114	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	122	-176.1	-52.3	-88.6	0	0	0	110.4	F238 R430 R431 L432 L479	F238-Y455 HydrophobicContact CD1-CE1 4.18Å; F238-Y455 AromaticContact CD2-CE1 3.81Å; F238-Y455 HydrophobicContact CD2-CE1 3.81Å; F238-Y455 HydrophobicContact CD2-CE2 4.15Å; F238-Y455 AromaticContact CD2-CZ 3.45Å; F238-Y455 VanDerWaalsContact CD2-CZ 3.45Å; F238-Y455 WeakPolarHBondContact CD2-OH 3.46Å; F238-Y455 HydrophobicContact CE1-CD1 4.15Å; F238-Y455 AromaticContact CE1-CE1 3.82Å; F238-Y455 HydrophobicContact CE1-CE1 3.82Å; F238-Y455 HydrophobicContact CE2-CD1 4.03Å; F238-Y455 HydrophobicContact CE2-CD2 4.08Å; F238-Y455 AromaticContact CE2-CE1 3.39Å; F238-Y455 HydrophobicContact CE2-CE1 3.39Å; F238-Y455 AromaticContact CE2-CE2 3.44Å; F238-Y455 HydrophobicContact CE2-CE2 3.44Å; F238-Y455 VanDerWaalsContact CE2-CE2 3.44Å; F238-Y455 HydrophobicContact CE2-CG 4.39Å; F238-Y455 AromaticContact CE2-CZ 3.09Å; F238-Y455 WeakPolarHBondContact CE2-OH 3.42Å; F238-Y455 HydrophobicContact CG-CE1 4.16Å; F238-Y455 AromaticContact CZ-CD1 3.65Å; F238-Y455 HydrophobicContact CZ-CD1 3.65Å; F238-Y455 HydrophobicContact CZ-CD2 4.24Å; F238-Y455 AromaticContact CZ-CE1 3.4Å; F238-Y455 HydrophobicContact CZ-CE1 3.4Å; F238-Y455 HydrophobicContact CZ-CE2 4.01Å; F238-Y455 HydrophobicContact CZ-CG 4.12Å; F238-Y455 AromaticContact CZ-CZ 3.63Å; R430-Y455 PolarHBondContact O-N 3.16Å; R431-Y455 HydrophobicContact CG-CD2 3.81Å; R431-Y455 HydrophobicContact CG-CG 4.34Å; L432-Y455 PolarHBondContact N-O 3.4Å; Y455-L479 HydrophobicContact CD1-CB 3.71Å; Y455-L479 HydrophobicContact CD1-CD1 4.13Å; Y455-L479 HydrophobicContact CD1-CG 4.35Å; Y455-L479 HydrophobicContact CE1-CB 4.15Å; Y455-L479 HydrophobicContact CE1-CD1 4.5Å
456	L	95.2	Very high	92.1	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	115.7	177.5	-178.8	51.9	0	0	0	110.5	L432 F447 L453 L458 F471 L474 L477 L479 L480 F481	L432-L456 HydrophobicContact CB-CD1 4.15Å; L432-L456 HydrophobicContact CD2-CD1 4Å; L432-L456 HydrophobicContact CG-CD1 4.01Å; F447-L456 HydrophobicContact CE1-CD1 4.35Å; F447-L456 HydrophobicContact CE1-CD2 4.2Å; F447-L456 HydrophobicContact CZ-CD2 4.23Å; L453-L456 HydrophobicContact CD2-CB 4.04Å; L453-L456 HydrophobicContact CD2-CD1 4.39Å; L453-L456 HydrophobicContact CD2-CD2 4.36Å; L456-L458 HydrophobicContact CD1-CD1 4.1Å; L456-L458 HydrophobicContact CD1-CG 4.05Å; L456-L458 HydrophobicContact CD2-CD1 3.85Å; L456-L458 HydrophobicContact CG-CD1 3.77Å; L456-L458 HydrophobicContact CG-CG 4.1Å; L456-F471 HydrophobicContact CD2-CD1 4.42Å; L456-F471 HydrophobicContact CD2-CE1 4.12Å; L456-L474 HydrophobicContact CD2-CD1 3.95Å; L456-L477 HydrophobicContact CB-CD1 3.8Å; L456-L479 PolarHBondContact N-O 3.5Å; L456-L480 HydrophobicContact CB-CD1 4.07Å; L456-L480 HydrophobicContact CD2-CD1 3.97Å; L456-L480 HydrophobicContact CG-CD1 3.93Å; L456-F481 PolarHBondContact O-N 3.22Å
457	Y	91.4	Very high	92.1	Very high	6 Å²	6	33.8 Å²	33.8	2%	0.024	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	113	-179.8	-61.3	-93.7	0	0	0	109.6	L432 Y433 L434 N435 E459 L479 F481	L432-Y457 PolarHBondContact O-N 2.89Å; Y433-Y457 HydrophobicContact CD1-CD1 4.32Å; Y433-Y457 AromaticContact CD1-CD2 3.34Å; Y433-Y457 HydrophobicContact CD1-CD2 3.34Å; Y433-Y457 AromaticContact CD1-CE2 3.89Å; Y433-Y457 HydrophobicContact CD1-CE2 3.89Å; Y433-Y457 AromaticContact CD1-CG 3.58Å; Y433-Y457 HydrophobicContact CD1-CG 3.58Å; Y433-Y457 HydrophobicContact CD2-CD2 4.36Å; Y433-Y457 HydrophobicContact CE1-CD1 4.21Å; Y433-Y457 AromaticContact CE1-CD2 3.3Å; Y433-Y457 HydrophobicContact CE1-CD2 3.3Å; Y433-Y457 HydrophobicContact CE1-CE1 4.23Å; Y433-Y457 AromaticContact CE1-CE2 3.31Å; Y433-Y457 HydrophobicContact CE1-CE2 3.31Å; Y433-Y457 AromaticContact CE1-CG 3.77Å; Y433-Y457 HydrophobicContact CE1-CG 3.77Å; Y433-Y457 AromaticContact CE1-CZ 3.8Å; Y433-Y457 HydrophobicContact CE2-CD2 4.33Å; Y433-Y457 HydrophobicContact CE2-CE2 4.26Å; Y433-Y457 AromaticContact CG-CD2 3.89Å; Y433-Y457 HydrophobicContact CG-CD2 3.89Å; Y433-Y457 HydrophobicContact CG-CG 4.37Å; Y433-Y457 AromaticContact CZ-CD2 3.82Å; Y433-Y457 AromaticContact CZ-CE2 3.52Å; L434-Y457 CarbonylContact C-O 3.51Å; L434-Y457 WeakPolarHBondContact CA-O 3.37Å; L434-Y457 PolarHBondContact N-O 3.32Å; N435-Y457 PolarHBondContact N-O 3.26Å; Y457-E459 VanDerWaalsContact CA-OE2 3.31Å; Y457-E459 WeakPolarHBondContact CA-OE2 3.48Å; Y457-E459 VanDerWaalsContact CB-OE2 3.31Å; Y457-E459 WeakPolarHBondContact CB-OE2 3.12Å; Y457-L479 HydrophobicContact CD1-CD2 4.5Å; Y457-L479 HydrophobicContact CE1-CD2 4.04Å; Y457-F481 HydrophobicContact CD1-CB 4.42Å; Y457-F481 AromaticContact CD1-CD2 3.74Å; Y457-F481 HydrophobicContact CD1-CD2 3.74Å; Y457-F481 HydrophobicContact CD1-CE2 4.38Å; Y457-F481 HydrophobicContact CD1-CG 4.34Å; Y457-F481 AromaticContact CE1-CD2 3.83Å; Y457-F481 HydrophobicContact CE1-CD2 3.83Å; Y457-F481 HydrophobicContact CE1-CE2 4.01Å
458	L	94.6	Very high	92	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	18%	0.183	C	C	.	.			trans	-127.6	10.4	-177.5	-75.3	163.1	0	0	0	111.9	L434 L439 L442 F447 L456 N461 I463 L480 F481 L482 N485	L434-L458 HydrophobicContact CB-CD2 3.7Å; L434-L458 HydrophobicContact CD1-CD2 4.03Å; L439-L458 HydrophobicContact CD1-CD2 3.73Å; L442-L458 HydrophobicContact CD1-CD1 3.88Å; F447-L458 HydrophobicContact CZ-CD1 4.27Å; L456-L458 HydrophobicContact CD1-CD1 4.1Å; L456-L458 HydrophobicContact CD1-CG 4.05Å; L456-L458 HydrophobicContact CD2-CD1 3.85Å; L456-L458 HydrophobicContact CG-CD1 3.77Å; L456-L458 HydrophobicContact CG-CG 4.1Å; L458-N461 PolarHBondContact O-ND2 3.37Å; L458-I463 HydrophobicContact CB-CD1 4.16Å; L458-I463 HydrophobicContact CD2-CD1 4.35Å; L458-L480 HydrophobicContact CD1-CD1 4.23Å; L458-F481 CarbonylContact C-O 3.54Å; L458-F481 WeakPolarHBondContact CA-O 3.39Å; L458-F481 WeakPolarHBondContact CB-O 3.33Å; L458-F481 PolarHBondContact N-O 3.17Å; L458-L482 HydrophobicContact CB-CD2 3.8Å; L458-L482 HydrophobicContact CD1-CD2 3.91Å; L458-N485 PolarHBondContact O-ND2 2.77Å
459	E	85.9	Confident	91.9	Very high	13 Å²	13	38 Å²	38	6%	0.061	19%	0.187	C	C	.	.			trans	-62.8	155.3	178.9	68.4	-78.2	179.9	0	0	113.4	N435 G436 Y457 N461 F481 N483	N435-E459 CarbonylContact C-O 3.58Å; N435-E459 WeakPolarHBondContact CA-O 3.36Å; N435-E459 HydrophobicContact CB-CG 3.89Å; N435-E459 WeakPolarHBondContact CB-O 3.31Å; N435-E459 WeakPolarHBondContact CB-OE1 3.32Å; N435-E459 PolarHBondContact ND2-OE1 3.12Å; G436-E459 PolarHBondContact N-O 2.98Å; Y457-E459 VanDerWaalsContact CA-OE2 3.31Å; Y457-E459 WeakPolarHBondContact CA-OE2 3.48Å; Y457-E459 VanDerWaalsContact CB-OE2 3.31Å; Y457-E459 WeakPolarHBondContact CB-OE2 3.12Å; E459-N461 VanDerWaalsContact C-N 3.29Å; E459-N461 PolarHBondContact O-N 2.78Å; E459-N461 PolarHBondContact O-ND2 2.74Å; E459-F481 PolarHBondContact N-O 2.88Å; E459-F481 WeakPolarHBondContact OE2-CB 3.36Å; E459-N483 CarbonylContact C-O 3.5Å; E459-N483 WeakPolarHBondContact CA-O 3.33Å; E459-N483 VanDerWaalsContact CB-O 3.23Å; E459-N483 WeakPolarHBondContact CB-O 3.41Å
460	Y	88.3	Confident	92.2	Very high	103 Å²	103	37.7 Å²	37.7	40%	0.404	18%	0.184	S	C	.	.	S	Bend	trans	54.5	42.1	-176.8	-60.5	-77.2	0	0	0	113.4	Y144 G436 N437 N483 N484	Y144-Y460 PolarHBondContact OH-OH 3.26Å; Y144-Y460 VanDerWaalsContact OH-OH 3.06Å; G436-Y460 VanDerWaalsContact CA-O 3.22Å; G436-Y460 WeakPolarHBondContact CA-O 3.31Å; G436-Y460 PolarHBondContact N-O 2.86Å; N437-Y460 PolarHBondContact N-O 3.03Å; Y460-N483 PolarHBondContact N-O 2.83Å; Y460-N483 VanDerWaalsContact N-O 3.09Å; Y460-N484 VanDerWaalsContact CA-O 3.31Å; Y460-N484 WeakPolarHBondContact CA-O 3.17Å; Y460-N484 HydrophobicContact CD1-CB 3.48Å; Y460-N484 VanDerWaalsContact CD1-CB 3.48Å; Y460-N484 HydrophobicContact CE1-CB 3.58Å; Y460-N484 VanDerWaalsContact CE1-ND2 3.29Å; Y460-N484 WeakPolarHBondContact CE1-ND2 3.43Å; Y460-N484 WeakPolarHBondContact CE2-ND2 3.34Å; Y460-N484 HydrophobicContact CG-CB 4.02Å; Y460-N484 PolarHBondContact N-O 2.85Å; Y460-N484 PolarHBondContact OH-ND2 3.35Å; Y460-N484 VanDerWaalsContact OH-ND2 3.16Å
461	N	92.7	Very high	92.2	Very high	9 Å²	9	37.7 Å²	37.7	5%	0.048	18%	0.184	C	C	.	.	S	Bend	trans	-105	-166.7	166.1	-84.5	-95.8	0	0	0	109.6	L434 N437 Y438 L439 L458 E459 I463 N485	L434-N461 PolarHBondContact O-ND2 2.69Å; N437-N461 WeakPolarHBondContact CA-OD1 3.04Å; N437-N461 WeakPolarHBondContact CB-OD1 3.36Å; N437-N461 PolarHBondContact O-OD1 3.3Å; Y438-N461 PolarHBondContact N-OD1 3.19Å; L439-N461 WeakPolarHBondContact CB-OD1 3.41Å; L439-N461 WeakPolarHBondContact CG-OD1 3.28Å; L439-N461 PolarHBondContact N-OD1 2.76Å; L458-N461 PolarHBondContact O-ND2 3.37Å; E459-N461 VanDerWaalsContact C-N 3.29Å; E459-N461 PolarHBondContact O-N 2.78Å; E459-N461 PolarHBondContact O-ND2 2.74Å; N461-I463 HydrophobicContact CB-CD1 4.02Å; N461-I463 HydrophobicContact CB-CG1 3.83Å; N461-N485 WeakPolarHBondContact CA-OD1 3.42Å; N461-N485 WeakPolarHBondContact CB-OD1 3.31Å; N461-N485 PolarHBondContact O-OD1 3.47Å
462	V	95	Very high	92.2	Very high	47 Å²	47	36 Å²	36	29%	0.285	18%	0.178	S	C	.	.			trans	-121.4	34.2	176.5	-68.5	0	0	0	0	111.1	L439 E440 K464 N485 L486	L439-V462 CarbonylContact O-C 3.05Å; L439-V462 WeakPolarHBondContact O-CG2 3.41Å; L439-V462 PolarHBondContact O-N 2.76Å; E440-V462 HydrophobicContact CG-CG2 3.93Å; V462-K464 PolarHBondContact O-N 3.01Å; V462-N485 PolarHBondContact N-OD1 3.08Å; V462-L486 HydrophobicContact CB-CD1 3.99Å; V462-L486 HydrophobicContact CG1-CD1 4.41Å
463	I	97.1	Very high	92	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	17%	0.173	C	C	.	.			trans	-69.8	120.2	-172.3	-53.2	163.3	0	0	0	108.9	L439 E440 L442 L458 N461 E465 I466 L482 N485 L486 L487	L439-I463 HydrophobicContact CB-CG1 4.12Å; L439-I463 WeakPolarHBondContact O-CA 3.31Å; L439-I463 VanDerWaalsContact O-CG1 3.27Å; L439-I463 WeakPolarHBondContact O-CG1 3.41Å; L439-I463 PolarHBondContact O-N 3.05Å; E440-I463 CarbonylContact O-C 3.5Å; E440-I463 WeakPolarHBondContact O-CA 3.39Å; L442-I463 HydrophobicContact CD1-CD1 4.19Å; L442-I463 HydrophobicContact CD2-CD1 4.11Å; L442-I463 HydrophobicContact CD2-CG1 4.43Å; L442-I463 HydrophobicContact CG-CD1 4.27Å; L442-I463 HydrophobicContact CG-CG2 4Å; L458-I463 HydrophobicContact CB-CD1 4.16Å; L458-I463 HydrophobicContact CD2-CD1 4.35Å; N461-I463 HydrophobicContact CB-CD1 4.02Å; N461-I463 HydrophobicContact CB-CG1 3.83Å; I463-E465 WeakPolarHBondContact CG2-O 3.38Å; I463-I466 HydrophobicContact CG2-CG1 4.19Å; I463-L482 HydrophobicContact CD1-CD2 4.06Å; I463-N485 HydrophobicContact CB-CB 4.44Å; I463-N485 WeakPolarHBondContact CB-OD1 3.42Å; I463-N485 VanDerWaalsContact CG1-OD1 3.3Å; I463-N485 WeakPolarHBondContact CG1-OD1 3.25Å; I463-N485 PolarHBondContact N-OD1 3.21Å; I463-L486 CarbonylContact O-C 3.56Å; I463-L486 VanDerWaalsContact O-CA 3.27Å; I463-L486 WeakPolarHBondContact O-CA 3.39Å; I463-L486 WeakPolarHBondContact O-CB 3.32Å; I463-L486 PolarHBondContact O-N 2.97Å; I463-L487 HydrophobicContact CB-CD2 4.22Å; I463-L487 HydrophobicContact CG2-CD2 3.66Å; I463-L487 PolarHBondContact O-N 2.85Å; I463-L487 VanDerWaalsContact O-N 3.1Å
464	K	94.3	Very high	91.9	Very high	91 Å²	91	35.1 Å²	35.1	40%	0.396	17%	0.173	S	C	.	.			trans	-98.4	-33.9	-178.7	-62.1	158.5	-162.8	172.6	0	111.6	E440 V462 L486	E440-K464 PolarHBondContact O-N 2.87Å; E440-K464 IonicContact OE1-NZ 3.88Å; E440-K464 PolarHBondContact OE1-NZ 3.12Å; E440-K464 IonicContact OE2-NZ 3.62Å; E440-K464 PolarHBondContact OE2-NZ 2.88Å; V462-K464 PolarHBondContact O-N 3.01Å; K464-L486 HydrophobicContact CG-CB 4.06Å; K464-L486 HydrophobicContact CG-CD1 4.21Å
465	E	93.8	Very high	91.9	Very high	103 Å²	103	36.1 Å²	36.1	48%	0.481	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	145	-170.8	-172.9	172.5	177.6	0	0	111.2	I441 L442 I463 L467	I441-E465 WeakPolarHBondContact CA-O 3.49Å; I441-E465 HydrophobicContact CG2-CB 4.46Å; L442-E465 PolarHBondContact N-O 3.02Å; L442-E465 VanDerWaalsContact N-O 3.1Å; I463-E465 WeakPolarHBondContact CG2-O 3.38Å; E465-L467 HydrophobicContact CG-CD2 4.44Å
466	I	95.6	Very high	92.1	Very high	5 Å²	5	38.1 Å²	38.1	3%	0.026	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	127.9	171.4	-61.3	177.7	0	0	0	105.5	L442 I463 T470 F471 L482 L487 L490 P491 V494	L442-I466 HydrophobicContact CB-CG1 4.25Å; L442-I466 HydrophobicContact CB-CG2 4.37Å; L442-I466 HydrophobicContact CD1-CD1 4.04Å; L442-I466 HydrophobicContact CD1-CG1 3.96Å; L442-I466 HydrophobicContact CG-CG1 4.17Å; I463-I466 HydrophobicContact CG2-CG1 4.19Å; I466-T470 HydrophobicContact CG2-CG2 3.95Å; I466-F471 HydrophobicContact CD1-CE2 4.29Å; I466-F471 HydrophobicContact CD1-CZ 4.18Å; I466-F471 HydrophobicContact CG2-CE2 4.14Å; I466-F471 HydrophobicContact CG2-CZ 4.33Å; I466-L482 HydrophobicContact CD1-CD1 3.95Å; I466-L482 HydrophobicContact CD1-CD2 4.32Å; I466-L487 HydrophobicContact CD1-CD1 4.08Å; I466-L487 HydrophobicContact CD1-CD2 3.89Å; I466-L487 HydrophobicContact CG1-CD2 3.79Å; I466-L490 HydrophobicContact CD1-CD2 4.01Å; I466-P491 WeakPolarHBondContact O-CD 3.47Å; I466-P491 VanDerWaalsContact O-CG 3.26Å; I466-P491 WeakPolarHBondContact O-CG 3.4Å; I466-V494 HydrophobicContact CG2-CG2 3.66Å
467	L	92.9	Very high	92	Very high	59 Å²	59	38.1 Å²	38.1	31%	0.309	20%	0.197	S	C	.	.			trans	-79.2	157.5	179.9	-63.5	-176.5	0	0	0	112	L442 E465 T470	L442-L467 PolarHBondContact O-N 3.34Å; E465-L467 HydrophobicContact CG-CD2 4.44Å; L467-T470 PolarHBondContact N-OG1 3.26Å; L467-T470 WeakPolarHBondContact O-CB 3.22Å; L467-T470 PolarHBondContact O-N 2.98Å; L467-T470 PolarHBondContact O-OG1 2.92Å
468	P	90.5	Very high	91.8	Very high	61 Å²	61	40.2 Å²	40.2	40%	0.396	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.3	148.3	173.6	-21.3	29.7	0	0	0	111.6	P444 T470 P491	P444-P468 VanDerWaalsContact CG-O 3.29Å; P444-P468 WeakPolarHBondContact CG-O 3.42Å; P468-T470 PolarHBondContact O-N 3.09Å; P468-T470 VanDerWaalsContact O-N 3.17Å; P468-P491 HydrophobicContact CB-CB 4.35Å; P468-P491 HydrophobicContact CG-CB 3.85Å; P468-P491 HydrophobicContact CG-CG 4.32Å
469	H	89.8	Confident	91.4	Very high	94 Å²	94	40.3 Å²	40.3	44%	0.435	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.8	11.2	179.9	-52.1	-72.2	0	0	0	116.2	F471 D472	H469-F471 PolarHBondContact O-N 3.09Å; H469-F471 VanDerWaalsContact O-N 3.14Å; H469-D472 HydrophobicContact CB-CB 4.49Å; H469-D472 WeakPolarHBondContact CB-OD2 3.15Å; H469-D472 IonicContact CE1-OD2 2.69Å; H469-D472 IonicContact CG-OD2 3.94Å; H469-D472 IonicContact ND1-OD2 3.94Å; H469-D472 PolarHBondContact ND1-OD2 3.47Å; H469-D472 PolarHBondContact O-N 3.12Å
470	T	92.9	Very high	91.8	Very high	1 Å²	1	39.7 Å²	39.7	1%	0.006	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58	-31.1	-175.5	-69.7	0	0	0	0	114.5	L442 F447 I466 L467 P468	L442-T470 HydrophobicContact CB-CG2 3.71Å; F447-T470 HydrophobicContact CD2-CG2 3.95Å; F447-T470 HydrophobicContact CE2-CG2 3.9Å; I466-T470 HydrophobicContact CG2-CG2 3.95Å; L467-T470 PolarHBondContact N-OG1 3.26Å; L467-T470 WeakPolarHBondContact O-CB 3.22Å; L467-T470 PolarHBondContact O-N 2.98Å; L467-T470 PolarHBondContact O-OG1 2.92Å; P468-T470 PolarHBondContact O-N 3.09Å; P468-T470 VanDerWaalsContact O-N 3.17Å
471	F	93.5	Very high	91.9	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.7	6.8	-177.9	-54	-55.9	0	0	0	114.2	L442 F447 L456 I466 H469 A473 L474 L480 V494 F495 T498	L442-F471 HydrophobicContact CD1-CE1 4.15Å; L442-F471 HydrophobicContact CD1-CZ 3.93Å; F447-F471 HydrophobicContact CD2-CD1 4.19Å; F447-F471 HydrophobicContact CD2-CE1 4.25Å; F447-F471 HydrophobicContact CE2-CD1 4.23Å; F447-F471 AromaticContact CE2-CE1 3.82Å; F447-F471 HydrophobicContact CE2-CE1 3.82Å; L456-F471 HydrophobicContact CD2-CD1 4.42Å; L456-F471 HydrophobicContact CD2-CE1 4.12Å; I466-F471 HydrophobicContact CD1-CE2 4.29Å; I466-F471 HydrophobicContact CD1-CZ 4.18Å; I466-F471 HydrophobicContact CG2-CE2 4.14Å; I466-F471 HydrophobicContact CG2-CZ 4.33Å; H469-F471 PolarHBondContact O-N 3.09Å; H469-F471 VanDerWaalsContact O-N 3.14Å; F471-A473 PolarHBondContact O-N 3.45Å; F471-A473 VanDerWaalsContact O-N 3.16Å; F471-L474 HydrophobicContact CB-CD1 4.14Å; F471-L474 HydrophobicContact CD1-CD1 3.74Å; F471-L474 HydrophobicContact CG-CD1 4.38Å; F471-L474 WeakPolarHBondContact O-CB 3.47Å; F471-L474 PolarHBondContact O-N 3.49Å; F471-L480 HydrophobicContact CD2-CD2 4.2Å; F471-L480 HydrophobicContact CE2-CD2 3.78Å; F471-L480 HydrophobicContact CZ-CD1 4.47Å; F471-L480 HydrophobicContact CZ-CD2 3.97Å; F471-V494 HydrophobicContact CD2-CG2 3.98Å; F471-V494 WeakPolarHBondContact CD2-O 3.4Å; F471-V494 HydrophobicContact CE2-CG2 4.05Å; F471-F495 AromaticContact CD2-CD1 3.87Å; F471-F495 HydrophobicContact CD2-CD1 3.87Å; F471-F495 AromaticContact CD2-CE1 3.76Å; F471-F495 HydrophobicContact CD2-CE1 3.76Å; F471-F495 HydrophobicContact CE2-CD1 4.46Å; F471-F495 AromaticContact CE2-CE1 3.9Å; F471-F495 HydrophobicContact CE2-CE1 3.9Å; F471-T498 HydrophobicContact CB-CG2 3.72Å; F471-T498 VanDerWaalsContact O-CG2 3.3Å; F471-T498 WeakPolarHBondContact O-CG2 3.44Å
472	D	90.1	Very high	92	Very high	59 Å²	59	35.2 Å²	35.2	32%	0.316	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-21.8	-173.9	-78.9	-3.8	0	0	0	113.9	H469 L474 G497	H469-D472 HydrophobicContact CB-CB 4.49Å; H469-D472 WeakPolarHBondContact CB-OD2 3.15Å; H469-D472 IonicContact CE1-OD2 2.69Å; H469-D472 IonicContact CG-OD2 3.94Å; H469-D472 IonicContact ND1-OD2 3.94Å; H469-D472 PolarHBondContact ND1-OD2 3.47Å; H469-D472 PolarHBondContact O-N 3.12Å; D472-L474 PolarHBondContact O-N 3.27Å; D472-G497 PolarHBondContact OD1-N 3.16Å
473	A	88.1	Confident	91.7	Very high	19 Å²	19	33.9 Å²	33.9	16%	0.157	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-14.2	171.5	0	0	0	0	0	113.8	H451 F471 S475	H451-A473 WeakPolarHBondContact CA-O 3.43Å; F471-A473 PolarHBondContact O-N 3.45Å; F471-A473 VanDerWaalsContact O-N 3.16Å; A473-S475 PolarHBondContact O-N 2.77Å
474	L	92.7	Very high	91.2	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	19%	0.186	C	C	.	.			trans	-99.7	56.1	-167.8	-48.8	179.2	0	0	0	112.3	F447 L450 L453 L456 F471 D472 N476 L477	F447-L474 HydrophobicContact CB-CD1 4.32Å; F447-L474 HydrophobicContact CB-CD2 4.02Å; F447-L474 HydrophobicContact CB-CG 4.38Å; F447-L474 HydrophobicContact CG-CD1 4.43Å; L450-L474 HydrophobicContact CB-CD2 3.42Å; L450-L474 VanDerWaalsContact CB-CD2 3.42Å; L450-L474 HydrophobicContact CD1-CD2 4.38Å; L453-L474 HydrophobicContact CB-CD2 4.18Å; L453-L474 HydrophobicContact CD2-CD1 4.27Å; L453-L474 HydrophobicContact CD2-CD2 4Å; L456-L474 HydrophobicContact CD2-CD1 3.95Å; F471-L474 HydrophobicContact CB-CD1 4.14Å; F471-L474 HydrophobicContact CD1-CD1 3.74Å; F471-L474 HydrophobicContact CG-CD1 4.38Å; F471-L474 WeakPolarHBondContact O-CB 3.47Å; F471-L474 PolarHBondContact O-N 3.49Å; D472-L474 PolarHBondContact O-N 3.27Å; L474-N476 PolarHBondContact O-N 2.81Å; L474-L477 HydrophobicContact CB-CB 3.89Å; L474-L477 HydrophobicContact CB-CD2 4.23Å; L474-L477 HydrophobicContact CD1-CD2 3.97Å; L474-L477 WeakPolarHBondContact O-CB 3.1Å; L474-L477 PolarHBondContact O-N 3.47Å
475	S	89.3	Confident	91.2	Very high	60 Å²	60	31.2 Å²	31.2	42%	0.42	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-17.5	-170.8	58.3	0	0	0	0	116.2	H451 A473 G497	H451-S475 PolarHBondContact O-OG 2.97Å; A473-S475 PolarHBondContact O-N 2.77Å; S475-G497 WeakPolarHBondContact CA-O 3.38Å
476	N	89.6	Confident	91.3	Very high	71 Å²	71	29 Å²	29	38%	0.38	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.2	10.1	175.6	-70.3	-87.7	0	0	0	113.7	H451 L453 Q454 L474 H478	H451-N476 PolarHBondContact O-ND2 3.14Å; L453-N476 CarbonylContact O-C 3.38Å; Q454-N476 WeakPolarHBondContact CA-O 3.32Å; Q454-N476 HydrophobicContact CG-CB 4.31Å; L474-N476 PolarHBondContact O-N 2.81Å; N476-H478 PolarHBondContact O-CD2 2.7Å; N476-H478 PolarHBondContact O-CE1 3.39Å; N476-H478 PolarHBondContact O-N 3.44Å; N476-H478 PolarHBondContact O-ND1 3.15Å; N476-H478 PolarHBondContact O-NE2 3Å
477	L	93.4	Very high	91.3	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	16%	0.158	C	C	.	.			trans	-69.7	119.8	-173.3	-169.7	69.5	0	0	0	111.5	L453 L456 L474 L480 T498 S499 L500	L453-L477 HydrophobicContact CD2-CD1 4.17Å; L453-L477 HydrophobicContact CG-CD1 4.35Å; L453-L477 VanDerWaalsContact O-CA 3.24Å; L453-L477 WeakPolarHBondContact O-CA 3.29Å; L453-L477 PolarHBondContact O-N 3.15Å; L456-L477 HydrophobicContact CB-CD1 3.8Å; L474-L477 HydrophobicContact CB-CB 3.89Å; L474-L477 HydrophobicContact CB-CD2 4.23Å; L474-L477 HydrophobicContact CD1-CD2 3.97Å; L474-L477 WeakPolarHBondContact O-CB 3.1Å; L474-L477 PolarHBondContact O-N 3.47Å; L477-L480 HydrophobicContact CD2-CB 4.36Å; L477-T498 HydrophobicContact CD2-CG2 4.47Å; L477-S499 CarbonylContact O-C 3.49Å; L477-L500 HydrophobicContact CB-CD2 4.42Å; L477-L500 HydrophobicContact CD2-CD2 3.82Å; L477-L500 HydrophobicContact CD2-CG 4.45Å; L477-L500 HydrophobicContact CG-CD2 3.74Å; L477-L500 WeakPolarHBondContact O-CA 3.05Å; L477-L500 PolarHBondContact O-N 3.18Å
478	H	87.1	Confident	91.3	Very high	49 Å²	49	34.3 Å²	34.3	23%	0.227	18%	0.175	C	C	.	.			trans	-108.9	-26.1	-178.4	-59.6	-38.9	0	0	0	113.4	Q454 N476 S499 T501 R502	Q454-H478 PolarHBondContact O-N 3.03Å; N476-H478 PolarHBondContact O-CD2 2.7Å; N476-H478 PolarHBondContact O-CE1 3.39Å; N476-H478 PolarHBondContact O-N 3.44Å; N476-H478 PolarHBondContact O-ND1 3.15Å; N476-H478 PolarHBondContact O-NE2 3Å; H478-S499 PolarHBondContact ND1-O 2.94Å; H478-T501 HydrophobicContact CB-CG2 4.28Å; H478-T501 WeakPolarHBondContact O-CA 3.44Å; H478-T501 PolarHBondContact O-N 2.98Å; H478-T501 PolarHBondContact O-OG1 3.04Å; H478-R502 PolarHBondContact O-N 2.87Å
479	L	87.2	Confident	91.3	Very high	2 Å²	2	34.4 Å²	34.4	1%	0.01	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	128	-178.4	-177.7	156.3	0	0	0	110.4	Q454 Y455 L456 Y457 F481 R502	Q454-L479 PolarHBondContact O-N 3.38Å; Q454-L479 VanDerWaalsContact O-N 3.09Å; Y455-L479 HydrophobicContact CD1-CB 3.71Å; Y455-L479 HydrophobicContact CD1-CD1 4.13Å; Y455-L479 HydrophobicContact CD1-CG 4.35Å; Y455-L479 HydrophobicContact CE1-CB 4.15Å; Y455-L479 HydrophobicContact CE1-CD1 4.5Å; L456-L479 PolarHBondContact N-O 3.5Å; Y457-L479 HydrophobicContact CD1-CD2 4.5Å; Y457-L479 HydrophobicContact CE1-CD2 4.04Å; L479-F481 HydrophobicContact CD1-CE1 3.99Å; L479-F481 HydrophobicContact CD1-CZ 4.09Å; L479-F481 HydrophobicContact CD2-CD1 3.64Å; L479-F481 HydrophobicContact CD2-CD2 4.34Å; L479-F481 HydrophobicContact CD2-CE1 3.8Å; L479-F481 HydrophobicContact CD2-CE2 4.47Å; L479-F481 HydrophobicContact CD2-CG 3.93Å; L479-F481 HydrophobicContact CD2-CZ 4.22Å; L479-F481 HydrophobicContact CG-CD1 4.1Å; L479-F481 HydrophobicContact CG-CE1 3.87Å; L479-F481 HydrophobicContact CG-CZ 4.41Å; L479-R502 WeakPolarHBondContact CA-O 3.4Å; L479-R502 HydrophobicContact CB-CB 4.49Å; L479-R502 HydrophobicContact CG-CB 4.26Å
480	L	94.6	Very high	91.5	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	115.6	174.5	176.2	58.3	0	0	0	110.5	L456 L458 F471 L477 L482 F495 L500 R502 L503 N504	L456-L480 HydrophobicContact CB-CD1 4.07Å; L456-L480 HydrophobicContact CD2-CD1 3.97Å; L456-L480 HydrophobicContact CG-CD1 3.93Å; L458-L480 HydrophobicContact CD1-CD1 4.23Å; F471-L480 HydrophobicContact CD2-CD2 4.2Å; F471-L480 HydrophobicContact CE2-CD2 3.78Å; F471-L480 HydrophobicContact CZ-CD1 4.47Å; F471-L480 HydrophobicContact CZ-CD2 3.97Å; L477-L480 HydrophobicContact CD2-CB 4.36Å; L480-L482 HydrophobicContact CD1-CD1 4.26Å; L480-L482 HydrophobicContact CD1-CG 4.03Å; L480-L482 HydrophobicContact CD2-CD1 3.85Å; L480-L482 HydrophobicContact CD2-CG 4.49Å; L480-L482 HydrophobicContact CG-CD1 3.94Å; L480-L482 HydrophobicContact CG-CG 4.06Å; L480-F495 HydrophobicContact CD2-CE1 3.69Å; L480-F495 HydrophobicContact CD2-CZ 4.41Å; L480-L500 HydrophobicContact CB-CD1 4.37Å; L480-L500 HydrophobicContact CB-CD2 3.72Å; L480-L500 HydrophobicContact CD2-CD1 4.24Å; L480-R502 PolarHBondContact N-O 3.38Å; L480-R502 VanDerWaalsContact N-O 3.08Å; L480-L503 HydrophobicContact CB-CD1 4.21Å; L480-L503 HydrophobicContact CD2-CD1 4.05Å; L480-L503 HydrophobicContact CG-CD1 4.12Å; L480-L503 WeakPolarHBondContact O-CA 3.41Å; L480-N504 PolarHBondContact O-N 3.17Å
481	F	90.3	Very high	91.5	Very high	19 Å²	19	31.4 Å²	31.4	8%	0.083	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	120	173.6	-75.6	2.4	0	0	0	110.2	L456 Y457 L458 E459 L479 N504	L456-F481 PolarHBondContact O-N 3.22Å; Y457-F481 HydrophobicContact CD1-CB 4.42Å; Y457-F481 AromaticContact CD1-CD2 3.74Å; Y457-F481 HydrophobicContact CD1-CD2 3.74Å; Y457-F481 HydrophobicContact CD1-CE2 4.38Å; Y457-F481 HydrophobicContact CD1-CG 4.34Å; Y457-F481 AromaticContact CE1-CD2 3.83Å; Y457-F481 HydrophobicContact CE1-CD2 3.83Å; Y457-F481 HydrophobicContact CE1-CE2 4.01Å; L458-F481 CarbonylContact C-O 3.54Å; L458-F481 WeakPolarHBondContact CA-O 3.39Å; L458-F481 WeakPolarHBondContact CB-O 3.33Å; L458-F481 PolarHBondContact N-O 3.17Å; E459-F481 PolarHBondContact N-O 2.88Å; E459-F481 WeakPolarHBondContact OE2-CB 3.36Å; L479-F481 HydrophobicContact CD1-CE1 3.99Å; L479-F481 HydrophobicContact CD1-CZ 4.09Å; L479-F481 HydrophobicContact CD2-CD1 3.64Å; L479-F481 HydrophobicContact CD2-CD2 4.34Å; L479-F481 HydrophobicContact CD2-CE1 3.8Å; L479-F481 HydrophobicContact CD2-CE2 4.47Å; L479-F481 HydrophobicContact CD2-CG 3.93Å; L479-F481 HydrophobicContact CD2-CZ 4.22Å; L479-F481 HydrophobicContact CG-CD1 4.1Å; L479-F481 HydrophobicContact CG-CE1 3.87Å; L479-F481 HydrophobicContact CG-CZ 4.41Å; F481-N504 HydrophobicContact CD1-CB 3.55Å; F481-N504 HydrophobicContact CE1-CB 4.01Å; F481-N504 HydrophobicContact CG-CB 4.17Å
482	L	95	Very high	91.2	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.191	C	C	.	.			trans	-126.5	13.7	179.8	-76.1	166.8	0	0	0	111.5	L458 I463 I466 L480 N485 L487 N504 L505 N508	L458-L482 HydrophobicContact CB-CD2 3.8Å; L458-L482 HydrophobicContact CD1-CD2 3.91Å; I463-L482 HydrophobicContact CD1-CD2 4.06Å; I466-L482 HydrophobicContact CD1-CD1 3.95Å; I466-L482 HydrophobicContact CD1-CD2 4.32Å; L480-L482 HydrophobicContact CD1-CD1 4.26Å; L480-L482 HydrophobicContact CD1-CG 4.03Å; L480-L482 HydrophobicContact CD2-CD1 3.85Å; L480-L482 HydrophobicContact CD2-CG 4.49Å; L480-L482 HydrophobicContact CG-CD1 3.94Å; L480-L482 HydrophobicContact CG-CG 4.06Å; L482-N485 WeakPolarHBondContact O-CB 3.42Å; L482-N485 PolarHBondContact O-ND2 3.1Å; L482-L487 HydrophobicContact CB-CD1 4.16Å; L482-L487 HydrophobicContact CD1-CD1 4.22Å; L482-L487 HydrophobicContact CD2-CD1 4.44Å; L482-N504 CarbonylContact C-O 3.46Å; L482-N504 WeakPolarHBondContact CA-O 3.49Å; L482-N504 PolarHBondContact N-O 3.14Å; L482-L505 HydrophobicContact CB-CD2 4.03Å; L482-L505 HydrophobicContact CD1-CD2 4.05Å; L482-N508 PolarHBondContact O-ND2 3.2Å
483	N	88.1	Confident	91	Very high	18 Å²	18	36.7 Å²	36.7	10%	0.096	19%	0.194	C	C	.	.			trans	-69.8	154.2	-176.9	55.5	-79.1	0	0	0	113.7	E459 Y460 N504 R506	E459-N483 CarbonylContact C-O 3.5Å; E459-N483 WeakPolarHBondContact CA-O 3.33Å; E459-N483 VanDerWaalsContact CB-O 3.23Å; E459-N483 WeakPolarHBondContact CB-O 3.41Å; Y460-N483 PolarHBondContact N-O 2.83Å; Y460-N483 VanDerWaalsContact N-O 3.09Å; N483-N504 WeakPolarHBondContact CB-OD1 3.21Å; N483-N504 PolarHBondContact N-O 3.17Å; N483-N504 PolarHBondContact OD1-ND2 3.09Å; N483-R506 CarbonylContact C-O 3.02Å; N483-R506 WeakPolarHBondContact CA-O 3.42Å; N483-R506 HydrophobicContact CB-CB 4Å; N483-R506 WeakPolarHBondContact CB-O 3.3Å
484	N	87.3	Confident	91.2	Very high	30 Å²	30	35.8 Å²	35.8	16%	0.16	19%	0.187	C	C	.	.	S	Bend	trans	56.1	59	-172.5	-48.5	-77.1	0	0	0	111.4	Y460 R506 N507	Y460-N484 VanDerWaalsContact CA-O 3.31Å; Y460-N484 WeakPolarHBondContact CA-O 3.17Å; Y460-N484 HydrophobicContact CD1-CB 3.48Å; Y460-N484 VanDerWaalsContact CD1-CB 3.48Å; Y460-N484 HydrophobicContact CE1-CB 3.58Å; Y460-N484 VanDerWaalsContact CE1-ND2 3.29Å; Y460-N484 WeakPolarHBondContact CE1-ND2 3.43Å; Y460-N484 WeakPolarHBondContact CE2-ND2 3.34Å; Y460-N484 HydrophobicContact CG-CB 4.02Å; Y460-N484 PolarHBondContact N-O 2.85Å; Y460-N484 PolarHBondContact OH-ND2 3.35Å; Y460-N484 VanDerWaalsContact OH-ND2 3.16Å; N484-R506 PolarHBondContact N-O 3.29Å; N484-N507 WeakPolarHBondContact CA-O 3.46Å; N484-N507 PolarHBondContact N-O 2.81Å; N484-N507 VanDerWaalsContact N-O 3.07Å; N484-N507 PolarHBondContact OD1-ND2 2.97Å
485	N	93.7	Very high	91.1	Very high	6 Å²	6	35.9 Å²	35.9	3%	0.032	19%	0.187	C	C	.	.	S	Bend	trans	-132.5	-169.1	174.8	-87.6	-75.8	0	0	0	109.5	L458 N461 V462 I463 L482 L487 N507 N508	L458-N485 PolarHBondContact O-ND2 2.77Å; N461-N485 WeakPolarHBondContact CA-OD1 3.42Å; N461-N485 WeakPolarHBondContact CB-OD1 3.31Å; N461-N485 PolarHBondContact O-OD1 3.47Å; V462-N485 PolarHBondContact N-OD1 3.08Å; I463-N485 HydrophobicContact CB-CB 4.44Å; I463-N485 WeakPolarHBondContact CB-OD1 3.42Å; I463-N485 VanDerWaalsContact CG1-OD1 3.3Å; I463-N485 WeakPolarHBondContact CG1-OD1 3.25Å; I463-N485 PolarHBondContact N-OD1 3.21Å; L482-N485 WeakPolarHBondContact O-CB 3.42Å; L482-N485 PolarHBondContact O-ND2 3.1Å; N485-L487 HydrophobicContact CB-CG 4.39Å; N485-N507 PolarHBondContact N-O 2.79Å; N485-N508 WeakPolarHBondContact CA-OD1 3.44Å; N485-N508 WeakPolarHBondContact CB-OD1 3.47Å; N485-N508 PolarHBondContact O-OD1 3.48Å
486	L	94.8	Very high	90.8	Very high	57 Å²	57	35.2 Å²	35.2	30%	0.298	19%	0.189	S	C	.	.			trans	-117.2	19.8	-174.9	-55	176.8	0	0	0	112.5	V462 I463 K464 N508	V462-L486 HydrophobicContact CB-CD1 3.99Å; V462-L486 HydrophobicContact CG1-CD1 4.41Å; I463-L486 CarbonylContact O-C 3.56Å; I463-L486 VanDerWaalsContact O-CA 3.27Å; I463-L486 WeakPolarHBondContact O-CA 3.39Å; I463-L486 WeakPolarHBondContact O-CB 3.32Å; I463-L486 PolarHBondContact O-N 2.97Å; K464-L486 HydrophobicContact CG-CB 4.06Å; K464-L486 HydrophobicContact CG-CD1 4.21Å; L486-N508 PolarHBondContact N-OD1 3.11Å
487	L	96.1	Very high	90.4	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	19%	0.186	C	C	.	.			trans	-65.3	136.2	-173.7	-62.9	172	0	0	0	111.3	I463 I466 L482 N485 L505 N508 H509 F510	I463-L487 HydrophobicContact CB-CD2 4.22Å; I463-L487 HydrophobicContact CG2-CD2 3.66Å; I463-L487 PolarHBondContact O-N 2.85Å; I463-L487 VanDerWaalsContact O-N 3.1Å; I466-L487 HydrophobicContact CD1-CD1 4.08Å; I466-L487 HydrophobicContact CD1-CD2 3.89Å; I466-L487 HydrophobicContact CG1-CD2 3.79Å; L482-L487 HydrophobicContact CB-CD1 4.16Å; L482-L487 HydrophobicContact CD1-CD1 4.22Å; L482-L487 HydrophobicContact CD2-CD1 4.44Å; N485-L487 HydrophobicContact CB-CG 4.39Å; L487-L505 HydrophobicContact CD1-CD2 4.48Å; L487-N508 HydrophobicContact CB-CB 4.43Å; L487-N508 VanDerWaalsContact CB-OD1 3.3Å; L487-N508 WeakPolarHBondContact CB-OD1 3.5Å; L487-N508 WeakPolarHBondContact CG-OD1 3.32Å; L487-N508 PolarHBondContact N-OD1 2.98Å; L487-H509 CarbonylContact O-C 3.51Å; L487-H509 WeakPolarHBondContact O-CA 3.48Å; L487-H509 WeakPolarHBondContact O-CB 3.48Å; L487-H509 PolarHBondContact O-N 3.07Å; L487-F510 HydrophobicContact CB-CE1 4.15Å; L487-F510 HydrophobicContact CB-CE2 3.83Å; L487-F510 HydrophobicContact CB-CZ 3.52Å; L487-F510 HydrophobicContact CD1-CE2 4.32Å; L487-F510 HydrophobicContact CD1-CZ 3.99Å; L487-F510 HydrophobicContact CG-CZ 4.4Å; L487-F510 PolarHBondContact O-N 2.85Å
488	R	92.3	Very high	90.2	Very high	175 Å²	175	34.2 Å²	34.2	66%	0.66	19%	0.192	S	C	*	.			trans	-108.7	-30.4	-179.8	-65.1	-178.9	175.8	-162.1	-4.5	114.5	H509 F510	R488-H509 WeakPolarHBondContact CA-O 3.42Å; R488-H509 HydrophobicContact CG-CB 4.03Å; R488-F510 WeakPolarHBondContact O-CD1 3.44Å
489	S	91.5	Very high	90.2	Very high	62 Å²	62	34.5 Å²	34.5	43%	0.434	20%	0.199	S	C	.	.			trans	-155.4	165.2	179.9	56.9	0	0	0	0	108.9
490	L	93.8	Very high	90.3	Very high	5 Å²	5	34.4 Å²	34.4	3%	0.026	20%	0.199	C	C	.	.			trans	-116.4	141.4	167.9	-66.1	-176.4	0	0	0	108	I466 V494 F495 L505 F510 L513 P514 V518	I466-L490 HydrophobicContact CD1-CD2 4.01Å; L490-V494 HydrophobicContact CB-CG1 4.19Å; L490-V494 HydrophobicContact CD1-CG1 4.37Å; L490-F495 HydrophobicContact CD1-CE2 3.76Å; L490-F495 HydrophobicContact CD1-CZ 3.77Å; L490-L505 HydrophobicContact CD1-CD1 4.38Å; L490-F510 HydrophobicContact CD2-CE1 4.31Å; L490-F510 HydrophobicContact CD2-CZ 4.12Å; L490-F510 HydrophobicContact CG-CE1 3.93Å; L490-F510 HydrophobicContact CG-CZ 4.05Å; L490-L513 HydrophobicContact CB-CD1 4.44Å; L490-L513 HydrophobicContact CD1-CD1 3.95Å; L490-L513 HydrophobicContact CG-CD1 4.12Å; L490-P514 WeakPolarHBondContact O-CG 3.45Å; L490-V518 HydrophobicContact CB-CG1 4.26Å; L490-V518 HydrophobicContact CD1-CG1 3.98Å
491	P	92.2	Very high	89.8	Confident	27 Å²	27	35.7 Å²	35.7	18%	0.175	21%	0.207	C	C	.	.			trans	-78.5	160.3	178.5	32.6	-35.2	0	0	0	112	I466 P468 V494 V518	I466-P491 WeakPolarHBondContact O-CD 3.47Å; I466-P491 VanDerWaalsContact O-CG 3.26Å; I466-P491 WeakPolarHBondContact O-CG 3.4Å; P468-P491 HydrophobicContact CB-CB 4.35Å; P468-P491 HydrophobicContact CG-CB 3.85Å; P468-P491 HydrophobicContact CG-CG 4.32Å; P491-V494 HydrophobicContact CG-CB 3.96Å; P491-V494 HydrophobicContact CG-CG2 4.07Å; P491-V494 WeakPolarHBondContact O-CB 3.22Å; P491-V494 PolarHBondContact O-N 2.98Å; P491-V518 WeakPolarHBondContact O-CG2 3.25Å
492	D	88.4	Confident	89.3	Confident	102 Å²	102	36.7 Å²	36.7	55%	0.545	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.2	140.7	172.2	-62.2	-15.3	0	0	0	111.3	V494	D492-V494 PolarHBondContact O-N 2.97Å
493	N	86.6	Confident	89.1	Confident	69 Å²	69	36.9 Å²	36.9	37%	0.369	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.2	18.8	-178.2	-50.6	-60.6	0	0	0	115.6	F495 G496 G517 Q521	N493-F495 PolarHBondContact O-N 3.42Å; N493-F495 VanDerWaalsContact O-N 3.09Å; N493-G496 PolarHBondContact O-N 3.44Å; N493-G496 VanDerWaalsContact O-N 3.17Å; N493-G517 WeakPolarHBondContact CA-O 3.33Å; N493-G517 PolarHBondContact N-O 3.39Å; N493-Q521 PolarHBondContact OD1-NE2 3.06Å
494	V	91.1	Very high	89	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-25.7	178.9	72.6	0	0	0	0	114	I466 F471 L490 P491 D492 V518	I466-V494 HydrophobicContact CG2-CG2 3.66Å; F471-V494 HydrophobicContact CD2-CG2 3.98Å; F471-V494 WeakPolarHBondContact CD2-O 3.4Å; F471-V494 HydrophobicContact CE2-CG2 4.05Å; L490-V494 HydrophobicContact CB-CG1 4.19Å; L490-V494 HydrophobicContact CD1-CG1 4.37Å; P491-V494 HydrophobicContact CG-CB 3.96Å; P491-V494 HydrophobicContact CG-CG2 4.07Å; P491-V494 WeakPolarHBondContact O-CB 3.22Å; P491-V494 PolarHBondContact O-N 2.98Å; D492-V494 PolarHBondContact O-N 2.97Å; V494-V518 HydrophobicContact CG1-CG1 4.14Å; V494-V518 HydrophobicContact CG1-CG2 4.35Å
495	F	89.9	Confident	89.3	Confident	1 Å²	1	35.7 Å²	35.7	0%	0.004	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-113	8.1	-178.4	-60.3	-47.6	0	0	0	113.6	F471 L480 L490 N493 G497 T498 L500 L503 V518 L522	F471-F495 AromaticContact CD2-CD1 3.87Å; F471-F495 HydrophobicContact CD2-CD1 3.87Å; F471-F495 AromaticContact CD2-CE1 3.76Å; F471-F495 HydrophobicContact CD2-CE1 3.76Å; F471-F495 HydrophobicContact CE2-CD1 4.46Å; F471-F495 AromaticContact CE2-CE1 3.9Å; F471-F495 HydrophobicContact CE2-CE1 3.9Å; L480-F495 HydrophobicContact CD2-CE1 3.69Å; L480-F495 HydrophobicContact CD2-CZ 4.41Å; L490-F495 HydrophobicContact CD1-CE2 3.76Å; L490-F495 HydrophobicContact CD1-CZ 3.77Å; N493-F495 PolarHBondContact O-N 3.42Å; N493-F495 VanDerWaalsContact O-N 3.09Å; F495-G497 VanDerWaalsContact C-N 3.31Å; F495-G497 PolarHBondContact O-N 2.57Å; F495-T498 PolarHBondContact O-N 2.98Å; F495-T498 PolarHBondContact O-OG1 3.36Å; F495-L500 HydrophobicContact CD1-CD1 3.59Å; F495-L500 HydrophobicContact CE1-CD1 3.81Å; F495-L500 HydrophobicContact CG-CD1 4.12Å; F495-L500 HydrophobicContact CZ-CD1 4.47Å; F495-L503 HydrophobicContact CE2-CD2 3.82Å; F495-L503 HydrophobicContact CZ-CD1 4.09Å; F495-L503 HydrophobicContact CZ-CD2 3.85Å; F495-V518 HydrophobicContact CD2-CG1 3.9Å; F495-V518 HydrophobicContact CE2-CG1 3.79Å; F495-L522 HydrophobicContact CB-CD2 3.67Å; F495-L522 HydrophobicContact CD2-CD1 3.99Å; F495-L522 HydrophobicContact CD2-CD2 3.79Å; F495-L522 HydrophobicContact CD2-CG 4.15Å; F495-L522 HydrophobicContact CE2-CD1 4.21Å; F495-L522 HydrophobicContact CG-CD2 3.86Å
496	G	83.4	Confident	89	Confident	46 Å²	46	37.4 Å²	37.4	47%	0.474	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-35.3	-166	0	0	0	0	0	114.8	N493	N493-G496 PolarHBondContact O-N 3.44Å; N493-G496 VanDerWaalsContact O-N 3.17Å
497	G	82.4	Confident	88.6	Confident	30 Å²	30	37.9 Å²	37.9	31%	0.309	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.2	1.3	174.4	0	0	0	0	0	116.3	D472 S475 F495	D472-G497 PolarHBondContact OD1-N 3.16Å; S475-G497 WeakPolarHBondContact CA-O 3.38Å; F495-G497 VanDerWaalsContact C-N 3.31Å; F495-G497 PolarHBondContact O-N 2.57Å
498	T	88.8	Confident	88.5	Confident	20 Å²	20	38 Å²	38	12%	0.123	21%	0.214	C	C	.	.			trans	-109.5	158.7	-167.1	71.7	0	0	0	0	114.7	F471 L477 F495	F471-T498 HydrophobicContact CB-CG2 3.72Å; F471-T498 VanDerWaalsContact O-CG2 3.3Å; F471-T498 WeakPolarHBondContact O-CG2 3.44Å; L477-T498 HydrophobicContact CD2-CG2 4.47Å; F495-T498 PolarHBondContact O-N 2.98Å; F495-T498 PolarHBondContact O-OG1 3.36Å
499	S	86.2	Confident	88.6	Confident	55 Å²	55	33.7 Å²	33.7	39%	0.385	20%	0.201	S	C	.	.			trans	-121.8	55.3	177.9	-164.2	0	0	0	0	111.2	L477 H478 T501	L477-S499 CarbonylContact O-C 3.49Å; H478-S499 PolarHBondContact ND1-O 2.94Å; S499-T501 PolarHBondContact O-N 3.16Å
500	L	89.9	Confident	88.7	Confident	1 Å²	1	30.7 Å²	30.7	1%	0.005	18%	0.181	C	C	.	.			trans	-67.8	128.8	-173.9	-78	171.8	0	0	0	112.2	L477 L480 F495 L522 A524 L525	L477-L500 HydrophobicContact CB-CD2 4.42Å; L477-L500 HydrophobicContact CD2-CD2 3.82Å; L477-L500 HydrophobicContact CD2-CG 4.45Å; L477-L500 HydrophobicContact CG-CD2 3.74Å; L477-L500 WeakPolarHBondContact O-CA 3.05Å; L477-L500 PolarHBondContact O-N 3.18Å; L480-L500 HydrophobicContact CB-CD1 4.37Å; L480-L500 HydrophobicContact CB-CD2 3.72Å; L480-L500 HydrophobicContact CD2-CD1 4.24Å; F495-L500 HydrophobicContact CD1-CD1 3.59Å; F495-L500 HydrophobicContact CE1-CD1 3.81Å; F495-L500 HydrophobicContact CG-CD1 4.12Å; F495-L500 HydrophobicContact CZ-CD1 4.47Å; L500-L522 HydrophobicContact CB-CD2 4.13Å; L500-L522 HydrophobicContact CD1-CD2 4.21Å; L500-A524 CarbonylContact O-C 3.17Å; L500-L525 PolarHBondContact O-N 3.39Å
501	T	83.9	Confident	88.5	Confident	27 Å²	27	32.6 Å²	32.6	17%	0.166	19%	0.194	C	C	.	.	S	Bend	trans	-102.7	-27.1	174	70.9	0	0	0	0	112.3	H478 S499 A524 I526 Q527	H478-T501 HydrophobicContact CB-CG2 4.28Å; H478-T501 WeakPolarHBondContact O-CA 3.44Å; H478-T501 PolarHBondContact O-N 2.98Å; H478-T501 PolarHBondContact O-OG1 3.04Å; S499-T501 PolarHBondContact O-N 3.16Å; T501-A524 WeakPolarHBondContact CA-O 3.48Å; T501-I526 WeakPolarHBondContact O-CA 2.98Å; T501-I526 PolarHBondContact O-N 2.81Å; T501-Q527 PolarHBondContact O-N 3.38Å; T501-Q527 VanDerWaalsContact O-N 3.12Å
502	R	80.5	Confident	88.4	Confident	40 Å²	40	34.8 Å²	34.8	15%	0.151	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	131.7	178	-61.1	-173.8	170.8	71	-7.7	110.9	E211 H478 L479 L480 Q527	E211-R502 IonicContact OE1-CZ 2.79Å; E211-R502 IonicContact OE1-NE 2.87Å; E211-R502 PolarHBondContact OE1-NE 2.92Å; E211-R502 IonicContact OE1-NH2 2.82Å; E211-R502 IonicContact OE2-CZ 2.67Å; E211-R502 VanDerWaalsContact OE2-CZ 3.23Å; E211-R502 IonicContact OE2-NE 3.45Å; E211-R502 PolarHBondContact OE2-NE 2.95Å; E211-R502 IonicContact OE2-NH2 3.23Å; E211-R502 PolarHBondContact OE2-NH2 3.08Å; H478-R502 PolarHBondContact O-N 2.87Å; L479-R502 WeakPolarHBondContact CA-O 3.4Å; L479-R502 HydrophobicContact CB-CB 4.49Å; L479-R502 HydrophobicContact CG-CB 4.26Å; L480-R502 PolarHBondContact N-O 3.38Å; L480-R502 VanDerWaalsContact N-O 3.08Å; R502-Q527 WeakPolarHBondContact CA-O 3.48Å; R502-Q527 VanDerWaalsContact CD-OE1 3.3Å; R502-Q527 HydrophobicContact CG-CB 4.04Å
503	L	90.8	Very high	88.5	Confident	4 Å²	4	30.1 Å²	30.1	2%	0.021	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	123.4	176.8	176.3	59.7	0	0	0	110.2	L480 F495 L505 L522 L525 Q527 I528 D529	L480-L503 HydrophobicContact CB-CD1 4.21Å; L480-L503 HydrophobicContact CD2-CD1 4.05Å; L480-L503 HydrophobicContact CG-CD1 4.12Å; L480-L503 WeakPolarHBondContact O-CA 3.41Å; F495-L503 HydrophobicContact CE2-CD2 3.82Å; F495-L503 HydrophobicContact CZ-CD1 4.09Å; F495-L503 HydrophobicContact CZ-CD2 3.85Å; L503-L505 HydrophobicContact CD1-CD2 4.18Å; L503-L505 HydrophobicContact CD1-CG 4.26Å; L503-L505 HydrophobicContact CD2-CD1 4.15Å; L503-L505 HydrophobicContact CD2-CG 4.45Å; L503-L505 HydrophobicContact CG-CD1 4.34Å; L503-L505 HydrophobicContact CG-CG 4.1Å; L503-L522 HydrophobicContact CD2-CD1 3.91Å; L503-L525 HydrophobicContact CB-CD1 4.19Å; L503-Q527 PolarHBondContact N-O 3.03Å; L503-Q527 VanDerWaalsContact N-O 3.13Å; L503-I528 HydrophobicContact CB-CG1 4.29Å; L503-I528 HydrophobicContact CD2-CD1 4.1Å; L503-I528 HydrophobicContact CG-CG1 4.43Å; L503-I528 VanDerWaalsContact O-CA 3.29Å; L503-I528 WeakPolarHBondContact O-CA 3.05Å; L503-D529 PolarHBondContact O-N 3.03Å; L503-D529 VanDerWaalsContact O-N 3.07Å
504	N	85.9	Confident	88.6	Confident	23 Å²	23	28.3 Å²	28.3	12%	0.123	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	115.9	176.6	-166.2	-19.3	0	0	0	111.3	L480 F481 L482 N483 R506 D529	L480-N504 PolarHBondContact O-N 3.17Å; F481-N504 HydrophobicContact CD1-CB 3.55Å; F481-N504 HydrophobicContact CE1-CB 4.01Å; F481-N504 HydrophobicContact CG-CB 4.17Å; L482-N504 CarbonylContact C-O 3.46Å; L482-N504 WeakPolarHBondContact CA-O 3.49Å; L482-N504 PolarHBondContact N-O 3.14Å; N483-N504 WeakPolarHBondContact CB-OD1 3.21Å; N483-N504 PolarHBondContact N-O 3.17Å; N483-N504 PolarHBondContact OD1-ND2 3.09Å; N504-R506 VanDerWaalsContact OD1-CB 3.24Å; N504-R506 WeakPolarHBondContact OD1-CB 3.45Å; N504-R506 PolarHBondContact OD1-N 3.09Å; N504-D529 WeakPolarHBondContact OD1-CB 3.43Å
505	L	93.3	Very high	88.3	Confident	0 Å²	0	29 Å²	29	0%	0	17%	0.173	C	C	.	.			trans	-116.6	9.7	178.2	-61.7	173.5	0	0	0	112.6	L482 L487 L490 L503 N508 F510 L513 D529 L530 N533	L482-L505 HydrophobicContact CB-CD2 4.03Å; L482-L505 HydrophobicContact CD1-CD2 4.05Å; L487-L505 HydrophobicContact CD1-CD2 4.48Å; L490-L505 HydrophobicContact CD1-CD1 4.38Å; L503-L505 HydrophobicContact CD1-CD2 4.18Å; L503-L505 HydrophobicContact CD1-CG 4.26Å; L503-L505 HydrophobicContact CD2-CD1 4.15Å; L503-L505 HydrophobicContact CD2-CG 4.45Å; L503-L505 HydrophobicContact CG-CD1 4.34Å; L503-L505 HydrophobicContact CG-CG 4.1Å; L505-N508 PolarHBondContact O-ND2 3.15Å; L505-F510 HydrophobicContact CB-CD2 4.44Å; L505-F510 HydrophobicContact CB-CE2 3.94Å; L505-F510 HydrophobicContact CD1-CE2 4.18Å; L505-F510 HydrophobicContact CD1-CZ 4.35Å; L505-F510 HydrophobicContact CD2-CE2 3.93Å; L505-F510 HydrophobicContact CD2-CZ 4.09Å; L505-F510 HydrophobicContact CG-CE2 4.24Å; L505-L513 HydrophobicContact CD1-CD1 4.47Å; L505-L513 HydrophobicContact CD1-CD2 4.1Å; L505-D529 PolarHBondContact N-O 3.08Å; L505-L530 HydrophobicContact CB-CD2 4.26Å; L505-L530 HydrophobicContact CD1-CD2 3.95Å; L505-N533 PolarHBondContact O-ND2 3.18Å
506	R	87.3	Confident	88	Confident	41 Å²	41	39.2 Å²	39.2	16%	0.155	21%	0.212	C	C	.	.			trans	-52.6	142.6	-179.1	178.2	174.1	171.6	-158.1	-1	112.6	D143 N483 N484 N504 N508 D529 Q531 E532	D143-R506 IonicContact OD2-NH1 2.74Å; D143-R506 PolarHBondContact OD2-NH1 3Å; N483-R506 CarbonylContact C-O 3.02Å; N483-R506 WeakPolarHBondContact CA-O 3.42Å; N483-R506 HydrophobicContact CB-CB 4Å; N483-R506 WeakPolarHBondContact CB-O 3.3Å; N484-R506 PolarHBondContact N-O 3.29Å; N504-R506 VanDerWaalsContact OD1-CB 3.24Å; N504-R506 WeakPolarHBondContact OD1-CB 3.45Å; N504-R506 PolarHBondContact OD1-N 3.09Å; R506-N508 PolarHBondContact O-ND2 3.29Å; R506-D529 HydrophobicContact CB-CB 4.48Å; R506-Q531 VanDerWaalsContact CA-O 3.31Å; R506-Q531 WeakPolarHBondContact CA-O 3.4Å; R506-Q531 HydrophobicContact CG-CB 4.19Å; R506-E532 HydrophobicContact CG-CB 4.46Å; R506-E532 IonicContact CZ-OE1 3.71Å; R506-E532 IonicContact CZ-OE2 3.23Å; R506-E532 VanDerWaalsContact NE-CD 3.34Å; R506-E532 IonicContact NE-OE1 3.4Å; R506-E532 PolarHBondContact NE-OE1 3.18Å; R506-E532 IonicContact NE-OE2 2.71Å; R506-E532 PolarHBondContact NE-OE2 2.88Å; R506-E532 IonicContact NH2-OE1 2.98Å; R506-E532 PolarHBondContact NH2-OE1 2.78Å; R506-E532 IonicContact NH2-OE2 3.74Å; R506-E532 PolarHBondContact NH2-OE2 3.32Å; R506-E532 VanDerWaalsContact NH2-OE2 3.13Å
507	N	86.1	Confident	87.9	Confident	68 Å²	68	37.7 Å²	37.7	36%	0.364	20%	0.196	S	C	.	.	S	Bend	trans	54.7	69.9	177.6	-163.6	24.2	0	0	0	112.4	N484 N485 Q531 E532	N484-N507 WeakPolarHBondContact CA-O 3.46Å; N484-N507 PolarHBondContact N-O 2.81Å; N484-N507 VanDerWaalsContact N-O 3.07Å; N484-N507 PolarHBondContact OD1-ND2 2.97Å; N485-N507 PolarHBondContact N-O 2.79Å; N507-Q531 PolarHBondContact N-O 2.98Å; N507-E532 WeakPolarHBondContact CA-O 3.39Å; N507-E532 HydrophobicContact CB-CB 4.04Å
508	N	94.1	Very high	88.2	Confident	1 Å²	1	36.2 Å²	36.2	1%	0.005	18%	0.181	C	C	.	.	S	Bend	trans	-134.6	-162.2	175.7	-91.2	-80.9	0	0	0	108.7	L482 N485 L486 L487 L505 R506 F510 E532 N533 P534	L482-N508 PolarHBondContact O-ND2 3.2Å; N485-N508 WeakPolarHBondContact CA-OD1 3.44Å; N485-N508 WeakPolarHBondContact CB-OD1 3.47Å; N485-N508 PolarHBondContact O-OD1 3.48Å; L486-N508 PolarHBondContact N-OD1 3.11Å; L487-N508 HydrophobicContact CB-CB 4.43Å; L487-N508 VanDerWaalsContact CB-OD1 3.3Å; L487-N508 WeakPolarHBondContact CB-OD1 3.5Å; L487-N508 WeakPolarHBondContact CG-OD1 3.32Å; L487-N508 PolarHBondContact N-OD1 2.98Å; L505-N508 PolarHBondContact O-ND2 3.15Å; R506-N508 PolarHBondContact O-ND2 3.29Å; N508-F510 HydrophobicContact CB-CD2 3.68Å; N508-F510 HydrophobicContact CB-CE2 3.77Å; N508-E532 PolarHBondContact N-O 3.01Å; N508-N533 VanDerWaalsContact CA-OD1 3.25Å; N508-N533 WeakPolarHBondContact CA-OD1 3.21Å; N508-N533 WeakPolarHBondContact CB-OD1 3.23Å; N508-N533 PolarHBondContact N-OD1 2.72Å; N508-N533 PolarHBondContact O-OD1 3.17Å; N508-P534 WeakPolarHBondContact O-CD 3.05Å
509	H	94.5	Very high	88.1	Confident	85 Å²	85	35.4 Å²	35.4	39%	0.394	18%	0.176	S	C	.	.			trans	-120.2	30.3	179.6	-65.7	-25.2	0	0	0	113	L487 R488 S511 N533 P534	L487-H509 CarbonylContact O-C 3.51Å; L487-H509 WeakPolarHBondContact O-CA 3.48Å; L487-H509 WeakPolarHBondContact O-CB 3.48Å; L487-H509 PolarHBondContact O-N 3.07Å; R488-H509 WeakPolarHBondContact CA-O 3.42Å; R488-H509 HydrophobicContact CG-CB 4.03Å; H509-S511 PolarHBondContact O-N 2.04Å; H509-N533 PolarHBondContact N-OD1 3.1Å; H509-P534 HydrophobicContact CB-CG 4.5Å
510	F	93.8	Very high	87.9	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	18%	0.181	C	C	.	.			trans	-67.8	115.9	176.3	-67.9	-73.1	0	0	0	111.4	L487 R488 L490 L505 N508 L513 N533 P534 W535	L487-F510 HydrophobicContact CB-CE1 4.15Å; L487-F510 HydrophobicContact CB-CE2 3.83Å; L487-F510 HydrophobicContact CB-CZ 3.52Å; L487-F510 HydrophobicContact CD1-CE2 4.32Å; L487-F510 HydrophobicContact CD1-CZ 3.99Å; L487-F510 HydrophobicContact CG-CZ 4.4Å; L487-F510 PolarHBondContact O-N 2.85Å; R488-F510 WeakPolarHBondContact O-CD1 3.44Å; L490-F510 HydrophobicContact CD2-CE1 4.31Å; L490-F510 HydrophobicContact CD2-CZ 4.12Å; L490-F510 HydrophobicContact CG-CE1 3.93Å; L490-F510 HydrophobicContact CG-CZ 4.05Å; L505-F510 HydrophobicContact CB-CD2 4.44Å; L505-F510 HydrophobicContact CB-CE2 3.94Å; L505-F510 HydrophobicContact CD1-CE2 4.18Å; L505-F510 HydrophobicContact CD1-CZ 4.35Å; L505-F510 HydrophobicContact CD2-CE2 3.93Å; L505-F510 HydrophobicContact CD2-CZ 4.09Å; L505-F510 HydrophobicContact CG-CE2 4.24Å; N508-F510 HydrophobicContact CB-CD2 3.68Å; N508-F510 HydrophobicContact CB-CE2 3.77Å; F510-L513 HydrophobicContact CD1-CD1 4.32Å; F510-L513 HydrophobicContact CE1-CD1 4.18Å; F510-N533 HydrophobicContact CB-CB 4.33Å; F510-N533 WeakPolarHBondContact CB-OD1 3.44Å; F510-N533 VanDerWaalsContact CD2-OD1 3.26Å; F510-N533 WeakPolarHBondContact CD2-OD1 3.38Å; F510-N533 PolarHBondContact N-OD1 2.86Å; F510-P534 CarbonylContact O-C 3.28Å; F510-P534 WeakPolarHBondContact O-CD 3.34Å; F510-W535 HydrophobicContact CB-CE3 4.32Å; F510-W535 HydrophobicContact CB-CH2 3.58Å; F510-W535 HydrophobicContact CB-CZ2 4.14Å; F510-W535 HydrophobicContact CB-CZ3 3.69Å; F510-W535 HydrophobicContact CG-CH2 4.2Å
511	S	90.1	Very high	87.5	Confident	44 Å²	44	39.6 Å²	39.6	31%	0.308	19%	0.192	S	C	.	.	S	Bend	trans	-86.2	-41.2	165.8	56	0	0	0	0	111.3	H509 P534 W535 D536	H509-S511 PolarHBondContact O-N 2.04Å; S511-P534 WeakPolarHBondContact CA-O 3.5Å; S511-W535 CarbonylContact O-C 3.43Å; S511-W535 WeakPolarHBondContact O-CA 3.29Å; S511-D536 PolarHBondContact O-N 3.28Å
512	H	89.6	Confident	87.4	Confident	73 Å²	73	38.9 Å²	38.9	34%	0.338	19%	0.188	S	C	.	.			trans	-137.3	153.9	169.9	68.6	92.7	0	0	0	110
513	L	90.7	Very high	87.3	Confident	4 Å²	4	42.6 Å²	42.6	2%	0.021	22%	0.219	C	C	.	.			trans	-123.1	112.6	176.3	-175.8	60.5	0	0	0	107.5	L490 L505 F510 V515 L519 L530 W535 L544	L490-L513 HydrophobicContact CB-CD1 4.44Å; L490-L513 HydrophobicContact CD1-CD1 3.95Å; L490-L513 HydrophobicContact CG-CD1 4.12Å; L505-L513 HydrophobicContact CD1-CD1 4.47Å; L505-L513 HydrophobicContact CD1-CD2 4.1Å; F510-L513 HydrophobicContact CD1-CD1 4.32Å; F510-L513 HydrophobicContact CE1-CD1 4.18Å; L513-V515 PolarHBondContact O-N 2.82Å; L513-L519 HydrophobicContact CD2-CD1 3.78Å; L513-L519 HydrophobicContact CD2-CD2 4.36Å; L513-L519 HydrophobicContact CD2-CG 4.28Å; L513-L519 HydrophobicContact CG-CD1 4.2Å; L513-L519 HydrophobicContact CG-CG 4.45Å; L513-L530 HydrophobicContact CD2-CD2 3.73Å; L513-W535 HydrophobicContact CB-CH2 3.79Å; L513-W535 HydrophobicContact CB-CZ3 3.65Å; L513-W535 HydrophobicContact CD2-CH2 4.16Å; L513-L544 HydrophobicContact CB-CD1 4.49Å; L513-L544 HydrophobicContact CB-CD2 4.2Å; L513-L544 HydrophobicContact CD2-CD1 4.32Å
514	P	87.8	Confident	86.8	Confident	31 Å²	31	44.1 Å²	44.1	20%	0.201	23%	0.233	C	C	.	.			trans	-58.3	137.2	175.3	23.2	-32.8	0	0	0	110.1	L490 V518	L490-P514 WeakPolarHBondContact O-CG 3.45Å; P514-V518 HydrophobicContact CB-CG2 4.5Å; P514-V518 HydrophobicContact CG-CG2 4Å; P514-V518 WeakPolarHBondContact O-CB 3.5Å
515	V	85.1	Confident	86.7	Confident	15 Å²	15	43.4 Å²	43.4	9%	0.091	23%	0.229	C	C	.	.	I	π-helix	trans	-94.2	-39.5	173.2	169	0	0	0	0	111.2	L513 V518 L519 D520 G543 L544 W547	L513-V515 PolarHBondContact O-N 2.82Å; V515-V518 PolarHBondContact O-N 2.92Å; V515-L519 HydrophobicContact CG1-CB 4.4Å; V515-L519 HydrophobicContact CG2-CB 4.38Å; V515-L519 HydrophobicContact CG2-CD1 4.23Å; V515-L519 PolarHBondContact O-N 2.8Å; V515-L519 VanDerWaalsContact O-N 3.12Å; V515-D520 WeakPolarHBondContact O-CB 3.37Å; V515-D520 PolarHBondContact O-N 2.94Å; V515-G543 VanDerWaalsContact CG2-C 3.41Å; V515-G543 WeakPolarHBondContact CG2-O 3.44Å; V515-L544 HydrophobicContact CG2-CB 4.3Å; V515-L544 HydrophobicContact CG2-CD1 4.5Å; V515-W547 HydrophobicContact CG1-CB 4.01Å; V515-W547 HydrophobicContact CG1-CG 4.08Å; V515-W547 HydrophobicContact CG2-CB 3.79Å; V515-W547 HydrophobicContact CG2-CG 4.2Å
516	R	84.3	Confident	85.7	Confident	215 Å²	215	47.2 Å²	47.2	81%	0.811	25%	0.249	S	C	*	.	I	π-helix	trans	-68.3	133.1	175.3	-70.8	-178.5	177	168.7	-0.5	109.4	V518 D520	R516-V518 PolarHBondContact O-N 3.12Å; R516-D520 VanDerWaalsContact CA-OD2 3.32Å; R516-D520 WeakPolarHBondContact CA-OD2 3.27Å
517	G	81.5	Confident	85.2	Confident	14 Å²	14	47 Å²	47	14%	0.144	25%	0.249	C	C	.	.	I	π-helix	trans	69.3	8.7	-179.9	0	0	0	0	0	115	N493 D520 Q521	N493-G517 WeakPolarHBondContact CA-O 3.33Å; N493-G517 PolarHBondContact N-O 3.39Å; G517-D520 WeakPolarHBondContact CA-OD1 3.44Å; G517-D520 VanDerWaalsContact N-CG 3.32Å; G517-D520 PolarHBondContact N-OD1 2.79Å; G517-D520 PolarHBondContact N-OD2 3.29Å; G517-D520 VanDerWaalsContact N-OD2 3.1Å; G517-Q521 PolarHBondContact O-NE2 2.9Å; G517-Q521 PolarHBondContact O-OE1 3.05Å
518	V	88.1	Confident	85.1	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.232	C	C	.	.	I	π-helix	trans	-141.6	-76.8	-177.7	-179.3	0	0	0	0	110.7	L490 P491 V494 F495 P514 V515 R516 D520 Q521	L490-V518 HydrophobicContact CB-CG1 4.26Å; L490-V518 HydrophobicContact CD1-CG1 3.98Å; P491-V518 WeakPolarHBondContact O-CG2 3.25Å; V494-V518 HydrophobicContact CG1-CG1 4.14Å; V494-V518 HydrophobicContact CG1-CG2 4.35Å; F495-V518 HydrophobicContact CD2-CG1 3.9Å; F495-V518 HydrophobicContact CE2-CG1 3.79Å; P514-V518 HydrophobicContact CB-CG2 4.5Å; P514-V518 HydrophobicContact CG-CG2 4Å; P514-V518 WeakPolarHBondContact O-CB 3.5Å; V515-V518 PolarHBondContact O-N 2.92Å; R516-V518 PolarHBondContact O-N 3.12Å; V518-D520 PolarHBondContact N-OD1 2.97Å; V518-Q521 PolarHBondContact O-N 3.47Å
519	L	85.8	Confident	84.5	Confident	3 Å²	3	44.2 Å²	44.2	2%	0.016	23%	0.234	C	C	.	.	I	π-helix	trans	-80.5	-14.6	-177.7	-63.3	-172	0	0	0	114.1	L513 V515 L522 I528 L544 W547	L513-L519 HydrophobicContact CD2-CD1 3.78Å; L513-L519 HydrophobicContact CD2-CD2 4.36Å; L513-L519 HydrophobicContact CD2-CG 4.28Å; L513-L519 HydrophobicContact CG-CD1 4.2Å; L513-L519 HydrophobicContact CG-CG 4.45Å; V515-L519 HydrophobicContact CG1-CB 4.4Å; V515-L519 HydrophobicContact CG2-CB 4.38Å; V515-L519 HydrophobicContact CG2-CD1 4.23Å; V515-L519 PolarHBondContact O-N 2.8Å; V515-L519 VanDerWaalsContact O-N 3.12Å; L519-L522 HydrophobicContact CD2-CD1 3.81Å; L519-I528 HydrophobicContact CD2-CD1 3.89Å; L519-L544 HydrophobicContact CD1-CD1 3.69Å; L519-W547 HydrophobicContact CB-CD2 4.32Å; L519-W547 HydrophobicContact CB-CZ2 4.17Å; L519-W547 HydrophobicContact CD1-CD2 4.06Å; L519-W547 HydrophobicContact CD1-CE3 4.05Å; L519-W547 HydrophobicContact CD1-CH2 4.35Å; L519-W547 HydrophobicContact CD1-CZ2 4.33Å; L519-W547 HydrophobicContact CD1-CZ3 4.2Å; L519-W547 PolarHBondContact O-NE1 3.4Å
520	D	82.3	Confident	84.2	Confident	91 Å²	91	40.2 Å²	40.2	49%	0.487	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-22.7	170.8	60.4	-8.7	0	0	0	113.2	V515 R516 G517 V518	V515-D520 WeakPolarHBondContact O-CB 3.37Å; V515-D520 PolarHBondContact O-N 2.94Å; R516-D520 VanDerWaalsContact CA-OD2 3.32Å; R516-D520 WeakPolarHBondContact CA-OD2 3.27Å; G517-D520 WeakPolarHBondContact CA-OD1 3.44Å; G517-D520 VanDerWaalsContact N-CG 3.32Å; G517-D520 PolarHBondContact N-OD1 2.79Å; G517-D520 PolarHBondContact N-OD2 3.29Å; G517-D520 VanDerWaalsContact N-OD2 3.1Å; V518-D520 PolarHBondContact N-OD1 2.97Å
521	Q	81.7	Confident	83.7	Confident	53 Å²	53	41.3 Å²	41.3	25%	0.248	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-26.2	177.2	-51.9	-168.3	-29.1	0	0	112.4	N493 G517 V518 S523	N493-Q521 PolarHBondContact OD1-NE2 3.06Å; G517-Q521 PolarHBondContact O-NE2 2.9Å; G517-Q521 PolarHBondContact O-OE1 3.05Å; V518-Q521 PolarHBondContact O-N 3.47Å; Q521-S523 PolarHBondContact O-N 3.47Å
522	L	83.4	Confident	83.4	Confident	12 Å²	12	42.7 Å²	42.7	6%	0.063	22%	0.223	C	C	.	.			trans	-79	56.5	-171.8	-56.9	-175.2	0	0	0	113.2	F495 L500 L503 L519 A524 L525	F495-L522 HydrophobicContact CB-CD2 3.67Å; F495-L522 HydrophobicContact CD2-CD1 3.99Å; F495-L522 HydrophobicContact CD2-CD2 3.79Å; F495-L522 HydrophobicContact CD2-CG 4.15Å; F495-L522 HydrophobicContact CE2-CD1 4.21Å; F495-L522 HydrophobicContact CG-CD2 3.86Å; L500-L522 HydrophobicContact CB-CD2 4.13Å; L500-L522 HydrophobicContact CD1-CD2 4.21Å; L503-L522 HydrophobicContact CD2-CD1 3.91Å; L519-L522 HydrophobicContact CD2-CD1 3.81Å; L522-A524 PolarHBondContact O-N 2.71Å; L522-L525 HydrophobicContact CB-CB 4.02Å; L522-L525 HydrophobicContact CB-CD2 4.14Å; L522-L525 HydrophobicContact CD1-CD1 4.33Å; L522-L525 HydrophobicContact CD1-CD2 4.04Å; L522-L525 VanDerWaalsContact O-CB 3.22Å; L522-L525 WeakPolarHBondContact O-CB 3.4Å; L522-L525 PolarHBondContact O-N 2.98Å; L522-L525 VanDerWaalsContact O-N 3.17Å
523	S	78	Confident	83.4	Confident	117 Å²	117	39.7 Å²	39.7	82%	0.818	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-20.6	-177.5	58.7	0	0	0	0	115.1	Q521	Q521-S523 PolarHBondContact O-N 3.47Å
524	A	80.1	Confident	83.5	Confident	37 Å²	37	41.1 Å²	41.1	31%	0.306	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97	5.8	178.4	0	0	0	0	0	114	L500 T501 L522 I526	L500-A524 CarbonylContact O-C 3.17Å; T501-A524 WeakPolarHBondContact CA-O 3.48Å; L522-A524 PolarHBondContact O-N 2.71Å; A524-I526 PolarHBondContact O-N 3.4Å
525	L	82.4	Confident	83.7	Confident	7 Å²	7	39.7 Å²	39.7	4%	0.037	21%	0.209	C	C	.	.			trans	-70.4	121.6	-170.8	-163.7	67.7	0	0	0	112.2	L500 L503 L522 Q527 I528 W547 P562	L500-L525 PolarHBondContact O-N 3.39Å; L503-L525 HydrophobicContact CB-CD1 4.19Å; L522-L525 HydrophobicContact CB-CB 4.02Å; L522-L525 HydrophobicContact CB-CD2 4.14Å; L522-L525 HydrophobicContact CD1-CD1 4.33Å; L522-L525 HydrophobicContact CD1-CD2 4.04Å; L522-L525 VanDerWaalsContact O-CB 3.22Å; L522-L525 WeakPolarHBondContact O-CB 3.4Å; L522-L525 PolarHBondContact O-N 2.98Å; L522-L525 VanDerWaalsContact O-N 3.17Å; L525-Q527 WeakPolarHBondContact CD1-O 3.49Å; L525-I528 HydrophobicContact CD2-CB 4.18Å; L525-I528 HydrophobicContact CD2-CD1 4.4Å; L525-W547 HydrophobicContact CD2-CH2 3.94Å; L525-W547 HydrophobicContact CD2-CZ2 3.93Å; L525-P562 HydrophobicContact CB-CB 4.39Å; L525-P562 HydrophobicContact CB-CG 4.33Å; L525-P562 HydrophobicContact CD2-CB 4.38Å; L525-P562 HydrophobicContact CG-CB 4.3Å; L525-P562 WeakPolarHBondContact O-CB 3.47Å; L525-P562 VanDerWaalsContact O-CG 3.25Å; L525-P562 WeakPolarHBondContact O-CG 3.44Å
526	I	74.1	Confident	83.9	Confident	81 Å²	81	40.8 Å²	40.8	42%	0.415	22%	0.215	S	C	.	.			trans	-99.1	-27.2	176.2	-58.2	176	0	0	0	110.4	T501 A524 V563	T501-I526 WeakPolarHBondContact O-CA 2.98Å; T501-I526 PolarHBondContact O-N 2.81Å; A524-I526 PolarHBondContact O-N 3.4Å; I526-V563 PolarHBondContact O-N 3.46Å
527	Q	74.9	Confident	84.1	Confident	36 Å²	36	30.6 Å²	30.6	17%	0.168	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	136	-169.9	-162.4	176.2	8.8	0	0	112.3	T501 R502 L503 L525 V563 I565	T501-Q527 PolarHBondContact O-N 3.38Å; T501-Q527 VanDerWaalsContact O-N 3.12Å; R502-Q527 WeakPolarHBondContact CA-O 3.48Å; R502-Q527 VanDerWaalsContact CD-OE1 3.3Å; R502-Q527 HydrophobicContact CG-CB 4.04Å; L503-Q527 PolarHBondContact N-O 3.03Å; L503-Q527 VanDerWaalsContact N-O 3.13Å; L525-Q527 WeakPolarHBondContact CD1-O 3.49Å; Q527-V563 WeakPolarHBondContact CA-O 3.16Å; Q527-I565 HydrophobicContact CG-CD1 3.79Å; Q527-I565 HydrophobicContact CG-CG1 3.74Å
528	I	84.9	Confident	84.4	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	137.7	171.8	-165	171.3	0	0	0	111.7	L503 L519 L525 L530 W547 V563 V564 I565	L503-I528 HydrophobicContact CB-CG1 4.29Å; L503-I528 HydrophobicContact CD2-CD1 4.1Å; L503-I528 HydrophobicContact CG-CG1 4.43Å; L503-I528 VanDerWaalsContact O-CA 3.29Å; L503-I528 WeakPolarHBondContact O-CA 3.05Å; L519-I528 HydrophobicContact CD2-CD1 3.89Å; L525-I528 HydrophobicContact CD2-CB 4.18Å; L525-I528 HydrophobicContact CD2-CD1 4.4Å; I528-L530 HydrophobicContact CD1-CD1 4.37Å; I528-L530 HydrophobicContact CD1-CD2 3.9Å; I528-L530 HydrophobicContact CD1-CG 4.19Å; I528-L530 HydrophobicContact CG1-CD2 4.1Å; I528-L530 HydrophobicContact CG1-CG 4.12Å; I528-W547 HydrophobicContact CD1-CH2 4.34Å; I528-W547 HydrophobicContact CG2-CH2 3.96Å; I528-W547 HydrophobicContact CG2-CZ3 4.14Å; I528-V563 PolarHBondContact N-O 2.82Å; I528-V564 HydrophobicContact CG2-CB 4.26Å; I528-V564 HydrophobicContact CG2-CG1 4.3Å; I528-V564 HydrophobicContact CG2-CG2 3.89Å; I528-V564 CarbonylContact O-C 3.59Å; I528-V564 WeakPolarHBondContact O-CA 3.47Å; I528-I565 PolarHBondContact O-N 3.03Å
529	D	81.3	Confident	84.2	Confident	11 Å²	11	34.9 Å²	34.9	6%	0.059	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	130.5	170.8	-167.2	-16.2	0	0	0	110.1	L503 N504 L505 R506 Q531 I565	L503-D529 PolarHBondContact O-N 3.03Å; L503-D529 VanDerWaalsContact O-N 3.07Å; N504-D529 WeakPolarHBondContact OD1-CB 3.43Å; L505-D529 PolarHBondContact N-O 3.08Å; R506-D529 HydrophobicContact CB-CB 4.48Å; D529-Q531 WeakPolarHBondContact OD1-CB 3.28Å; D529-Q531 PolarHBondContact OD1-N 3.46Å; D529-I565 HydrophobicContact CB-CB 4.21Å; D529-I565 HydrophobicContact CB-CD1 4Å; D529-I565 HydrophobicContact CB-CG1 4.3Å
530	L	88.7	Confident	84.2	Confident	1 Å²	1	40.5 Å²	40.5	1%	0.005	23%	0.232	C	C	.	.			trans	-132	8.9	-173.8	-64.6	178.8	0	0	0	112.3	L505 L513 I528 W535 L544 V568	L505-L530 HydrophobicContact CB-CD2 4.26Å; L505-L530 HydrophobicContact CD1-CD2 3.95Å; L513-L530 HydrophobicContact CD2-CD2 3.73Å; I528-L530 HydrophobicContact CD1-CD1 4.37Å; I528-L530 HydrophobicContact CD1-CD2 3.9Å; I528-L530 HydrophobicContact CD1-CG 4.19Å; I528-L530 HydrophobicContact CG1-CD2 4.1Å; I528-L530 HydrophobicContact CG1-CG 4.12Å; L530-W535 HydrophobicContact CB-CZ2 3.96Å; L530-W535 HydrophobicContact CD2-CH2 4.31Å; L530-W535 HydrophobicContact CD2-CZ2 4.14Å; L530-W535 HydrophobicContact CG-CZ2 4.49Å; L530-W535 PolarHBondContact O-NE1 2.82Å; L530-L544 HydrophobicContact CD1-CD1 4.19Å; L530-V568 HydrophobicContact CB-CG2 3.66Å; L530-V568 HydrophobicContact CD1-CG2 3.8Å; L530-V568 HydrophobicContact CG-CG2 4.39Å
531	Q	83.1	Confident	84.4	Confident	23 Å²	23	36.2 Å²	36.2	11%	0.107	21%	0.209	C	C	.	.			trans	-67.7	163.7	-175	-158.6	-174.7	-71	0	0	112.1	R506 N507 D529 N533 N566	R506-Q531 VanDerWaalsContact CA-O 3.31Å; R506-Q531 WeakPolarHBondContact CA-O 3.4Å; R506-Q531 HydrophobicContact CG-CB 4.19Å; N507-Q531 PolarHBondContact N-O 2.98Å; D529-Q531 WeakPolarHBondContact OD1-CB 3.28Å; D529-Q531 PolarHBondContact OD1-N 3.46Å; Q531-N533 VanDerWaalsContact C-N 3.34Å; Q531-N533 PolarHBondContact O-N 3.49Å; Q531-N533 PolarHBondContact O-ND2 2.83Å; Q531-N566 VanDerWaalsContact OE1-CB 3.31Å; Q531-N566 PolarHBondContact OE1-ND2 2.84Å
532	E	83.4	Confident	84.6	Confident	73 Å²	73	35.4 Å²	35.4	34%	0.341	21%	0.205	S	C	.	.	S	Bend	trans	57	43.6	171.2	-70.9	153.4	-162.1	0	0	112.8	R506 N507 N508	R506-E532 HydrophobicContact CG-CB 4.46Å; R506-E532 IonicContact CZ-OE1 3.71Å; R506-E532 IonicContact CZ-OE2 3.23Å; R506-E532 VanDerWaalsContact NE-CD 3.34Å; R506-E532 IonicContact NE-OE1 3.4Å; R506-E532 PolarHBondContact NE-OE1 3.18Å; R506-E532 IonicContact NE-OE2 2.71Å; R506-E532 PolarHBondContact NE-OE2 2.88Å; R506-E532 IonicContact NH2-OE1 2.98Å; R506-E532 PolarHBondContact NH2-OE1 2.78Å; R506-E532 IonicContact NH2-OE2 3.74Å; R506-E532 PolarHBondContact NH2-OE2 3.32Å; R506-E532 VanDerWaalsContact NH2-OE2 3.13Å; N507-E532 WeakPolarHBondContact CA-O 3.39Å; N507-E532 HydrophobicContact CB-CB 4.04Å; N508-E532 PolarHBondContact N-O 3.01Å
533	N	90.6	Very high	84.7	Confident	10 Å²	10	36.5 Å²	36.5	5%	0.053	22%	0.219	C	C	.	.			trans	-126.2	145.1	177.1	-88.8	-84.1	0	0	0	110	L505 N508 H509 F510 Q531 W535	L505-N533 PolarHBondContact O-ND2 3.18Å; N508-N533 VanDerWaalsContact CA-OD1 3.25Å; N508-N533 WeakPolarHBondContact CA-OD1 3.21Å; N508-N533 WeakPolarHBondContact CB-OD1 3.23Å; N508-N533 PolarHBondContact N-OD1 2.72Å; N508-N533 PolarHBondContact O-OD1 3.17Å; H509-N533 PolarHBondContact N-OD1 3.1Å; F510-N533 HydrophobicContact CB-CB 4.33Å; F510-N533 WeakPolarHBondContact CB-OD1 3.44Å; F510-N533 VanDerWaalsContact CD2-OD1 3.26Å; F510-N533 WeakPolarHBondContact CD2-OD1 3.38Å; F510-N533 PolarHBondContact N-OD1 2.86Å; Q531-N533 VanDerWaalsContact C-N 3.34Å; Q531-N533 PolarHBondContact O-N 3.49Å; Q531-N533 PolarHBondContact O-ND2 2.83Å; N533-W535 HydrophobicContact CB-CD2 4.24Å; N533-W535 HydrophobicContact CB-CG 4.42Å; N533-W535 HydrophobicContact CB-CZ2 3.81Å; N533-W535 VanDerWaalsContact CB-NE1 3.3Å; N533-W535 PolarHBondContact O-N 2.01Å
534	P	91.4	Very high	85.1	Confident	34 Å²	34	31 Å²	31	22%	0.221	18%	0.18	C	C	.	.			trans	-80.9	57.8	-172.8	35.6	-39.2	0	0	0	112.3	N508 H509 F510 S511 D536 E571	N508-P534 WeakPolarHBondContact O-CD 3.05Å; H509-P534 HydrophobicContact CB-CG 4.5Å; F510-P534 CarbonylContact O-C 3.28Å; F510-P534 WeakPolarHBondContact O-CD 3.34Å; S511-P534 WeakPolarHBondContact CA-O 3.5Å; P534-D536 PolarHBondContact O-N 3.13Å; P534-E571 WeakPolarHBondContact CA-OE2 3.48Å; P534-E571 HydrophobicContact CB-CB 4.37Å; P534-E571 VanDerWaalsContact CB-OE2 3.31Å; P534-E571 WeakPolarHBondContact CB-OE2 3.43Å
535	W	92.4	Very high	85.4	Confident	1 Å²	1	30 Å²	30	0%	0.004	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.1	125.6	-171.1	-63.1	105	0	0	0	112.2	F510 S511 L513 L530 N533 I541 L544 V568 I569 C570 E571 S572	F510-W535 HydrophobicContact CB-CE3 4.32Å; F510-W535 HydrophobicContact CB-CH2 3.58Å; F510-W535 HydrophobicContact CB-CZ2 4.14Å; F510-W535 HydrophobicContact CB-CZ3 3.69Å; F510-W535 HydrophobicContact CG-CH2 4.2Å; S511-W535 CarbonylContact O-C 3.43Å; S511-W535 WeakPolarHBondContact O-CA 3.29Å; L513-W535 HydrophobicContact CB-CH2 3.79Å; L513-W535 HydrophobicContact CB-CZ3 3.65Å; L513-W535 HydrophobicContact CD2-CH2 4.16Å; L530-W535 HydrophobicContact CB-CZ2 3.96Å; L530-W535 HydrophobicContact CD2-CH2 4.31Å; L530-W535 HydrophobicContact CD2-CZ2 4.14Å; L530-W535 HydrophobicContact CG-CZ2 4.49Å; L530-W535 PolarHBondContact O-NE1 2.82Å; N533-W535 HydrophobicContact CB-CD2 4.24Å; N533-W535 HydrophobicContact CB-CG 4.42Å; N533-W535 HydrophobicContact CB-CZ2 3.81Å; N533-W535 VanDerWaalsContact CB-NE1 3.3Å; N533-W535 PolarHBondContact O-N 2.01Å; W535-I541 HydrophobicContact CB-CD1 4Å; W535-I541 HydrophobicContact CD2-CD1 4.41Å; W535-I541 HydrophobicContact CE3-CD1 3.89Å; W535-L544 HydrophobicContact CE3-CD2 4.01Å; W535-L544 HydrophobicContact CH2-CD2 4.05Å; W535-L544 HydrophobicContact CZ3-CD2 3.71Å; W535-V568 HydrophobicContact CB-CG1 4.49Å; W535-V568 HydrophobicContact CD2-CG1 3.98Å; W535-V568 HydrophobicContact CG-CG1 3.77Å; W535-I569 VanDerWaalsContact CD1-O 3.25Å; W535-C570 CarbonylContact O-C 3.42Å; W535-E571 PolarHBondContact O-N 2.88Å; W535-S572 PolarHBondContact O-N 3.11Å
536	D	89.4	Confident	85.5	Confident	38 Å²	38	31.7 Å²	31.7	20%	0.203	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	105.3	174.8	-177.1	56.9	0	0	0	110.3	S511 P534 T538 S572	S511-D536 PolarHBondContact O-N 3.28Å; P534-D536 PolarHBondContact O-N 3.13Å; D536-T538 PolarHBondContact O-N 3.03Å; D536-T538 WeakPolarHBondContact OD2-CB 3.35Å; D536-T538 WeakPolarHBondContact OD2-CG2 3.2Å; D536-T538 PolarHBondContact OD2-OG1 3.03Å; D536-S572 CarbonylContact C-O 3.03Å; D536-S572 WeakPolarHBondContact CA-O 3.31Å; D536-S572 VanDerWaalsContact OD1-C 3.32Å; D536-S572 WeakPolarHBondContact OD1-CB 3.45Å; D536-S572 PolarHBondContact OD1-OG 3.45Å
537	C	88.4	Confident	86.1	Confident	1 Å²	1	28.6 Å²	28.6	1%	0.007	16%	0.161	C	C	.	.			trans	-88	54.6	-175.2	-66	0	0	0	0	112.6	I541 C570 S572 H576 L584	C537-I541 HydrophobicContact CB-CG2 4.19Å; C537-C570 HydrophobicContact CB-CB 3.75Å; C537-C570 WeakPolarHBondContact CB-SG 3.37Å; C537-C570 WeakPolarHBondContact SG-CB 3.48Å; C537-C570 CovalentContact SG-SG 2.02Å; C537-C570 PolarHBondContact SG-SG 3.4Å; C537-S572 PolarHBondContact N-O 3.04Å; C537-H576 HydrophobicContact CB-CB 4.34Å; C537-L584 HydrophobicContact CB-CD1 3.57Å
538	T	87.2	Confident	86.4	Confident	45 Å²	45	27.3 Å²	27.3	28%	0.276	16%	0.155	S	C	.	.	S	Bend	trans	-95.9	179	166.2	57.8	0	0	0	0	110.7	D536 D540 I541 P573 I589	D536-T538 PolarHBondContact O-N 3.03Å; D536-T538 WeakPolarHBondContact OD2-CB 3.35Å; D536-T538 WeakPolarHBondContact OD2-CG2 3.2Å; D536-T538 PolarHBondContact OD2-OG1 3.03Å; T538-D540 PolarHBondContact O-N 3.19Å; T538-I541 WeakPolarHBondContact O-CG2 3.3Å; T538-I541 PolarHBondContact O-N 3.18Å; T538-P573 HydrophobicContact CG2-CG 4.29Å; T538-I589 WeakPolarHBondContact O-CG2 3.3Å
539	C	85.4	Confident	86.2	Confident	58 Å²	58	29.4 Å²	29.4	39%	0.392	17%	0.165	S	C	.	.	G	3₁₀ helix	trans	-44.7	-32.9	-178.3	-71.7	0	0	0	0	115	I541 M542 C590	C539-I541 VanDerWaalsContact C-N 3.33Å; C539-I541 PolarHBondContact O-N 3.48Å; C539-M542 WeakPolarHBondContact O-CB 3.29Å; C539-M542 WeakPolarHBondContact O-CG 3.34Å; C539-M542 PolarHBondContact O-N 3.12Å; C539-C590 HydrophobicContact CB-CB 3.89Å; C539-C590 WeakPolarHBondContact CB-SG 3.34Å; C539-C590 VanDerWaalsContact SG-CA 3.51Å; C539-C590 WeakPolarHBondContact SG-CB 3.33Å; C539-C590 CovalentContact SG-SG 2.05Å; C539-C590 PolarHBondContact SG-SG 3.06Å
540	D	84.1	Confident	86	Confident	122 Å²	122	35.5 Å²	35.5	65%	0.652	19%	0.187	S	C	*	.	G	3₁₀ helix	trans	-67.7	-28.9	-176	-61.8	-38	0	0	0	113.3	T538 M542	T538-D540 PolarHBondContact O-N 3.19Å; D540-M542 PolarHBondContact O-N 3.38Å
541	I	88	Confident	85.1	Confident	1 Å²	1	36.2 Å²	36.2	1%	0.005	19%	0.192	C	C	.	.	G	3₁₀ helix	trans	-75.4	-8.3	179	-147.2	162.2	0	0	0	113.4	W535 C537 T538 C539 G543 L544 R545 L581 I589	W535-I541 HydrophobicContact CB-CD1 4Å; W535-I541 HydrophobicContact CD2-CD1 4.41Å; W535-I541 HydrophobicContact CE3-CD1 3.89Å; C537-I541 HydrophobicContact CB-CG2 4.19Å; T538-I541 WeakPolarHBondContact O-CG2 3.3Å; T538-I541 PolarHBondContact O-N 3.18Å; C539-I541 VanDerWaalsContact C-N 3.33Å; C539-I541 PolarHBondContact O-N 3.48Å; I541-G543 PolarHBondContact O-N 3.38Å; I541-G543 VanDerWaalsContact O-N 3.12Å; I541-L544 HydrophobicContact CD1-CD2 4.35Å; I541-L544 HydrophobicContact CG1-CB 4.11Å; I541-L544 HydrophobicContact CG1-CD2 4.13Å; I541-L544 PolarHBondContact O-N 3.24Å; I541-R545 PolarHBondContact O-N 3.31Å; I541-L581 HydrophobicContact CB-CD1 4.34Å; I541-L581 HydrophobicContact CD1-CD1 4.07Å; I541-L581 HydrophobicContact CD1-CD2 3.81Å; I541-L581 HydrophobicContact CG1-CD1 3.99Å; I541-L581 HydrophobicContact CG1-CD2 3.77Å; I541-L581 HydrophobicContact CG2-CD1 3.47Å; I541-L581 VanDerWaalsContact CG2-CD1 3.47Å; I541-I589 HydrophobicContact CG2-CD1 4.46Å; I541-I589 HydrophobicContact CG2-CG2 4.27Å
542	M	85.1	Confident	84.2	Confident	36 Å²	36	37.6 Å²	37.6	18%	0.177	20%	0.202	C	C	.	.	H	α-helix	trans	-56.8	-30.1	-178.6	-74.9	-73.4	-83.8	0	0	113.1	C539 D540 N546 K586 I589 C590	C539-M542 WeakPolarHBondContact O-CB 3.29Å; C539-M542 WeakPolarHBondContact O-CG 3.34Å; C539-M542 PolarHBondContact O-N 3.12Å; D540-M542 PolarHBondContact O-N 3.38Å; M542-N546 WeakPolarHBondContact O-CB 3.22Å; M542-N546 PolarHBondContact O-N 3.15Å; M542-N546 VanDerWaalsContact O-N 3.08Å; M542-N546 PolarHBondContact O-ND2 3.15Å; M542-N546 VanDerWaalsContact O-ND2 3.08Å; M542-K586 HydrophobicContact CE-CB 3.67Å; M542-K586 HydrophobicContact CE-CG 3.96Å; M542-I589 HydrophobicContact CG-CB 4.4Å; M542-I589 HydrophobicContact CG-CG2 3.7Å; M542-I589 HydrophobicContact SD-CB 3.89Å; M542-I589 HydrophobicContact SD-CD1 3.94Å; M542-I589 HydrophobicContact SD-CG2 3.84Å; M542-C590 HydrophobicContact CE-CB 4.43Å; M542-C590 HydrophobicContact CG-CB 4.23Å
543	G	85	Confident	83.3	Confident	34 Å²	34	37.6 Å²	37.6	35%	0.351	20%	0.204	S	C	.	.	H	α-helix	trans	-58.2	-56.4	170.8	0	0	0	0	0	111.6	V515 I541 N546 W547	V515-G543 VanDerWaalsContact CG2-C 3.41Å; V515-G543 WeakPolarHBondContact CG2-O 3.44Å; I541-G543 PolarHBondContact O-N 3.38Å; I541-G543 VanDerWaalsContact O-N 3.12Å; G543-N546 PolarHBondContact O-N 3.19Å; G543-W547 PolarHBondContact O-N 3.48Å
544	L	88.1	Confident	81.2	Confident	1 Å²	1	46 Å²	46	1%	0.005	24%	0.243	C	C	.	.	H	α-helix	trans	-61.8	-45.1	-179.4	-177.7	64.6	0	0	0	111.4	L513 V515 L519 L530 W535 I541 N546 W547 I548 L581	L513-L544 HydrophobicContact CB-CD1 4.49Å; L513-L544 HydrophobicContact CB-CD2 4.2Å; L513-L544 HydrophobicContact CD2-CD1 4.32Å; V515-L544 HydrophobicContact CG2-CB 4.3Å; V515-L544 HydrophobicContact CG2-CD1 4.5Å; L519-L544 HydrophobicContact CD1-CD1 3.69Å; L530-L544 HydrophobicContact CD1-CD1 4.19Å; W535-L544 HydrophobicContact CE3-CD2 4.01Å; W535-L544 HydrophobicContact CH2-CD2 4.05Å; W535-L544 HydrophobicContact CZ3-CD2 3.71Å; I541-L544 HydrophobicContact CD1-CD2 4.35Å; I541-L544 HydrophobicContact CG1-CB 4.11Å; I541-L544 HydrophobicContact CG1-CD2 4.13Å; I541-L544 PolarHBondContact O-N 3.24Å; L544-N546 PolarHBondContact O-N 3.29Å; L544-W547 HydrophobicContact CD1-CE3 4.45Å; L544-W547 WeakPolarHBondContact O-CB 3.49Å; L544-W547 PolarHBondContact O-N 2.82Å; L544-W547 VanDerWaalsContact O-N 3.12Å; L544-I548 HydrophobicContact CD1-CD1 4.19Å; L544-I548 HydrophobicContact CD1-CG1 4.31Å; L544-I548 HydrophobicContact CG-CD1 3.99Å; L544-I548 HydrophobicContact CG-CG1 4.46Å; L544-I548 WeakPolarHBondContact O-CG1 3.11Å; L544-I548 PolarHBondContact O-N 3.39Å; L544-L581 HydrophobicContact CB-CD2 4.08Å; L544-L581 HydrophobicContact CD2-CD2 3.56Å; L544-L581 HydrophobicContact CG-CD2 3.66Å
545	R	86.3	Confident	79.2	Confident	16 Å²	16	52 Å²	52	6%	0.06	27%	0.273	C	S	.	.	H	α-helix	trans	-51.1	-55	174.2	-174.6	-164.1	172.9	-64.1	-13.5	111.4	I541 W547 I548 E549 L581 L584	I541-R545 PolarHBondContact O-N 3.31Å; R545-W547 PolarHBondContact O-N 3.24Å; R545-I548 PolarHBondContact O-N 2.74Å; R545-E549 IonicContact CZ-OE1 3.55Å; R545-E549 VanDerWaalsContact CZ-OE1 3.23Å; R545-E549 IonicContact NH1-OE1 2.75Å; R545-E549 PolarHBondContact NH1-OE1 3.21Å; R545-E549 IonicContact NH1-OE2 3.95Å; R545-E549 PolarHBondContact NH1-OE2 2.67Å; R545-E549 IonicContact NH2-OE1 3.79Å; R545-E549 PolarHBondContact NH2-OE1 3.17Å; R545-E549 WeakPolarHBondContact O-CB 3.46Å; R545-E549 PolarHBondContact O-N 3.2Å; R545-L581 HydrophobicContact CB-CD1 3.85Å; R545-L581 HydrophobicContact CB-CG 4.08Å; R545-L581 HydrophobicContact CG-CD1 4.29Å; R545-L581 HydrophobicContact CG-CG 4.46Å; R545-L584 PolarHBondContact NE-O 2.9Å; R545-L584 PolarHBondContact NH2-O 3.07Å
546	N	84.7	Confident	77.1	Confident	43 Å²	43	56.7 Å²	56.7	23%	0.23	30%	0.298	C	S	.	.	H	α-helix	trans	-70.7	-19.1	-175.6	-66.7	-24.3	0	0	0	112.4	M542 G543 L544 R550 K586	M542-N546 WeakPolarHBondContact O-CB 3.22Å; M542-N546 PolarHBondContact O-N 3.15Å; M542-N546 VanDerWaalsContact O-N 3.08Å; M542-N546 PolarHBondContact O-ND2 3.15Å; M542-N546 VanDerWaalsContact O-ND2 3.08Å; G543-N546 PolarHBondContact O-N 3.19Å; L544-N546 PolarHBondContact O-N 3.29Å; N546-R550 PolarHBondContact O-NE 3.24Å; N546-R550 PolarHBondContact O-NH2 2.92Å; N546-K586 VanDerWaalsContact OD1-CE 3.28Å; N546-K586 WeakPolarHBondContact OD1-CE 3.29Å
547	W	85.6	Confident	75.1	Confident	17 Å²	17	64.3 Å²	64.3	6%	0.064	33%	0.333	C	S	.	.	H	α-helix	trans	-77	-49.6	170.3	-177.2	95.7	0	0	0	111	V515 L519 L525 I528 G543 L544 R545 E549 R550 V551 V564	V515-W547 HydrophobicContact CG1-CB 4.01Å; V515-W547 HydrophobicContact CG1-CG 4.08Å; V515-W547 HydrophobicContact CG2-CB 3.79Å; V515-W547 HydrophobicContact CG2-CG 4.2Å; L519-W547 HydrophobicContact CB-CD2 4.32Å; L519-W547 HydrophobicContact CB-CZ2 4.17Å; L519-W547 HydrophobicContact CD1-CD2 4.06Å; L519-W547 HydrophobicContact CD1-CE3 4.05Å; L519-W547 HydrophobicContact CD1-CH2 4.35Å; L519-W547 HydrophobicContact CD1-CZ2 4.33Å; L519-W547 HydrophobicContact CD1-CZ3 4.2Å; L519-W547 PolarHBondContact O-NE1 3.4Å; L525-W547 HydrophobicContact CD2-CH2 3.94Å; L525-W547 HydrophobicContact CD2-CZ2 3.93Å; I528-W547 HydrophobicContact CD1-CH2 4.34Å; I528-W547 HydrophobicContact CG2-CH2 3.96Å; I528-W547 HydrophobicContact CG2-CZ3 4.14Å; G543-W547 PolarHBondContact O-N 3.48Å; L544-W547 HydrophobicContact CD1-CE3 4.45Å; L544-W547 WeakPolarHBondContact O-CB 3.49Å; L544-W547 PolarHBondContact O-N 2.82Å; L544-W547 VanDerWaalsContact O-N 3.12Å; R545-W547 PolarHBondContact O-N 3.24Å; W547-E549 VanDerWaalsContact C-N 3.29Å; W547-E549 PolarHBondContact O-N 3.19Å; W547-R550 PolarHBondContact O-N 3.45Å; W547-V551 HydrophobicContact CD2-CG2 4Å; W547-V551 HydrophobicContact CE3-CG2 4.26Å; W547-V551 HydrophobicContact CH2-CG2 4.36Å; W547-V551 HydrophobicContact CZ2-CG2 4.12Å; W547-V551 HydrophobicContact CZ3-CG2 4.43Å; W547-V551 WeakPolarHBondContact O-CB 3.43Å; W547-V551 VanDerWaalsContact O-CG2 3.28Å; W547-V551 WeakPolarHBondContact O-CG2 3.2Å; W547-V551 PolarHBondContact O-N 3.1Å; W547-V564 HydrophobicContact CZ3-CG2 4.28Å
548	I	82.3	Confident	73.3	Confident	9 Å²	9	70.8 Å²	70.8	5%	0.046	36%	0.363	C	S	.	.	H	α-helix	trans	-58.5	-40.7	176.3	-64.4	174	0	0	0	111.1	L544 R545 V551 T552 V568 L581 K582	L544-I548 HydrophobicContact CD1-CD1 4.19Å; L544-I548 HydrophobicContact CD1-CG1 4.31Å; L544-I548 HydrophobicContact CG-CD1 3.99Å; L544-I548 HydrophobicContact CG-CG1 4.46Å; L544-I548 WeakPolarHBondContact O-CG1 3.11Å; L544-I548 PolarHBondContact O-N 3.39Å; R545-I548 PolarHBondContact O-N 2.74Å; I548-V551 PolarHBondContact O-N 2.95Å; I548-T552 HydrophobicContact CG2-CG2 4.16Å; I548-T552 WeakPolarHBondContact O-CB 3.41Å; I548-T552 WeakPolarHBondContact O-CG2 3.17Å; I548-T552 PolarHBondContact O-N 2.9Å; I548-T552 PolarHBondContact O-OG1 3.16Å; I548-V568 HydrophobicContact CD1-CB 4.26Å; I548-V568 HydrophobicContact CD1-CG2 3.79Å; I548-L581 HydrophobicContact CD1-CD2 4.03Å; I548-K582 HydrophobicContact CG2-CB 4.24Å
549	E	79.9	Confident	71.2	Confident	43 Å²	43	73.3 Å²	73.3	20%	0.201	39%	0.388	C	S	.	.	H	α-helix	trans	-54.8	-61	174	-169.2	166.5	-104.5	0	0	110.7	R545 W547 V551 T552 D553 K586	R545-E549 IonicContact CZ-OE1 3.55Å; R545-E549 VanDerWaalsContact CZ-OE1 3.23Å; R545-E549 IonicContact NH1-OE1 2.75Å; R545-E549 PolarHBondContact NH1-OE1 3.21Å; R545-E549 IonicContact NH1-OE2 3.95Å; R545-E549 PolarHBondContact NH1-OE2 2.67Å; R545-E549 IonicContact NH2-OE1 3.79Å; R545-E549 PolarHBondContact NH2-OE1 3.17Å; R545-E549 WeakPolarHBondContact O-CB 3.46Å; R545-E549 PolarHBondContact O-N 3.2Å; W547-E549 VanDerWaalsContact C-N 3.29Å; W547-E549 PolarHBondContact O-N 3.19Å; E549-V551 PolarHBondContact O-N 3.06Å; E549-V551 VanDerWaalsContact O-N 3.14Å; E549-T552 PolarHBondContact O-N 2.87Å; E549-T552 VanDerWaalsContact O-N 3.16Å; E549-T552 PolarHBondContact O-OG1 2.79Å; E549-D553 PolarHBondContact O-N 2.9Å; E549-D553 VanDerWaalsContact O-N 3.17Å; E549-K586 VanDerWaalsContact OE2-CE 3.29Å; E549-K586 WeakPolarHBondContact OE2-CE 3.21Å; E549-K586 IonicContact OE2-NZ 2.67Å; E549-K586 PolarHBondContact OE2-NZ 3.15Å
550	R	76.9	Confident	69.7	Low	140 Å²	140	76.8 Å²	76.8	53%	0.528	40%	0.402	S	S	.	.	H	α-helix	trans	-56.5	-30.8	177.7	-80.5	176.1	-74.2	151.6	-0.9	115	N546 W547 N556	N546-R550 PolarHBondContact O-NE 3.24Å; N546-R550 PolarHBondContact O-NH2 2.92Å; W547-R550 PolarHBondContact O-N 3.45Å; R550-N556 PolarHBondContact O-ND2 2.86Å; R550-N556 VanDerWaalsContact O-ND2 3.15Å
551	V	70	Confident	68.4	Low	16 Å²	16	73.7 Å²	73.7	10%	0.097	39%	0.389	C	S	.	.	H	α-helix	trans	-83.2	-30.4	-178.2	163	0	0	0	0	112.4	W547 I548 E549 P561 P562 V564	W547-V551 HydrophobicContact CD2-CG2 4Å; W547-V551 HydrophobicContact CE3-CG2 4.26Å; W547-V551 HydrophobicContact CH2-CG2 4.36Å; W547-V551 HydrophobicContact CZ2-CG2 4.12Å; W547-V551 HydrophobicContact CZ3-CG2 4.43Å; W547-V551 WeakPolarHBondContact O-CB 3.43Å; W547-V551 VanDerWaalsContact O-CG2 3.28Å; W547-V551 WeakPolarHBondContact O-CG2 3.2Å; W547-V551 PolarHBondContact O-N 3.1Å; I548-V551 PolarHBondContact O-N 2.95Å; E549-V551 PolarHBondContact O-N 3.06Å; E549-V551 VanDerWaalsContact O-N 3.14Å; V551-P561 WeakPolarHBondContact O-CB 3.46Å; V551-P562 HydrophobicContact CG1-CB 3.77Å; V551-P562 HydrophobicContact CG1-CG 3.8Å; V551-P562 WeakPolarHBondContact CG1-O 3.35Å; V551-P562 HydrophobicContact CG2-CG 4.08Å; V551-V564 HydrophobicContact CG1-CG2 4.21Å
552	T	64.4	Low	67	Low	52 Å²	52	74.9 Å²	74.9	32%	0.319	40%	0.397	S	S	.	.	H	α-helix	trans	-99.2	-5.6	-176.4	54.7	0	0	0	0	114.3	I548 E549 Q554 V564 K582	I548-T552 HydrophobicContact CG2-CG2 4.16Å; I548-T552 WeakPolarHBondContact O-CB 3.41Å; I548-T552 WeakPolarHBondContact O-CG2 3.17Å; I548-T552 PolarHBondContact O-N 2.9Å; I548-T552 PolarHBondContact O-OG1 3.16Å; E549-T552 PolarHBondContact O-N 2.87Å; E549-T552 VanDerWaalsContact O-N 3.16Å; E549-T552 PolarHBondContact O-OG1 2.79Å; T552-Q554 PolarHBondContact O-N 3.3Å; T552-V564 HydrophobicContact CG2-CG2 4.34Å; T552-K582 WeakPolarHBondContact OG1-CD 3.24Å; T552-K582 PolarHBondContact OG1-NZ 2.97Å
553	D	63.4	Low	65.8	Low	72 Å²	72	77.4 Å²	77.4	39%	0.385	41%	0.414	S	S	.	.			trans	-84.8	110.2	179.7	-70.6	-11.1	0	0	0	112.1	E549 N555 N556 K582	E549-D553 PolarHBondContact O-N 2.9Å; E549-D553 VanDerWaalsContact O-N 3.17Å; D553-N555 PolarHBondContact O-N 2.83Å; D553-N556 PolarHBondContact O-N 3.47Å; D553-K582 IonicContact OD1-NZ 3.52Å; D553-K582 PolarHBondContact OD1-NZ 2.66Å
554	Q	48.3	Very low	65	Low	188 Å²	188	76.6 Å²	76.6	88%	0.879	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	-1.5	-171.6	-62.3	-173.5	-20.8	0	0	115.8	T552	T552-Q554 PolarHBondContact O-N 3.3Å
555	N	48.1	Very low	63.5	Low	159 Å²	159	78 Å²	78	85%	0.85	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86	-10	177.9	-66.9	-23.4	0	0	0	113.1	D553	D553-N555 PolarHBondContact O-N 2.83Å
556	N	48.3	Very low	62.1	Low	99 Å²	99	77.7 Å²	77.7	53%	0.529	41%	0.409	S	S	.	.	S	Bend	trans	-74	124.9	176.1	-113.2	-25.8	0	0	0	110.3	R550 D553 Q558	R550-N556 PolarHBondContact O-ND2 2.86Å; R550-N556 VanDerWaalsContact O-ND2 3.15Å; D553-N556 PolarHBondContact O-N 3.47Å; N556-Q558 PolarHBondContact O-N 3.04Å
557	Q	48.6	Very low	61.4	Low	199 Å²	199	77.8 Å²	77.8	93%	0.93	41%	0.408	S	S	*	.			trans	-74	22.3	-176.8	-64.8	-178.6	-13.7	0	0	114.3
558	Q	50.2	Low	61.3	Low	137 Å²	137	77.3 Å²	77.3	64%	0.64	41%	0.407	S	S	*	.			trans	-77.4	124.4	177.5	-158.8	69.2	10.7	0	0	109.4	N556 N560	N556-Q558 PolarHBondContact O-N 3.04Å; Q558-N560 PolarHBondContact O-N 2.85Å
559	A	43.8	Very low	61.4	Low	97 Å²	97	79.5 Å²	79.5	80%	0.802	42%	0.418	S	S	*	.	S	Bend	trans	-58.5	-24	-166.9	0	0	0	0	0	115.6
560	N	52	Low	61.8	Low	131 Å²	131	77.5 Å²	77.5	70%	0.701	41%	0.409	S	S	*	.	S	Bend	trans	-149.2	115.1	160.7	-72.6	-73	0	0	0	108.1	Q558	Q558-N560 PolarHBondContact O-N 2.85Å
561	P	57.6	Low	62.3	Low	58 Å²	58	76.6 Å²	76.6	38%	0.377	41%	0.411	S	S	.	.			trans	-79.5	152.7	170.1	32.1	-33.7	0	0	0	111.5	V551 V563	V551-P561 WeakPolarHBondContact O-CB 3.46Å; P561-V563 PolarHBondContact O-N 3.28Å
562	P	57.9	Low	63	Low	25 Å²	25	78.1 Å²	78.1	16%	0.162	42%	0.423	C	S	.	.			trans	-59.2	128.3	178.9	-11.4	13.8	0	0	0	113.1	L525 V551 V564	L525-P562 HydrophobicContact CB-CB 4.39Å; L525-P562 HydrophobicContact CB-CG 4.33Å; L525-P562 HydrophobicContact CD2-CB 4.38Å; L525-P562 HydrophobicContact CG-CB 4.3Å; L525-P562 WeakPolarHBondContact O-CB 3.47Å; L525-P562 VanDerWaalsContact O-CG 3.25Å; L525-P562 WeakPolarHBondContact O-CG 3.44Å; V551-P562 HydrophobicContact CG1-CB 3.77Å; V551-P562 HydrophobicContact CG1-CG 3.8Å; V551-P562 WeakPolarHBondContact CG1-O 3.35Å; V551-P562 HydrophobicContact CG2-CG 4.08Å; P562-V564 PolarHBondContact O-N 2.9Å
563	V	61.5	Low	63.8	Low	90 Å²	90	77.3 Å²	77.3	55%	0.545	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	103.6	172.4	-177.1	0	0	0	0	109.1	I526 Q527 I528 P561 I565	I526-V563 PolarHBondContact O-N 3.46Å; Q527-V563 WeakPolarHBondContact CA-O 3.16Å; I528-V563 PolarHBondContact N-O 2.82Å; P561-V563 PolarHBondContact O-N 3.28Å; V563-I565 PolarHBondContact O-N 3.5Å
564	V	68.1	Low	64.7	Low	16 Å²	16	80.6 Å²	80.6	10%	0.097	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65	115.6	161.7	-172.4	0	0	0	0	107.5	I528 W547 V551 T552 P562 N566	I528-V564 HydrophobicContact CG2-CB 4.26Å; I528-V564 HydrophobicContact CG2-CG1 4.3Å; I528-V564 HydrophobicContact CG2-CG2 3.89Å; I528-V564 CarbonylContact O-C 3.59Å; I528-V564 WeakPolarHBondContact O-CA 3.47Å; W547-V564 HydrophobicContact CZ3-CG2 4.28Å; V551-V564 HydrophobicContact CG1-CG2 4.21Å; T552-V564 HydrophobicContact CG2-CG2 4.34Å; P562-V564 PolarHBondContact O-N 2.9Å; V564-N566 PolarHBondContact O-N 3.33Å
565	I	56.7	Low	66.2	Low	31 Å²	31	79.8 Å²	79.8	16%	0.159	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	123.7	173.2	-44.6	-176.2	0	0	0	107.2	Q527 I528 D529 V563	Q527-I565 HydrophobicContact CG-CD1 3.79Å; Q527-I565 HydrophobicContact CG-CG1 3.74Å; I528-I565 PolarHBondContact O-N 3.03Å; D529-I565 HydrophobicContact CB-CB 4.21Å; D529-I565 HydrophobicContact CB-CD1 4Å; D529-I565 HydrophobicContact CB-CG1 4.3Å; V563-I565 PolarHBondContact O-N 3.5Å
566	N	56.6	Low	67.8	Low	10 Å²	10	73.4 Å²	73.4	5%	0.053	40%	0.4	C	S	.	.	S	Bend	trans	55.6	-160.8	-179.3	-56.8	-21	0	0	0	111.9	H117 Y139 Q531 V564	H117-N566 PolarHBondContact CE1-OD1 3.39Å; Y139-N566 PolarHBondContact OH-ND2 3.43Å; Q531-N566 VanDerWaalsContact OE1-CB 3.31Å; Q531-N566 PolarHBondContact OE1-ND2 2.84Å; V564-N566 PolarHBondContact O-N 3.33Å
567	E	69.8	Low	69.4	Low	45 Å²	45	71.7 Å²	71.7	21%	0.21	40%	0.395	C	S	.	.			trans	-124.1	140.5	-168.9	-65.2	-179.9	-139.9	0	0	110.9	Q67 R115 I569 H580 F583	Q67-E567 PolarHBondContact NE2-OE1 3.32Å; Q67-E567 VanDerWaalsContact NE2-OE1 3.16Å; R115-E567 IonicContact NH1-OE1 2.72Å; R115-E567 PolarHBondContact NH1-OE1 3.26Å; E567-I569 PolarHBondContact O-N 3.24Å; E567-H580 WeakPolarHBondContact CB-ND1 3.2Å; E567-H580 IonicContact OE2-CE1 3.48Å; E567-H580 PolarHBondContact OE2-CE1 3.01Å; E567-H580 IonicContact OE2-CG 2.79Å; E567-H580 IonicContact OE2-ND1 3.17Å; E567-H580 PolarHBondContact OE2-ND1 2.71Å; E567-F583 VanDerWaalsContact OE2-CE2 3.29Å; E567-F583 WeakPolarHBondContact OE2-CE2 3.02Å
568	V	83.3	Confident	70.8	Confident	7 Å²	7	62.8 Å²	62.8	4%	0.042	36%	0.357	C	S	.	.			trans	-77	119.4	177.6	171.7	0	0	0	0	108.4	L530 W535 I548 H580 L581	L530-V568 HydrophobicContact CB-CG2 3.66Å; L530-V568 HydrophobicContact CD1-CG2 3.8Å; L530-V568 HydrophobicContact CG-CG2 4.39Å; W535-V568 HydrophobicContact CB-CG1 4.49Å; W535-V568 HydrophobicContact CD2-CG1 3.98Å; W535-V568 HydrophobicContact CG-CG1 3.77Å; I548-V568 HydrophobicContact CD1-CB 4.26Å; I548-V568 HydrophobicContact CD1-CG2 3.79Å; V568-H580 CarbonylContact O-C 3.42Å; V568-H580 VanDerWaalsContact O-CA 3.31Å; V568-H580 WeakPolarHBondContact O-CA 3.34Å; V568-L581 HydrophobicContact CB-CB 3.92Å; V568-L581 HydrophobicContact CB-CD2 4.4Å; V568-L581 HydrophobicContact CG1-CB 3.57Å; V568-L581 HydrophobicContact CG1-CD2 3.69Å; V568-L581 HydrophobicContact CG1-CG 4.29Å; V568-L581 PolarHBondContact O-N 3.49Å
569	I	84.3	Confident	72.2	Confident	54 Å²	54	58.4 Å²	58.4	28%	0.277	34%	0.336	S	S	.	.	B	Isolated β-bridge	trans	-109.5	129.3	-178.6	-57.5	174.8	0	0	0	108.9	F69 W535 E567	F69-I569 HydrophobicContact CE1-CD1 4.22Å; W535-I569 VanDerWaalsContact CD1-O 3.25Å; E567-I569 PolarHBondContact O-N 3.24Å
570	C	87.9	Confident	74	Confident	2 Å²	2	54 Å²	54	1%	0.014	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	133.3	176.2	-58.6	0	0	0	0	110.9	W535 C537 H576 S577 G578 E579	W535-C570 CarbonylContact O-C 3.42Å; C537-C570 HydrophobicContact CB-CB 3.75Å; C537-C570 WeakPolarHBondContact CB-SG 3.37Å; C537-C570 WeakPolarHBondContact SG-CB 3.48Å; C537-C570 CovalentContact SG-SG 2.02Å; C537-C570 PolarHBondContact SG-SG 3.4Å; C570-H576 WeakPolarHBondContact CB-O 3.14Å; C570-S577 WeakPolarHBondContact O-CA 2.99Å; C570-G578 PolarHBondContact O-N 3.37Å; C570-E579 VanDerWaalsContact CB-O 3.3Å; C570-E579 WeakPolarHBondContact CB-O 3.42Å; C570-E579 PolarHBondContact N-O 3.36Å; C570-E579 PolarHBondContact SG-O 3.35Å; C570-E579 VanDerWaalsContact SG-O 3.38Å
571	E	88.4	Confident	75.5	Confident	121 Å²	121	47.8 Å²	47.8	57%	0.565	27%	0.266	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.3	-31.2	169.7	-169.9	176	147.6	0	0	111.6	P534 W535 S577	P534-E571 WeakPolarHBondContact CA-OE2 3.48Å; P534-E571 HydrophobicContact CB-CB 4.37Å; P534-E571 VanDerWaalsContact CB-OE2 3.31Å; P534-E571 WeakPolarHBondContact CB-OE2 3.43Å; W535-E571 PolarHBondContact O-N 2.88Å; E571-S577 WeakPolarHBondContact O-CB 3.25Å; E571-S577 PolarHBondContact O-OG 2.03Å
572	S	83.6	Confident	76.4	Confident	48 Å²	48	47.1 Å²	47.1	34%	0.336	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	160.5	179	177.8	0	0	0	0	109.6	W535 D536 C537	W535-S572 PolarHBondContact O-N 3.11Å; D536-S572 CarbonylContact C-O 3.03Å; D536-S572 WeakPolarHBondContact CA-O 3.31Å; D536-S572 VanDerWaalsContact OD1-C 3.32Å; D536-S572 WeakPolarHBondContact OD1-CB 3.45Å; D536-S572 PolarHBondContact OD1-OG 3.45Å; C537-S572 PolarHBondContact N-O 3.04Å
573	P	82.4	Confident	76.9	Confident	35 Å²	35	47.6 Å²	47.6	23%	0.227	26%	0.257	C	S	.	.	S	Bend	cis	-68.1	168.2	-17.7	32.6	-36	0	0	0	110.9	T538 K575 H576 S577	T538-P573 HydrophobicContact CG2-CG 4.29Å; P573-K575 PolarHBondContact O-N 3.01Å; P573-H576 PolarHBondContact O-N 3.24Å; P573-S577 PolarHBondContact O-N 2.89Å
574	T	80.8	Confident	77.7	Confident	140 Å²	140	43.6 Å²	43.6	86%	0.859	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-6	-177.9	58.8	0	0	0	0	115.6
575	K	79.6	Confident	77.9	Confident	172 Å²	172	45.2 Å²	45.2	75%	0.748	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.5	-31.1	169.2	-64.6	-179.1	179.8	177.4	0	113.6	P573	P573-K575 PolarHBondContact O-N 3.01Å
576	H	82.1	Confident	78.9	Confident	25 Å²	25	47.6 Å²	47.6	12%	0.116	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-119.5	5	-172.9	-56.9	-52.3	0	0	0	112.1	C537 C570 P573 G578 E579 L584	C537-H576 HydrophobicContact CB-CB 4.34Å; C570-H576 WeakPolarHBondContact CB-O 3.14Å; P573-H576 PolarHBondContact O-N 3.24Å; H576-G578 PolarHBondContact O-N 3.14Å; H576-E579 WeakPolarHBondContact CA-OE2 3.34Å; H576-E579 IonicContact CE1-OE2 2.67Å; H576-E579 IonicContact CG-OE2 3.34Å; H576-E579 IonicContact ND1-OE2 3.99Å; H576-E579 PolarHBondContact ND1-OE2 2.81Å; H576-E579 WeakPolarHBondContact O-CB 2.99Å; H576-E579 PolarHBondContact O-N 3Å; H576-L584 HydrophobicContact CB-CD1 4.15Å; H576-L584 HydrophobicContact CB-CD2 4.24Å
577	S	81.8	Confident	79.6	Confident	63 Å²	63	52.8 Å²	52.8	44%	0.441	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	115.9	179.1	-167.7	0	0	0	0	110.9	C570 E571 P573	C570-S577 WeakPolarHBondContact O-CA 2.99Å; E571-S577 WeakPolarHBondContact O-CB 3.25Å; E571-S577 PolarHBondContact O-OG 2.03Å; P573-S577 PolarHBondContact O-N 2.89Å
578	G	78.4	Confident	79.7	Confident	12 Å²	12	52.8 Å²	52.8	12%	0.124	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	98.8	-17.8	-171.2	0	0	0	0	0	114.5	C570 H576	C570-G578 PolarHBondContact O-N 3.37Å; H576-G578 PolarHBondContact O-N 3.14Å
579	E	80.5	Confident	79.4	Confident	45 Å²	45	53 Å²	53	21%	0.21	29%	0.286	C	S	.	.			trans	-75.8	153.1	177.2	-57.6	-162	94.2	0	0	111	E37 C570 H576 L584	E37-E579 HydrophobicContact CG-CG 4.05Å; C570-E579 VanDerWaalsContact CB-O 3.3Å; C570-E579 WeakPolarHBondContact CB-O 3.42Å; C570-E579 PolarHBondContact N-O 3.36Å; C570-E579 PolarHBondContact SG-O 3.35Å; C570-E579 VanDerWaalsContact SG-O 3.38Å; H576-E579 WeakPolarHBondContact CA-OE2 3.34Å; H576-E579 IonicContact CE1-OE2 2.67Å; H576-E579 IonicContact CG-OE2 3.34Å; H576-E579 IonicContact ND1-OE2 3.99Å; H576-E579 PolarHBondContact ND1-OE2 2.81Å; H576-E579 WeakPolarHBondContact O-CB 2.99Å; H576-E579 PolarHBondContact O-N 3Å; E579-L584 HydrophobicContact CB-CD2 3.89Å; E579-L584 HydrophobicContact CB-CG 4.46Å; E579-L584 HydrophobicContact CG-CD2 4.35Å; E579-L584 WeakPolarHBondContact OE2-CD2 3.34Å
580	H	80.8	Confident	79.3	Confident	5 Å²	5	52.3 Å²	52.3	2%	0.023	29%	0.286	C	S	.	.	B	Isolated β-bridge	trans	-91.2	147	-179.5	-66.3	-155.7	0	0	0	111.2	N44 Q67 F69 E567 V568 F583 L584	N44-H580 PolarHBondContact ND2-CE1 2.75Å; N44-H580 PolarHBondContact ND2-NE2 3.27Å; Q67-H580 PolarHBondContact OE1-CE1 2.69Å; F69-H580 AromaticContact CE1-NE2 3.85Å; F69-H580 AromaticContact CE2-NE2 3.82Å; F69-H580 AromaticContact CZ-CE1 3.45Å; F69-H580 VanDerWaalsContact CZ-CE1 3.45Å; F69-H580 WeakPolarHBondContact CZ-CE1 3.38Å; F69-H580 AromaticContact CZ-NE2 3.22Å; F69-H580 WeakPolarHBondContact CZ-NE2 3.28Å; E567-H580 WeakPolarHBondContact CB-ND1 3.2Å; E567-H580 IonicContact OE2-CE1 3.48Å; E567-H580 PolarHBondContact OE2-CE1 3.01Å; E567-H580 IonicContact OE2-CG 2.79Å; E567-H580 IonicContact OE2-ND1 3.17Å; E567-H580 PolarHBondContact OE2-ND1 2.71Å; V568-H580 CarbonylContact O-C 3.42Å; V568-H580 VanDerWaalsContact O-CA 3.31Å; V568-H580 WeakPolarHBondContact O-CA 3.34Å; H580-F583 HydrophobicContact CB-CB 3.77Å; H580-F583 HydrophobicContact CB-CD2 3.44Å; H580-F583 VanDerWaalsContact CB-CD2 3.44Å; H580-F583 HydrophobicContact CB-CE2 4.27Å; H580-F583 HydrophobicContact CB-CG 3.69Å; H580-F583 CarbonylContact O-C 3.18Å; H580-F583 VanDerWaalsContact O-CA 3.23Å; H580-F583 WeakPolarHBondContact O-CA 3.39Å; H580-F583 WeakPolarHBondContact O-CB 3.41Å; H580-F583 PolarHBondContact O-N 2.76Å; H580-L584 PolarHBondContact O-N 2.61Å
581	L	83.3	Confident	78.6	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	31%	0.313	C	S	.	.	G	3₁₀ helix	trans	-67.9	-41.3	-174.2	179.8	59.6	0	0	0	113.8	I541 L544 R545 I548 V568 F583 I589	I541-L581 HydrophobicContact CB-CD1 4.34Å; I541-L581 HydrophobicContact CD1-CD1 4.07Å; I541-L581 HydrophobicContact CD1-CD2 3.81Å; I541-L581 HydrophobicContact CG1-CD1 3.99Å; I541-L581 HydrophobicContact CG1-CD2 3.77Å; I541-L581 HydrophobicContact CG2-CD1 3.47Å; I541-L581 VanDerWaalsContact CG2-CD1 3.47Å; L544-L581 HydrophobicContact CB-CD2 4.08Å; L544-L581 HydrophobicContact CD2-CD2 3.56Å; L544-L581 HydrophobicContact CG-CD2 3.66Å; R545-L581 HydrophobicContact CB-CD1 3.85Å; R545-L581 HydrophobicContact CB-CG 4.08Å; R545-L581 HydrophobicContact CG-CD1 4.29Å; R545-L581 HydrophobicContact CG-CG 4.46Å; I548-L581 HydrophobicContact CD1-CD2 4.03Å; V568-L581 HydrophobicContact CB-CB 3.92Å; V568-L581 HydrophobicContact CB-CD2 4.4Å; V568-L581 HydrophobicContact CG1-CB 3.57Å; V568-L581 HydrophobicContact CG1-CD2 3.69Å; V568-L581 HydrophobicContact CG1-CG 4.29Å; V568-L581 PolarHBondContact O-N 3.49Å; L581-F583 PolarHBondContact O-N 2.94Å; L581-F583 VanDerWaalsContact O-N 3.08Å; L581-I589 HydrophobicContact CD1-CD1 4.36Å
582	K	76.4	Confident	77.2	Confident	44 Å²	44	59.3 Å²	59.3	19%	0.191	33%	0.326	C	S	.	.	G	3₁₀ helix	trans	-63.9	-8.8	168.7	177.7	163.1	-173.8	166.5	0	111.6	K39 I548 T552 D553	K39-K582 PolarHBondContact NZ-O 3.2Å; I548-K582 HydrophobicContact CG2-CB 4.24Å; T552-K582 WeakPolarHBondContact OG1-CD 3.24Å; T552-K582 PolarHBondContact OG1-NZ 2.97Å; D553-K582 IonicContact OD1-NZ 3.52Å; D553-K582 PolarHBondContact OD1-NZ 2.66Å
583	F	69.4	Low	75.3	Confident	34 Å²	34	64 Å²	64	15%	0.149	35%	0.347	C	S	.	.	G	3₁₀ helix	trans	-103.1	-16.1	-170	-69.7	-118.5	0	0	0	114.5	K39 E567 H580 L581	K39-F583 HydrophobicContact CB-CD1 3.9Å; K39-F583 HydrophobicContact CD-CB 3.62Å; K39-F583 HydrophobicContact CD-CD1 3.63Å; K39-F583 HydrophobicContact CD-CE1 4.42Å; K39-F583 HydrophobicContact CD-CG 3.79Å; K39-F583 WeakPolarHBondContact CD-O 3.35Å; K39-F583 HydrophobicContact CG-CD1 4.43Å; K39-F583 VanDerWaalsContact NZ-CD1 3.28Å; E567-F583 VanDerWaalsContact OE2-CE2 3.29Å; E567-F583 WeakPolarHBondContact OE2-CE2 3.02Å; H580-F583 HydrophobicContact CB-CB 3.77Å; H580-F583 HydrophobicContact CB-CD2 3.44Å; H580-F583 VanDerWaalsContact CB-CD2 3.44Å; H580-F583 HydrophobicContact CB-CE2 4.27Å; H580-F583 HydrophobicContact CB-CG 3.69Å; H580-F583 CarbonylContact O-C 3.18Å; H580-F583 VanDerWaalsContact O-CA 3.23Å; H580-F583 WeakPolarHBondContact O-CA 3.39Å; H580-F583 WeakPolarHBondContact O-CB 3.41Å; H580-F583 PolarHBondContact O-N 2.76Å; L581-F583 PolarHBondContact O-N 2.94Å; L581-F583 VanDerWaalsContact O-N 3.08Å
584	L	77.1	Confident	73.5	Confident	6 Å²	6	67.7 Å²	67.7	3%	0.031	37%	0.371	C	S	.	.	S	Bend	trans	-78.4	146.7	171	-62.1	174.3	0	0	0	111.9	C537 R545 H576 E579 H580 I589	C537-L584 HydrophobicContact CB-CD1 3.57Å; R545-L584 PolarHBondContact NE-O 2.9Å; R545-L584 PolarHBondContact NH2-O 3.07Å; H576-L584 HydrophobicContact CB-CD1 4.15Å; H576-L584 HydrophobicContact CB-CD2 4.24Å; E579-L584 HydrophobicContact CB-CD2 3.89Å; E579-L584 HydrophobicContact CB-CG 4.46Å; E579-L584 HydrophobicContact CG-CD2 4.35Å; E579-L584 WeakPolarHBondContact OE2-CD2 3.34Å; H580-L584 PolarHBondContact O-N 2.61Å; L584-I589 HydrophobicContact CB-CD1 3.48Å; L584-I589 VanDerWaalsContact CB-CD1 3.48Å; L584-I589 HydrophobicContact CB-CG1 3.66Å; L584-I589 HydrophobicContact CD1-CD1 3.84Å; L584-I589 HydrophobicContact CD1-CG1 3.57Å; L584-I589 HydrophobicContact CG-CD1 4.31Å; L584-I589 HydrophobicContact CG-CG1 4.23Å
585	S	72.9	Confident	71.4	Confident	51 Å²	51	68 Å²	68	36%	0.357	37%	0.368	S	S	.	.			trans	-79	160.6	169	101.6	0	0	0	0	110.8	E587 A588 I589	S585-E587 VanDerWaalsContact C-N 3.29Å; S585-E587 WeakPolarHBondContact CB-OE2 3Å; S585-E587 PolarHBondContact O-N 3.22Å; S585-E587 PolarHBondContact OG-N 3.15Å; S585-E587 PolarHBondContact OG-OE2 3.32Å; S585-A588 PolarHBondContact O-N 3.08Å; S585-A588 WeakPolarHBondContact OG-CB 3.21Å; S585-A588 PolarHBondContact OG-N 3.1Å; S585-A588 VanDerWaalsContact OG-N 3.14Å; S585-I589 PolarHBondContact O-N 3.07Å
586	K	76.8	Confident	69.5	Low	81 Å²	81	68.3 Å²	68.3	35%	0.352	38%	0.377	S	S	.	.	H	α-helix	trans	-66.9	-38.3	-176.7	-68	176.5	-177	175.5	0	110.7	M542 N546 E549 C590	M542-K586 HydrophobicContact CE-CB 3.67Å; M542-K586 HydrophobicContact CE-CG 3.96Å; N546-K586 VanDerWaalsContact OD1-CE 3.28Å; N546-K586 WeakPolarHBondContact OD1-CE 3.29Å; E549-K586 VanDerWaalsContact OE2-CE 3.29Å; E549-K586 WeakPolarHBondContact OE2-CE 3.21Å; E549-K586 IonicContact OE2-NZ 2.67Å; E549-K586 PolarHBondContact OE2-NZ 3.15Å; K586-C590 CarbonylContact O-C 3.13Å; K586-C590 PolarHBondContact O-N 3.15Å
587	E	71.7	Confident	67.3	Low	119 Å²	119	71.8 Å²	71.8	56%	0.556	40%	0.403	S	S	*	.	H	α-helix	trans	-77.3	-23.6	-178.8	-43.8	71.5	-155.6	0	0	112.3	S585 P591	S585-E587 VanDerWaalsContact C-N 3.29Å; S585-E587 WeakPolarHBondContact CB-OE2 3Å; S585-E587 PolarHBondContact O-N 3.22Å; S585-E587 PolarHBondContact OG-N 3.15Å; S585-E587 PolarHBondContact OG-OE2 3.32Å; E587-P591 VanDerWaalsContact O-CA 3.25Å; E587-P591 WeakPolarHBondContact O-CA 3.45Å
588	A	71.8	Confident	64.9	Low	45 Å²	45	75.5 Å²	75.5	37%	0.372	42%	0.419	S	S	.	.	H	α-helix	trans	-77.2	-45.8	174.7	0	0	0	0	0	111.9	S585	S585-A588 PolarHBondContact O-N 3.08Å; S585-A588 WeakPolarHBondContact OG-CB 3.21Å; S585-A588 PolarHBondContact OG-N 3.1Å; S585-A588 VanDerWaalsContact OG-N 3.14Å
589	I	77.9	Confident	62.6	Low	10 Å²	10	81.3 Å²	81.3	5%	0.051	46%	0.457	C	S	.	.	H	α-helix	trans	-68.2	-44.5	175.4	-69.6	159	0	0	0	111	T538 I541 M542 L581 L584 S585	T538-I589 WeakPolarHBondContact O-CG2 3.3Å; I541-I589 HydrophobicContact CG2-CD1 4.46Å; I541-I589 HydrophobicContact CG2-CG2 4.27Å; M542-I589 HydrophobicContact CG-CB 4.4Å; M542-I589 HydrophobicContact CG-CG2 3.7Å; M542-I589 HydrophobicContact SD-CB 3.89Å; M542-I589 HydrophobicContact SD-CD1 3.94Å; M542-I589 HydrophobicContact SD-CG2 3.84Å; L581-I589 HydrophobicContact CD1-CD1 4.36Å; L584-I589 HydrophobicContact CB-CD1 3.48Å; L584-I589 VanDerWaalsContact CB-CD1 3.48Å; L584-I589 HydrophobicContact CB-CG1 3.66Å; L584-I589 HydrophobicContact CD1-CD1 3.84Å; L584-I589 HydrophobicContact CD1-CG1 3.57Å; L584-I589 HydrophobicContact CG-CD1 4.31Å; L584-I589 HydrophobicContact CG-CG1 4.23Å; S585-I589 PolarHBondContact O-N 3.07Å
590	C	82.1	Confident	60.4	Low	41 Å²	41	84.7 Å²	84.7	28%	0.277	49%	0.486	S	S	.	.	S	Bend	trans	-138.9	87.1	-175.3	-153.3	0	0	0	0	109.6	C539 M542 K586 E592	C539-C590 HydrophobicContact CB-CB 3.89Å; C539-C590 WeakPolarHBondContact CB-SG 3.34Å; C539-C590 VanDerWaalsContact SG-CA 3.51Å; C539-C590 WeakPolarHBondContact SG-CB 3.33Å; C539-C590 CovalentContact SG-SG 2.05Å; C539-C590 PolarHBondContact SG-SG 3.06Å; M542-C590 HydrophobicContact CE-CB 4.43Å; M542-C590 HydrophobicContact CG-CB 4.23Å; K586-C590 CarbonylContact O-C 3.13Å; K586-C590 PolarHBondContact O-N 3.15Å; C590-E592 PolarHBondContact O-N 3.31Å
591	P	73.9	Confident	58.1	Low	91 Å²	91	92.7 Å²	92.7	59%	0.591	53%	0.528	S	S	*	.			trans	-62.6	125.1	175.9	25	-33.4	0	0	0	109.5	E587 N593	E587-P591 VanDerWaalsContact O-CA 3.25Å; E587-P591 WeakPolarHBondContact O-CA 3.45Å; P591-N593 PolarHBondContact O-N 3.45Å
592	E	57.4	Low	55.5	Low	179 Å²	179	101 Å²	101	84%	0.836	57%	0.572	S	S	*	*			trans	-57.4	124.4	179.5	-68.8	-167.5	151.1	0	0	110.3	C590 P594	C590-E592 PolarHBondContact O-N 3.31Å; E592-P594 VanDerWaalsContact O-CD 3.3Å; E592-P594 WeakPolarHBondContact O-CD 3.3Å
593	N	45.5	Very low	53.3	Low	146 Å²	146	104.3 Å²	104.3	78%	0.781	60%	0.6	S	S	*	*			trans	-75.3	113.4	178.2	-161	9.9	0	0	0	108	P591 N595	P591-N593 PolarHBondContact O-N 3.45Å; N593-N595 PolarHBondContact O-N 3.34Å
594	P	43.2	Very low	51.2	Low	112 Å²	112	109.4 Å²	109.4	73%	0.727	63%	0.634	S	S	*	*	S	Bend	trans	-82.1	64.7	-163.3	33.9	-36.9	0	0	0	112.1	E592	E592-P594 VanDerWaalsContact O-CD 3.3Å; E592-P594 WeakPolarHBondContact O-CD 3.3Å
595	N	37.7	Very low	48.8	Very low	148 Å²	148	116.4 Å²	116.4	79%	0.791	67%	0.671	S	S	*	*			trans	-159.8	63.7	175.5	-91.9	-50.6	0	0	0	111.6	N593	N593-N595 PolarHBondContact O-N 3.34Å
596	L	40.1	Very low	46.8	Very low	178 Å²	178	122.4 Å²	122.4	93%	0.932	69%	0.693	S	S	*	*			trans	-168.6	62.9	158.2	-108.9	161.9	0	0	0	110.7
597	S	34.4	Very low	44.3	Very low	97 Å²	97	125.3 Å²	125.3	68%	0.678	71%	0.713	S	S	*	*			trans	-80.9	161.5	168.4	67.6	0	0	0	0	111.5
598	D	30.8	Very low	42.3	Very low	142 Å²	142	125.3 Å²	125.3	76%	0.759	72%	0.721	S	S	*	*			trans	66.1	86.6	163	-52.6	-50.8	0	0	0	118.4
599	S	32.1	Very low	40.2	Very low	133 Å²	133	130.6 Å²	130.6	93%	0.93	74%	0.743	S	S	*	*			trans	-143.5	97.7	135.2	-74.4	0	0	0	0	109
600	S	33.1	Very low	37.8	Very low	116 Å²	116	134.4 Å²	134.4	81%	0.811	78%	0.776	S	S	*	*			trans	-78.3	159.4	-176.9	53.9	0	0	0	0	113.4	L602	S600-L602 PolarHBondContact O-N 2.86Å
601	L	33.8	Very low	36.2	Very low	173 Å²	173	137.1 Å²	137.1	91%	0.906	79%	0.793	S	S	*	*			trans	-42.1	127.7	174.7	-70.4	152.3	0	0	0	114.2
602	L	28.2	Very low	34.1	Very low	176 Å²	176	140.6 Å²	140.6	92%	0.921	80%	0.801	S	S	*	*			trans	-132.3	125	151.4	-86.9	175.5	0	0	0	110.3	S600	S600-L602 PolarHBondContact O-N 2.86Å
603	S	29	Very low	32.7	Very low	113 Å²	113	139 Å²	139	79%	0.79	80%	0.798	S	S	*	*			trans	-99.5	132.5	178.9	55.7	0	0	0	0	111.3
604	V	26	Very low	32	Very low	141 Å²	141	140.1 Å²	140.1	86%	0.855	80%	0.803	S	S	*	*			trans	-138	125.3	163.7	-178	0	0	0	0	109.8
605	N	25.8	Very low	31.1	Very low	153 Å²	153	138.3 Å²	138.3	82%	0.818	81%	0.805	S	S	*	*			trans	-98.2	136.1	160.6	-86.6	-30.9	0	0	0	108.3
606	Q	30.8	Very low	30.7	Very low	176 Å²	176	139.1 Å²	139.1	82%	0.822	81%	0.807	S	S	*	*				163.2	118.2	128.1	-89.7	172.4	19.1	0	0	113.1
607	N	25.8	Very low	30.2	Very low	143 Å²	143	135.8 Å²	135.8	77%	0.765	80%	0.799	S	S	*	*				51.1	157.2	127.7	-63.7	3.8	0	0	0	124.7
608	T	29.3	Very low	30.3	Very low	118 Å²	118	136.6 Å²	136.6	72%	0.724	80%	0.802	S	S	*	*			trans	82.9	113.3	153.5	33.3	0	0	0	0	120.7
609	D	26.8	Very low	30.2	Very low	157 Å²	157	135.2 Å²	135.2	84%	0.84	80%	0.803	S	S	*	*			trans	83.6	138.4	135.4	-54.8	-15.2	0	0	0	122.8
610	A	28.6	Very low	30.1	Very low	90 Å²	90	133.9 Å²	133.9	74%	0.744	79%	0.794	S	S	*	*			trans	-133.8	-178.5	171	0	0	0	0	0	106.5
611	P	48	Very low	30	Very low	98 Å²	98	139 Å²	139	64%	0.636	80%	0.797	S	S	*	*			cis	-135	-172.7	2	35.4	-13.7	0	0	0	114.6
612	H	29.5	Very low	29.9	Very low	164 Å²	164	136.4 Å²	136.4	76%	0.759	79%	0.791	S	S	*	*			trans	139.7	91.7	141.6	-76.3	-71.1	0	0	0	116.9
613	L	28.8	Very low	30.1	Very low	145 Å²	145	135.2 Å²	135.2	76%	0.759	78%	0.78	S	S	*	*				50.1	132.1	121.9	-84.5	166.2	0	0	0	123.9
614	L	30	Very low	30.3	Very low	169 Å²	169	137.2 Å²	137.2	89%	0.885	78%	0.78	S	S	*	*			trans	81.9	121	154.4	-61	169.1	0	0	0	119.4
615	G	24.8	Very low	30.8	Very low	75 Å²	75	136.9 Å²	136.9	77%	0.773	77%	0.769	S	S	*	*			trans	166.8	47.9	171.8	0	0	0	0	0	119.6
616	I	29.3	Very low	31.7	Very low	165 Å²	165	135.1 Å²	135.1	85%	0.846	76%	0.764	S	S	*	*			trans	29.8	124.1	156	-56.4	170.7	0	0	0	120.5
617	S	30	Very low	32.5	Very low	108 Å²	108	135.6 Å²	135.6	76%	0.755	77%	0.766	S	S	*	*			trans	-5	144	154.8	-48.8	0	0	0	0	120.4
618	P	36.9	Very low	34.2	Very low	114 Å²	114	132.9 Å²	132.9	74%	0.74	76%	0.755	S	S	*	*				-150.5	177.8	81.2	42.1	-25.6	0	0	0	117.3
619	S	28.6	Very low	35.9	Very low	112 Å²	112	131 Å²	131	78%	0.783	75%	0.745	S	S	*	*			trans	67.4	153.8	161.6	71.4	0	0	0	0	118.6
620	S	29.2	Very low	37.7	Very low	105 Å²	105	129.7 Å²	129.7	73%	0.734	74%	0.737	S	S	*	*			cis	-176.2	134	-44.3	46.3	0	0	0	0	107
621	Y	30.3	Very low	39.7	Very low	224 Å²	224	129 Å²	129	88%	0.878	73%	0.726	S	S	*	*			trans	-65.6	141.1	179.2	-71.4	-93.7	0	0	0	112.2	E623	Y621-E623 PolarHBondContact O-N 3.32Å
622	P	32.3	Very low	41	Very low	119 Å²	119	128.3 Å²	128.3	77%	0.773	72%	0.72	S	S	*	*			trans	-80.6	96.8	167.2	32	-31.4	0	0	0	110.3	I624	P622-I624 PolarHBondContact O-N 3.34Å
623	E	33.2	Very low	43.1	Very low	150 Å²	150	124.9 Å²	124.9	70%	0.701	71%	0.707	S	S	*	*			trans	-70.6	118.3	165.6	-68.8	-170.3	135.4	0	0	110	Y621 H625	Y621-E623 PolarHBondContact O-N 3.32Å; E623-H625 PolarHBondContact O-N 2.71Å; E623-H625 VanDerWaalsContact O-N 3.16Å; E623-H625 IonicContact OE2-CD2 3.13Å; E623-H625 IonicContact OE2-CE1 2.66Å; E623-H625 IonicContact OE2-NE2 3.36Å; E623-H625 PolarHBondContact OE2-NE2 3.06Å
624	I	33.1	Very low	45.6	Very low	155 Å²	155	122.5 Å²	122.5	80%	0.795	69%	0.694	S	S	*	*			trans	-85.8	82.5	172	-55.5	178.5	0	0	0	108.2	P622 T626	P622-I624 PolarHBondContact O-N 3.34Å; I624-T626 PolarHBondContact O-N 3.03Å
625	H	36.2	Very low	47.9	Very low	135 Å²	135	119.9 Å²	119.9	63%	0.625	68%	0.68	S	S	*	*			trans	-72.2	109	169.3	-74.1	-71.8	0	0	0	109.9	E623 E627	E623-H625 PolarHBondContact O-N 2.71Å; E623-H625 VanDerWaalsContact O-N 3.16Å; E623-H625 IonicContact OE2-CD2 3.13Å; E623-H625 IonicContact OE2-CE1 2.66Å; E623-H625 IonicContact OE2-NE2 3.36Å; E623-H625 PolarHBondContact OE2-NE2 3.06Å; H625-E627 PolarHBondContact O-N 2.05Å
626	T	44.7	Very low	50.5	Low	115 Å²	115	118 Å²	118	71%	0.706	66%	0.661	S	S	*	*			trans	-81.1	94.7	170.4	41.3	0	0	0	0	109.6	I624 V628	I624-T626 PolarHBondContact O-N 3.03Å; T626-V628 VanDerWaalsContact C-N 3.33Å; T626-V628 PolarHBondContact O-N 3.33Å
627	E	47	Very low	53	Low	186 Å²	186	115.4 Å²	115.4	87%	0.869	65%	0.648	S	S	*	*			trans	-64.7	89.4	174.9	-68.9	-165.4	157.4	0	0	111.3	H625 P629	H625-E627 PolarHBondContact O-N 2.05Å; E627-P629 WeakPolarHBondContact O-CD 3.49Å
628	V	61.3	Low	55.7	Low	86 Å²	86	114.6 Å²	114.6	52%	0.521	64%	0.635	S	S	.	*			trans	-68.9	119.8	170.4	178.9	0	0	0	0	108.2	T626 L630 V632	T626-V628 VanDerWaalsContact C-N 3.33Å; T626-V628 PolarHBondContact O-N 3.33Å; V628-L630 PolarHBondContact O-N 3.49Å; V628-V632 HydrophobicContact CG1-CB 4.26Å; V628-V632 HydrophobicContact CG1-CG1 4.32Å
629	P	65.4	Low	58.1	Low	79 Å²	79	112.8 Å²	112.8	51%	0.513	62%	0.622	S	S	.	*			trans	-62.6	134.3	-176.5	23.6	-33.1	0	0	0	110.9	E627 S631 V632	E627-P629 WeakPolarHBondContact O-CD 3.49Å; P629-S631 PolarHBondContact O-N 2.9Å; P629-V632 HydrophobicContact CG-CG2 3.95Å; P629-V632 PolarHBondContact O-N 2.86Å
630	L	65.5	Low	60.9	Low	130 Å²	130	111.8 Å²	111.8	68%	0.681	61%	0.611	S	S	*	*	H	α-helix	trans	-53.7	-30.6	-169.6	-152.8	83.7	0	0	0	113.6	V628 V632 L633 I634	V628-L630 PolarHBondContact O-N 3.49Å; L630-V632 PolarHBondContact O-N 3.15Å; L630-L633 PolarHBondContact O-N 3.45Å; L630-I634 HydrophobicContact CD2-CD1 4.03Å; L630-I634 HydrophobicContact CG-CD1 4.14Å; L630-I634 WeakPolarHBondContact O-CB 3.42Å; L630-I634 WeakPolarHBondContact O-CD1 3.45Å; L630-I634 VanDerWaalsContact O-CG1 3.26Å; L630-I634 WeakPolarHBondContact O-CG1 3.15Å; L630-I634 PolarHBondContact O-N 2.95Å
631	S	70.8	Confident	63.7	Low	74 Å²	74	113.4 Å²	113.4	52%	0.517	61%	0.605	S	S	.	*	H	α-helix	trans	-60	-38.3	175.5	50.5	0	0	0	0	113.8	P629 L635	P629-S631 PolarHBondContact O-N 2.9Å; S631-L635 WeakPolarHBondContact O-CB 3.49Å; S631-L635 PolarHBondContact O-N 3.02Å
632	V	74.6	Confident	66.5	Low	84 Å²	84	107 Å²	107	51%	0.509	59%	0.585	S	S	.	*	H	α-helix	trans	-72.1	-40	178.3	175.6	0	0	0	0	110.5	V628 P629 L630 L635 G636	V628-V632 HydrophobicContact CG1-CB 4.26Å; V628-V632 HydrophobicContact CG1-CG1 4.32Å; P629-V632 HydrophobicContact CG-CG2 3.95Å; P629-V632 PolarHBondContact O-N 2.86Å; L630-V632 PolarHBondContact O-N 3.15Å; V632-L635 PolarHBondContact O-N 2.93Å; V632-G636 PolarHBondContact O-N 3.04Å
633	L	72.9	Confident	69.1	Low	93 Å²	93	106.6 Å²	106.6	49%	0.487	58%	0.576	S	S	.	*	H	α-helix	trans	-68.7	-38.6	178.4	-165.2	144.9	0	0	0	111.5	L630 G636 L637	L630-L633 PolarHBondContact O-N 3.45Å; L633-G636 PolarHBondContact O-N 3.06Å; L633-L637 HydrophobicContact CD2-CD1 3.67Å; L633-L637 HydrophobicContact CD2-CG 4.25Å; L633-L637 WeakPolarHBondContact O-CB 3.49Å; L633-L637 WeakPolarHBondContact O-CG 3.05Å; L633-L637 PolarHBondContact O-N 3.46Å
634	I	81.9	Confident	71.7	Confident	95 Å²	95	102.7 Å²	102.7	49%	0.487	57%	0.565	S	S	.	*	H	α-helix	trans	-63.2	-45.3	171.7	-69.7	164.9	0	0	0	111.2	L630 L637 L638	L630-I634 HydrophobicContact CD2-CD1 4.03Å; L630-I634 HydrophobicContact CG-CD1 4.14Å; L630-I634 WeakPolarHBondContact O-CB 3.42Å; L630-I634 WeakPolarHBondContact O-CD1 3.45Å; L630-I634 VanDerWaalsContact O-CG1 3.26Å; L630-I634 WeakPolarHBondContact O-CG1 3.15Å; L630-I634 PolarHBondContact O-N 2.95Å; I634-L637 PolarHBondContact O-N 3.32Å; I634-L638 VanDerWaalsContact O-CB 3.3Å; I634-L638 WeakPolarHBondContact O-CB 3.09Å; I634-L638 PolarHBondContact O-N 2.9Å
635	L	77	Confident	74.5	Confident	113 Å²	113	99 Å²	99	59%	0.592	55%	0.55	S	S	*	.	H	α-helix	trans	-61.3	-43.5	175.4	-95.9	160.6	0	0	0	112.2	S631 V632 L638 V639	S631-L635 WeakPolarHBondContact O-CB 3.49Å; S631-L635 PolarHBondContact O-N 3.02Å; V632-L635 PolarHBondContact O-N 2.93Å; L635-L638 PolarHBondContact O-N 2.65Å; L635-V639 WeakPolarHBondContact O-CG2 3.38Å; L635-V639 PolarHBondContact O-N 3.03Å
636	G	79.8	Confident	76.9	Confident	36 Å²	36	96.3 Å²	96.3	37%	0.371	55%	0.545	S	S	.	.	H	α-helix	trans	-60.8	-48.8	176.5	0	0	0	0	0	112.5	V632 L633 L638 V639 V640	V632-G636 PolarHBondContact O-N 3.04Å; L633-G636 PolarHBondContact O-N 3.06Å; G636-L638 VanDerWaalsContact C-N 3.31Å; G636-L638 PolarHBondContact O-N 2.67Å; G636-V639 PolarHBondContact O-N 3.09Å; G636-V640 WeakPolarHBondContact O-CG2 3.14Å; G636-V640 PolarHBondContact O-N 2.81Å
637	L	83.2	Confident	78.9	Confident	110 Å²	110	97.9 Å²	97.9	58%	0.576	54%	0.542	S	S	*	.	H	α-helix	trans	-61.6	-37.8	175.7	-72.2	175.9	0	0	0	112.4	L633 I634 V640 F641	L633-L637 HydrophobicContact CD2-CD1 3.67Å; L633-L637 HydrophobicContact CD2-CG 4.25Å; L633-L637 WeakPolarHBondContact O-CB 3.49Å; L633-L637 WeakPolarHBondContact O-CG 3.05Å; L633-L637 PolarHBondContact O-N 3.46Å; I634-L637 PolarHBondContact O-N 3.32Å; L637-V640 PolarHBondContact O-N 2.7Å; L637-F641 WeakPolarHBondContact O-CB 3.08Å; L637-F641 PolarHBondContact O-N 3.21Å
638	L	86.8	Confident	80.9	Confident	92 Å²	92	90.8 Å²	90.8	48%	0.482	52%	0.519	S	S	.	.	H	α-helix	trans	-68	-39.1	178.1	-165.4	152.4	0	0	0	111.6	I634 L635 G636 F641 I642	I634-L638 VanDerWaalsContact O-CB 3.3Å; I634-L638 WeakPolarHBondContact O-CB 3.09Å; I634-L638 PolarHBondContact O-N 2.9Å; L635-L638 PolarHBondContact O-N 2.65Å; G636-L638 VanDerWaalsContact C-N 3.31Å; G636-L638 PolarHBondContact O-N 2.67Å; L638-F641 PolarHBondContact O-N 2.99Å; L638-I642 HydrophobicContact CD2-CD1 3.59Å; L638-I642 HydrophobicContact CD2-CG1 4.3Å; L638-I642 WeakPolarHBondContact O-CG1 3.29Å; L638-I642 PolarHBondContact O-N 3.3Å
639	V	86.5	Confident	82	Confident	75 Å²	75	89.2 Å²	89.2	46%	0.455	52%	0.515	S	S	.	.	H	α-helix	trans	-64.5	-45.1	171.8	170.4	0	0	0	0	111.4	L635 G636 F641 I642 L643	L635-V639 WeakPolarHBondContact O-CG2 3.38Å; L635-V639 PolarHBondContact O-N 3.03Å; G636-V639 PolarHBondContact O-N 3.09Å; V639-F641 VanDerWaalsContact C-N 3.3Å; V639-F641 PolarHBondContact O-N 3.05Å; V639-I642 PolarHBondContact O-N 2.9Å; V639-L643 HydrophobicContact CG1-CD1 3.93Å; V639-L643 HydrophobicContact CG1-CG 4.42Å; V639-L643 WeakPolarHBondContact O-CB 3.42Å; V639-L643 WeakPolarHBondContact O-CG 3.21Å; V639-L643 PolarHBondContact O-N 3.43Å
640	V	86.4	Confident	82.9	Confident	92 Å²	92	87.3 Å²	87.3	56%	0.558	51%	0.51	S	S	*	.	H	α-helix	trans	-61.9	-38	176.2	170.7	0	0	0	0	111.6	G636 L637 L643 S644	G636-V640 WeakPolarHBondContact O-CG2 3.14Å; G636-V640 PolarHBondContact O-N 2.81Å; L637-V640 PolarHBondContact O-N 2.7Å; V640-L643 PolarHBondContact O-N 2.94Å; V640-S644 PolarHBondContact O-N 3.3Å; V640-S644 PolarHBondContact O-OG 2.84Å
641	F	89.4	Confident	83.8	Confident	138 Å²	138	85.4 Å²	85.4	61%	0.605	50%	0.5	S	S	*	.	H	α-helix	trans	-66.6	-44.8	175	-176.4	-98.4	0	0	0	112.3	L637 L638 V639 L643 S644 V645	L637-F641 WeakPolarHBondContact O-CB 3.08Å; L637-F641 PolarHBondContact O-N 3.21Å; L638-F641 PolarHBondContact O-N 2.99Å; V639-F641 VanDerWaalsContact C-N 3.3Å; V639-F641 PolarHBondContact O-N 3.05Å; F641-L643 VanDerWaalsContact C-N 3.33Å; F641-L643 PolarHBondContact O-N 3.01Å; F641-S644 PolarHBondContact O-N 3.5Å; F641-S644 PolarHBondContact O-OG 3.01Å; F641-S644 VanDerWaalsContact O-OG 3.11Å; F641-V645 HydrophobicContact CD1-CG2 4.28Å; F641-V645 HydrophobicContact CE1-CG2 3.92Å; F641-V645 HydrophobicContact CE2-CG2 4.31Å; F641-V645 HydrophobicContact CZ-CG2 3.93Å; F641-V645 WeakPolarHBondContact O-CB 3.38Å; F641-V645 VanDerWaalsContact O-CG2 3.32Å; F641-V645 WeakPolarHBondContact O-CG2 3.36Å; F641-V645 PolarHBondContact O-N 3.15Å
642	I	88.6	Confident	84.3	Confident	90 Å²	90	88.4 Å²	88.4	46%	0.462	50%	0.504	S	S	.	.	H	α-helix	trans	-60.4	-44.5	174.1	-71.5	173.8	0	0	0	110.5	L638 V639 S644 V645 C646	L638-I642 HydrophobicContact CD2-CD1 3.59Å; L638-I642 HydrophobicContact CD2-CG1 4.3Å; L638-I642 WeakPolarHBondContact O-CG1 3.29Å; L638-I642 PolarHBondContact O-N 3.3Å; V639-I642 PolarHBondContact O-N 2.9Å; I642-S644 PolarHBondContact O-N 3.31Å; I642-V645 PolarHBondContact O-N 2.91Å; I642-C646 WeakPolarHBondContact O-CB 3.25Å; I642-C646 PolarHBondContact O-N 2.75Å; I642-C646 PolarHBondContact O-SG 2.78Å; I642-C646 VanDerWaalsContact O-SG 3.32Å
643	L	87.1	Confident	84.6	Confident	110 Å²	110	88.9 Å²	88.9	58%	0.576	51%	0.507	S	S	*	.	H	α-helix	trans	-62.9	-42.1	178.5	-72.5	171.2	0	0	0	112.4	V639 V640 F641 C646 F647	V639-L643 HydrophobicContact CG1-CD1 3.93Å; V639-L643 HydrophobicContact CG1-CG 4.42Å; V639-L643 WeakPolarHBondContact O-CB 3.42Å; V639-L643 WeakPolarHBondContact O-CG 3.21Å; V639-L643 PolarHBondContact O-N 3.43Å; V640-L643 PolarHBondContact O-N 2.94Å; F641-L643 VanDerWaalsContact C-N 3.33Å; F641-L643 PolarHBondContact O-N 3.01Å; L643-C646 PolarHBondContact O-N 2.93Å; L643-F647 VanDerWaalsContact O-CB 3.29Å; L643-F647 WeakPolarHBondContact O-CB 3.46Å; L643-F647 PolarHBondContact O-N 2.73Å
644	S	87.9	Confident	84.8	Confident	68 Å²	68	90.1 Å²	90.1	48%	0.476	51%	0.509	S	S	.	.	H	α-helix	trans	-69.2	-37.5	178.2	74.4	0	0	0	0	112.6	V640 F641 I642 F647 G648	V640-S644 PolarHBondContact O-N 3.3Å; V640-S644 PolarHBondContact O-OG 2.84Å; F641-S644 PolarHBondContact O-N 3.5Å; F641-S644 PolarHBondContact O-OG 3.01Å; F641-S644 VanDerWaalsContact O-OG 3.11Å; I642-S644 PolarHBondContact O-N 3.31Å; S644-F647 PolarHBondContact O-N 2.6Å; S644-G648 PolarHBondContact O-N 3.02Å
645	V	91.3	Very high	84.6	Confident	79 Å²	79	88.8 Å²	88.8	48%	0.479	51%	0.505	S	S	.	.	H	α-helix	trans	-65.6	-44.5	172.9	171.3	0	0	0	0	111.1	F641 I642 F647 G648 A649	F641-V645 HydrophobicContact CD1-CG2 4.28Å; F641-V645 HydrophobicContact CE1-CG2 3.92Å; F641-V645 HydrophobicContact CE2-CG2 4.31Å; F641-V645 HydrophobicContact CZ-CG2 3.93Å; F641-V645 WeakPolarHBondContact O-CB 3.38Å; F641-V645 VanDerWaalsContact O-CG2 3.32Å; F641-V645 WeakPolarHBondContact O-CG2 3.36Å; F641-V645 PolarHBondContact O-N 3.15Å; I642-V645 PolarHBondContact O-N 2.91Å; V645-F647 PolarHBondContact O-N 2.59Å; V645-G648 PolarHBondContact O-N 3.28Å; V645-A649 WeakPolarHBondContact O-CB 3.36Å; V645-A649 PolarHBondContact O-N 2.89Å
646	C	85.9	Confident	84.3	Confident	78 Å²	78	87.6 Å²	87.6	53%	0.527	50%	0.498	S	S	.	.	H	α-helix	trans	-63.1	-39.6	174.9	-75.1	0	0	0	0	112.3	I642 L643 G650	I642-C646 WeakPolarHBondContact O-CB 3.25Å; I642-C646 PolarHBondContact O-N 2.75Å; I642-C646 PolarHBondContact O-SG 2.78Å; I642-C646 VanDerWaalsContact O-SG 3.32Å; L643-C646 PolarHBondContact O-N 2.93Å; C646-G650 PolarHBondContact O-N 3.24Å
647	F	88.1	Confident	83.7	Confident	147 Å²	147	93.8 Å²	93.8	65%	0.645	52%	0.515	S	S	*	.	H	α-helix	trans	-69.1	-41.5	176.8	-162.5	-102.2	0	0	0	111.7	L643 S644 V645 G650 L651	L643-F647 VanDerWaalsContact O-CB 3.29Å; L643-F647 WeakPolarHBondContact O-CB 3.46Å; L643-F647 PolarHBondContact O-N 2.73Å; S644-F647 PolarHBondContact O-N 2.6Å; V645-F647 PolarHBondContact O-N 2.59Å; F647-G650 PolarHBondContact O-N 3.18Å; F647-L651 HydrophobicContact CD1-CD1 3.77Å; F647-L651 HydrophobicContact CE1-CD1 3.68Å; F647-L651 HydrophobicContact CD1-CG 4.27Å; F647-L651 PolarHBondContact O-N 2.93Å; F647-L651 WeakPolarHBondContact O-CG 3.42Å; F647-L651 HydrophobicContact CE1-CG 4.18Å; F647-L651 WeakPolarHBondContact O-CB 3.34Å
648	G	88.7	Confident	82.5	Confident	38 Å²	38	97.1 Å²	97.1	39%	0.392	52%	0.52	S	S	.	.	H	α-helix	trans	-61.8	-43.5	172.9	0	0	0	0	0	112.8	S644 V645 L651 F652	S644-G648 PolarHBondContact O-N 3.02Å; V645-G648 PolarHBondContact O-N 3.28Å; G648-L651 PolarHBondContact O-N 3.31Å; G648-F652 WeakPolarHBondContact O-CB 3.33Å; G648-F652 PolarHBondContact O-N 3.28Å
649	A	84.1	Confident	81.1	Confident	53 Å²	53	102.8 Å²	102.8	44%	0.438	54%	0.535	S	S	.	.	H	α-helix	trans	-64.7	-41.5	173.6	0	0	0	0	0	112	V645 F652 V653	V645-A649 WeakPolarHBondContact O-CB 3.36Å; V645-A649 PolarHBondContact O-N 2.89Å; A649-F652 PolarHBondContact O-N 3.28Å; A649-V653 WeakPolarHBondContact O-CG2 3.42Å; A649-V653 PolarHBondContact O-N 3.11Å
650	G	85	Confident	79.2	Confident	39 Å²	39	108.6 Å²	108.6	40%	0.402	55%	0.554	S	S	.	*	H	α-helix	trans	-60.6	-45.3	174.3	0	0	0	0	0	112.5	C646 F647 V653 F654	C646-G650 PolarHBondContact O-N 3.24Å; F647-G650 PolarHBondContact O-N 3.18Å; G650-V653 PolarHBondContact O-N 2.91Å; G650-F654 VanDerWaalsContact O-CB 3.27Å; G650-F654 WeakPolarHBondContact O-CB 3.22Å; G650-F654 PolarHBondContact O-N 2.92Å
651	L	83.2	Confident	77.3	Confident	89 Å²	89	107 Å²	107	47%	0.466	56%	0.557	S	S	.	*	H	α-helix	trans	-63.2	-40.6	173	-75.9	174.1	0	0	0	112.1	F647 G648 F654 V655	F647-L651 HydrophobicContact CD1-CD1 3.77Å; F647-L651 HydrophobicContact CE1-CD1 3.68Å; F647-L651 HydrophobicContact CD1-CG 4.27Å; F647-L651 PolarHBondContact O-N 2.93Å; F647-L651 WeakPolarHBondContact O-CG 3.42Å; F647-L651 HydrophobicContact CE1-CG 4.18Å; F647-L651 WeakPolarHBondContact O-CB 3.34Å; G648-L651 PolarHBondContact O-N 3.31Å; L651-F654 PolarHBondContact O-N 2.96Å; L651-V655 VanDerWaalsContact O-CG2 3.28Å; L651-V655 PolarHBondContact O-N 3.26Å; L651-V655 WeakPolarHBondContact O-CG2 3.37Å; L651-V655 WeakPolarHBondContact O-CB 3.38Å
652	F	81.4	Confident	75.3	Confident	137 Å²	137	106.5 Å²	106.5	60%	0.601	57%	0.565	S	S	*	*	H	α-helix	trans	-64.3	-45.2	177	-173	-108.6	0	0	0	111.8	G648 A649 F654 V655 L656	G648-F652 WeakPolarHBondContact O-CB 3.33Å; G648-F652 PolarHBondContact O-N 3.28Å; A649-F652 PolarHBondContact O-N 3.28Å; F652-F654 PolarHBondContact O-N 3.28Å; F652-V655 PolarHBondContact O-N 2.99Å; F652-L656 HydrophobicContact CD1-CD1 3.84Å; F652-L656 HydrophobicContact CE1-CD1 3.53Å; F652-L656 HydrophobicContact CE1-CG 4.31Å; F652-L656 HydrophobicContact CZ-CD1 4.05Å; F652-L656 HydrophobicContact CZ-CG 4.45Å; F652-L656 WeakPolarHBondContact O-CB 3.23Å; F652-L656 WeakPolarHBondContact O-CG 3.14Å; F652-L656 PolarHBondContact O-N 3.29Å
653	V	80.6	Confident	72.6	Confident	94 Å²	94	111.7 Å²	111.7	57%	0.57	59%	0.587	S	S	*	*	H	α-helix	trans	-63.1	-40.4	173.5	171.4	0	0	0	0	111.3	A649 G650 L656 K657	A649-V653 WeakPolarHBondContact O-CG2 3.42Å; A649-V653 PolarHBondContact O-N 3.11Å; G650-V653 PolarHBondContact O-N 2.91Å; V653-L656 PolarHBondContact O-N 3.48Å; V653-K657 PolarHBondContact O-N 3.1Å; V653-K657 VanDerWaalsContact O-CB 3.31Å; V653-K657 WeakPolarHBondContact O-CB 3.49Å
654	F	77.6	Confident	70.3	Confident	119 Å²	119	111.8 Å²	111.8	52%	0.522	60%	0.597	S	S	.	*	H	α-helix	trans	-64.1	-43.2	175.3	-180	-101.4	0	0	0	112.1	G650 L651 F652 K657 R658	G650-F654 VanDerWaalsContact O-CB 3.27Å; G650-F654 WeakPolarHBondContact O-CB 3.22Å; G650-F654 PolarHBondContact O-N 2.92Å; L651-F654 PolarHBondContact O-N 2.96Å; F652-F654 PolarHBondContact O-N 3.28Å; F654-K657 PolarHBondContact O-N 3.23Å; F654-R658 VanDerWaalsContact O-CB 3.27Å; F654-R658 WeakPolarHBondContact O-CB 3.48Å; F654-R658 PolarHBondContact O-N 2.95Å
655	V	77	Confident	67.5	Low	67 Å²	67	117 Å²	117	41%	0.406	62%	0.616	S	S	.	*	H	α-helix	trans	-66.1	-40	176	167.9	0	0	0	0	111.4	L651 F652 R658 R659	L651-V655 VanDerWaalsContact O-CG2 3.28Å; L651-V655 PolarHBondContact O-N 3.26Å; L651-V655 WeakPolarHBondContact O-CG2 3.37Å; L651-V655 WeakPolarHBondContact O-CB 3.38Å; F652-V655 PolarHBondContact O-N 2.99Å; V655-R658 PolarHBondContact O-N 3.45Å; V655-R659 WeakPolarHBondContact O-CB 3.28Å; V655-R659 WeakPolarHBondContact O-CG 3.03Å; V655-R659 PolarHBondContact O-N 2.79Å
656	L	71.4	Confident	65	Low	88 Å²	88	118 Å²	118	46%	0.461	62%	0.624	S	S	.	*	H	α-helix	trans	-63.8	-43.4	172.6	-74.4	175.1	0	0	0	111.9	F652 V653 R659 K660	F652-L656 HydrophobicContact CD1-CD1 3.84Å; F652-L656 HydrophobicContact CE1-CD1 3.53Å; F652-L656 HydrophobicContact CE1-CG 4.31Å; F652-L656 HydrophobicContact CZ-CD1 4.05Å; F652-L656 HydrophobicContact CZ-CG 4.45Å; F652-L656 WeakPolarHBondContact O-CB 3.23Å; F652-L656 WeakPolarHBondContact O-CG 3.14Å; F652-L656 PolarHBondContact O-N 3.29Å; V653-L656 PolarHBondContact O-N 3.48Å; L656-R659 PolarHBondContact O-N 3.3Å; L656-K660 PolarHBondContact O-N 3.22Å
657	K	67.6	Low	62.4	Low	167 Å²	167	120.1 Å²	120.1	73%	0.726	64%	0.64	S	S	*	*	H	α-helix	trans	-63.8	-41	175.8	-169.7	174.9	-178.2	179.6	0	111.5	V653 F654 K660 G661	V653-K657 PolarHBondContact O-N 3.1Å; V653-K657 VanDerWaalsContact O-CB 3.31Å; V653-K657 WeakPolarHBondContact O-CB 3.49Å; F654-K657 PolarHBondContact O-N 3.23Å; K657-K660 PolarHBondContact O-N 3.04Å; K657-G661 PolarHBondContact O-N 2.82Å
658	R	58.6	Low	59.9	Low	179 Å²	179	119 Å²	119	68%	0.675	65%	0.649	S	S	*	*	H	α-helix	trans	-68.8	-37.3	176.7	-164.7	173.2	-175	179.4	2.3	112.2	F654 V655 K660 G661	F654-R658 VanDerWaalsContact O-CB 3.27Å; F654-R658 WeakPolarHBondContact O-CB 3.48Å; F654-R658 PolarHBondContact O-N 2.95Å; V655-R658 PolarHBondContact O-N 3.45Å; R658-K660 VanDerWaalsContact C-N 3.32Å; R658-K660 PolarHBondContact O-N 2.84Å; R658-G661 VanDerWaalsContact O-N 3.11Å; R658-G661 PolarHBondContact O-N 2.61Å
659	R	56.7	Low	57.2	Low	211 Å²	211	121.8 Å²	121.8	80%	0.796	67%	0.669	S	S	*	*	H	α-helix	trans	-70	-22.6	172.5	-78.3	-175.7	171.5	-170	-2.2	113.8	V655 L656	V655-R659 WeakPolarHBondContact O-CB 3.28Å; V655-R659 WeakPolarHBondContact O-CG 3.03Å; V655-R659 PolarHBondContact O-N 2.79Å; L656-R659 PolarHBondContact O-N 3.3Å
660	K	47.2	Very low	54.8	Low	197 Å²	197	126.4 Å²	126.4	86%	0.857	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84	-4.3	167.6	-77.3	-167.3	171.8	-173.1	0	114.3	L656 K657 R658	L656-K660 PolarHBondContact O-N 3.22Å; K657-K660 PolarHBondContact O-N 3.04Å; R658-K660 VanDerWaalsContact C-N 3.32Å; R658-K660 PolarHBondContact O-N 2.84Å
661	G	45.1	Very low	52.3	Low	59 Å²	59	131.9 Å²	131.9	61%	0.608	71%	0.706	S	S	*	*	S	Bend	trans	-96.7	4.6	-171.6	0	0	0	0	0	116.4	K657 R658	K657-G661 PolarHBondContact O-N 2.82Å; R658-G661 VanDerWaalsContact O-N 3.11Å; R658-G661 PolarHBondContact O-N 2.61Å
662	V	47.5	Very low	49.8	Very low	128 Å²	128	134.7 Å²	134.7	78%	0.776	72%	0.721	S	S	*	*			trans	-135.6	76.4	-172.8	-168.1	0	0	0	0	112
663	Q	33.6	Very low	47.3	Very low	199 Å²	199	134.6 Å²	134.6	93%	0.93	73%	0.727	S	S	*	*			trans	-144.8	147.9	149	-105.2	177.1	0.3	0	0	108.4
664	S	38.4	Very low	44.9	Very low	111 Å²	111	137.7 Å²	137.7	78%	0.776	74%	0.739	S	S	*	*			trans	-91.5	145.4	-159.4	54.9	0	0	0	0	114.8
665	M	27.8	Very low	42.5	Very low	179 Å²	179	136.8 Å²	136.8	88%	0.882	75%	0.747	S	S	*	*			trans	-141	136.2	153.4	-95	-65.9	167.9	0	0	110.9
666	P	38.7	Very low	40.2	Very low	100 Å²	100	138.5 Å²	138.5	65%	0.649	76%	0.762	S	S	*	*			trans	-90.6	176.5	164.6	38.1	-34.2	0	0	0	111.7
667	S	32.7	Very low	38.2	Very low	122 Å²	122	142.9 Å²	142.9	85%	0.853	78%	0.778	S	S	*	*			trans	72.5	130.1	160.9	-56.3	0	0	0	0	118.4
668	S	34.6	Very low	36.3	Very low	122 Å²	122	142.5 Å²	142.5	85%	0.853	78%	0.779	S	S	*	*			trans	-97.2	119.3	174.6	53.2	0	0	0	0	111.7
669	A	33.4	Very low	34.9	Very low	97 Å²	97	140.3 Å²	140.3	80%	0.802	78%	0.78	S	S	*	*			trans	-155.2	130.1	162.7	0	0	0	0	0	112.8
670	N	32.8	Very low	33.5	Very low	151 Å²	151	137.5 Å²	137.5	81%	0.807	78%	0.776	S	S	*	*			trans	-4.2	127	161.8	-52.8	-18.2	0	0	0	121
671	N	31.8	Very low	32.6	Very low	153 Å²	153	139 Å²	139	82%	0.818	78%	0.778	S	S	*	*				50.7	152.8	128.7	-66.8	-2.7	0	0	0	123.8
672	L	31.7	Very low	31.7	Very low	149 Å²	149	139.3 Å²	139.3	78%	0.78	78%	0.781	S	S	*	*			trans	90.4	99.8	161.8	-68.2	157.7	0	0	0	118.9
673	D	28.9	Very low	30.7	Very low	134 Å²	134	137.6 Å²	137.6	72%	0.717	77%	0.774	S	S	*	*				74.7	138.4	119.7	-77.4	7.5	0	0	0	125.2
674	I	30.3	Very low	30.6	Very low	159 Å²	159	138.5 Å²	138.5	82%	0.815	77%	0.771	S	S	*	*			trans	83.8	147.3	144.8	-74.6	166.2	0	0	0	119.3
675	S	27.6	Very low	30	Very low	100 Å²	100	139.7 Å²	139.7	70%	0.699	77%	0.769	S	S	*	*			trans	-88.7	156.5	-170.6	52.6	0	0	0	0	113.4
676	S	28.5	Very low	30.1	Very low	104 Å²	104	136.1 Å²	136.1	73%	0.727	76%	0.757	S	S	*	*				161.5	146.2	108.7	52.9	0	0	0	0	115.3
677	F	29.4	Very low	29.7	Very low	179 Å²	179	139.4 Å²	139.4	79%	0.785	76%	0.763	S	S	*	*			trans	38.4	138	147.1	-80.1	-84.1	0	0	0	125.1
678	Q	28	Very low	29.4	Very low	159 Å²	159	139.6 Å²	139.6	74%	0.743	76%	0.76	S	S	*	*			trans	68.2	153.9	145.4	-78.3	161.9	-98.2	0	0	119.8
679	L	29.3	Very low	29.3	Very low	134 Å²	134	142.5 Å²	142.5	70%	0.702	76%	0.76	S	S	*	*			cis	-166	171	-36.6	-148.7	126	0	0	0	109.2
680	Q	26.1	Very low	29.1	Very low	152 Å²	152	145.3 Å²	145.3	71%	0.71	76%	0.761	S	S	*	*			trans	81.5	110.4	143.8	-135.9	160.9	-14.6	0	0	121.3
681	Y	28.1	Very low	29.3	Very low	228 Å²	228	146.7 Å²	146.7	89%	0.894	76%	0.76	S	S	*	*			trans	53	146.9	138.7	-73.1	-123.8	0	0	0	120.6
682	G	26.9	Very low	29.1	Very low	66 Å²	66	146.5 Å²	146.5	68%	0.68	77%	0.765	S	S	*	*			cis	173.5	162.2	-6	0	0	0	0	0	114.4
683	S	26.7	Very low	29.1	Very low	91 Å²	91	148.7 Å²	148.7	64%	0.636	77%	0.771	S	S	*	*			trans	25.1	124.4	148	-168.2	0	0	0	0	120.1
684	Y	30.1	Very low	29.1	Very low	218 Å²	218	146 Å²	146	86%	0.855	78%	0.775	S	S	*	*				-164.7	155.3	95.6	-111.2	-81	0	0	0	114.7
685	N	26	Very low	29.1	Very low	137 Å²	137	147.3 Å²	147.3	73%	0.733	78%	0.777	S	S	*	*			trans	-85.8	174.1	173	-72.3	-11.2	0	0	0	110.8
686	T	30.1	Very low	29.1	Very low	103 Å²	103	149.5 Å²	149.5	63%	0.632	79%	0.786	S	S	*	*			cis	-163.1	-176.9	-7.7	18.3	0	0	0	0	108.7
687	E	29.7	Very low	29.2	Very low	169 Å²	169	154.4 Å²	154.4	79%	0.79	79%	0.79	S	S	*	*			trans	72.2	161.4	152.7	-77.8	149.8	-105.2	0	0	118.2
688	T	27.6	Very low	29	Very low	127 Å²	127	152.8 Å²	152.8	78%	0.779	79%	0.789	S	S	*	*			cis	-131.8	171.2	-0.7	42.3	0	0	0	0	112.5
689	H	33	Very low	29	Very low	183 Å²	183	155.1 Å²	155.1	85%	0.847	79%	0.793	S	S	*	*			trans	-74.7	155.8	157.6	-96	-97.5	0	0	0	112.2
690	D	29.5	Very low	29.2	Very low	155 Å²	155	156.4 Å²	156.4	83%	0.829	80%	0.799	S	S	*	*				-172.3	-177.7	105.7	-140.4	-28.5	0	0	0	113.4
691	K	35.5	Very low	29.6	Very low	180 Å²	180	154.1 Å²	154.1	78%	0.783	80%	0.797	S	S	*	*			trans	-110.4	158	-179.8	-59.9	174.3	178.9	175.6	0	113.3
692	T	28.8	Very low	30	Very low	150 Å²	150	148.5 Å²	148.5	92%	0.92	79%	0.788	S	S	*	*			trans	-166.7	164.4	139.2	3.8	0	0	0	0	112.1
693	E	31.8	Very low	30.6	Very low	194 Å²	194	151.6 Å²	151.6	91%	0.907	80%	0.796	S	S	*	*			trans	-101.7	161.8	-178.8	-59.7	176.5	133.4	0	0	112.5
694	G	27.9	Very low	30.8	Very low	78 Å²	78	153.8 Å²	153.8	80%	0.804	81%	0.806	S	S	*	*			trans	-179.8	116.1	170.2	0	0	0	0	0	114.3
695	H	30.6	Very low	30.7	Very low	187 Å²	187	147.1 Å²	147.1	87%	0.866	80%	0.803	S	S	*	*			trans	-100	133.3	178.3	-67.6	-75.3	0	0	0	112.9
696	V	28.6	Very low	30.9	Very low	145 Å²	145	148.9 Å²	148.9	88%	0.879	81%	0.807	S	S	*	*			trans	-140.4	142.2	152.7	-176.7	0	0	0	0	109.1
697	Y	28.9	Very low	30.7	Very low	208 Å²	208	151 Å²	151	82%	0.816	81%	0.812	S	S	*	*			trans	-79.5	148.4	-178	-77.5	-103.8	0	0	0	113.3
698	N	26.8	Very low	30.5	Very low	145 Å²	145	148 Å²	148	78%	0.775	81%	0.808	S	S	*	*				-168.4	151.5	113.4	-106.3	-46.4	0	0	0	116.1
699	Y	27.9	Very low	30.5	Very low	207 Å²	207	151 Å²	151	81%	0.812	81%	0.813	S	S	*	*			trans	59.6	112.3	160	-97.7	-103.8	0	0	0	121.7
700	I	33.5	Very low	30.4	Very low	162 Å²	162	149.4 Å²	149.4	83%	0.831	81%	0.811	S	S	*	*			trans	-129.6	120.2	158.6	-64.8	174.1	0	0	0	108.3
701	P	32.9	Very low	30.5	Very low	104 Å²	104	148 Å²	148	68%	0.675	81%	0.81	S	S	*	*			trans	-78.8	152.8	166.3	-14.7	31.5	0	0	0	112.5
702	P	36.7	Very low	30.2	Very low	109 Å²	109	146.8 Å²	146.8	71%	0.708	81%	0.811	S	S	*	*			trans	-97.8	153.9	-164.1	37.2	-36.6	0	0	0	115.5
703	P	40.4	Very low	30.2	Very low	131 Å²	131	149.7 Å²	149.7	85%	0.851	81%	0.806	S	S	*	*			trans	-94.8	97.5	165	34.5	-28.9	0	0	0	111.6
704	V	29.5	Very low	29.9	Very low	137 Å²	137	147.3 Å²	147.3	83%	0.83	80%	0.797	S	S	*	*			trans	-140.9	125.2	171.9	-173	0	0	0	0	110.4
705	G	28.9	Very low	30	Very low	78 Å²	78	151.1 Å²	151.1	80%	0.804	79%	0.794	S	S	*	*			trans	177.8	92.4	178.2	0	0	0	0	0	112.1
706	Q	31.1	Very low	29.8	Very low	174 Å²	174	149.4 Å²	149.4	81%	0.813	78%	0.784	S	S	*	*			trans	-90.8	142.1	-173.2	-89.5	-178.5	-50.7	0	0	114.1
707	M	24.3	Very low	29.8	Very low	149 Å²	149	150 Å²	150	73%	0.734	78%	0.777	S	S	*	*			trans	72.3	124.5	140	-68.6	171.4	68.5	0	0	121.4
708	C	26.5	Very low	29.7	Very low	105 Å²	105	144 Å²	144	71%	0.709	78%	0.779	S	S	*	*			trans	62	118.6	137.8	-56.6	0	0	0	0	120.4
709	Q	28.3	Very low	29.6	Very low	189 Å²	189	143.4 Å²	143.4	88%	0.883	78%	0.776	S	S	*	*				-175.3	165	95.2	-95.1	179.3	23.8	0	0	112.1
710	N	29.6	Very low	30	Very low	150 Å²	150	139.1 Å²	139.1	80%	0.802	77%	0.773	S	S	*	*			trans	-69.9	162	168.1	-68.2	-18.2	0	0	0	110.4
711	P	32.8	Very low	29.6	Very low	125 Å²	125	136.9 Å²	136.9	81%	0.812	77%	0.767	S	S	*	*				-137.9	152.2	110.9	37.2	-27.6	0	0	0	114.8
712	I	28.1	Very low	29.3	Very low	155 Å²	155	136.8 Å²	136.8	80%	0.795	78%	0.775	S	S	*	*			trans	-103.1	117.3	154.7	-63.5	167.4	0	0	0	105.4
713	Y	28.4	Very low	28.8	Very low	211 Å²	211	142.5 Å²	142.5	83%	0.827	78%	0.784	S	S	*	*			trans	-164.3	115.5	147.4	-128.2	-95.8	0	0	0	112.6
714	M	27	Very low	28.1	Very low	145 Å²	145	146.1 Å²	146.1	71%	0.714	78%	0.782	S	S	*	*			trans	16.6	147.8	141.5	-76.9	-65.1	-176.3	0	0	123.7
715	Q	28.8	Very low	28	Very low	158 Å²	158	149.3 Å²	149.3	74%	0.738	78%	0.779	S	S	*	*			trans	76.8	150.8	138.1	-77.5	173.3	-26.4	0	0	120.1
716	K	27.4	Very low	27.8	Very low	150 Å²	150	153.4 Å²	153.4	65%	0.652	78%	0.782	S	S	*	*			cis	-170.2	168.4	-29.7	-136.6	-176.4	153.5	-158	0	110.7
717	E	27.5	Very low	27.7	Very low	157 Å²	157	151 Å²	151	73%	0.734	77%	0.774	S	S	*	*			trans	71.3	146.6	148.4	-81.9	155.4	170.5	0	0	121.2
718	G	27.9	Very low	27.7	Very low	83 Å²	83	152 Å²	152	86%	0.856	78%	0.777	S	S	*	*			trans	166.6	31.7	-173.7	0	0	0	0	0	112.9
719	D	24.2	Very low	27.6	Very low	133 Å²	133	155.8 Å²	155.8	71%	0.711	78%	0.784	S	S	*	*			trans	-79	159.7	179.5	-128.5	-40.7	0	0	0	110.2	V721	D719-V721 PolarHBondContact OD1-N 2.84Å; D719-V721 VanDerWaalsContact OD1-N 3.11Å
720	P	35.4	Very low	27.3	Very low	116 Å²	116	156.6 Å²	156.6	75%	0.753	79%	0.785	S	S	*	*				-150.9	137.3	69.7	37.3	-16.3	0	0	0	118.7
721	V	26	Very low	27	Very low	115 Å²	115	153.1 Å²	153.1	70%	0.697	79%	0.785	S	S	*	*				40.4	114.9	124.7	-172.2	0	0	0	0	119.6	D719	D719-V721 PolarHBondContact OD1-N 2.84Å; D719-V721 VanDerWaalsContact OD1-N 3.11Å
722	A	27.6	Very low	26.7	Very low	102 Å²	102	156.8 Å²	156.8	84%	0.843	78%	0.784	S	S	*	*			trans	-145.6	135.1	148.5	0	0	0	0	0	113.3
723	Y	25.9	Very low	26.6	Very low	229 Å²	229	155.3 Å²	155.3	90%	0.898	79%	0.788	S	S	*	*			trans	-44.1	168.5	-170.9	-103.2	-110.7	0	0	0	122.7
724	Y	24.9	Very low	26.5	Very low	208 Å²	208	151.2 Å²	151.2	82%	0.816	78%	0.78	S	S	*	*			trans	-82.6	158.9	176.9	-103.8	-82.3	0	0	0	115.3
725	R	26.8	Very low	26.7	Very low	204 Å²	204	151.5 Å²	151.5	77%	0.77	78%	0.783	S	S	*	*			trans	66.5	132.4	151	-83.7	177.9	175.6	167.1	-1.8	119.8
726	N	25.8	Very low	26.6	Very low	163 Å²	163	150.1 Å²	150.1	87%	0.872	78%	0.781	S	S	*	*				-150.6	171.2	106.5	-98.9	-31.3	0	0	0	111.7
727	L	28	Very low	26.7	Very low	123 Å²	123	150.7 Å²	150.7	64%	0.644	79%	0.786	S	S	*	*			trans	-102.3	165.4	-177.5	-83.1	72.6	0	0	0	111.7
728	H	25.3	Very low	26.7	Very low	171 Å²	171	153.2 Å²	153.2	79%	0.792	80%	0.795	S	S	*	*			trans	63.4	138.3	167.1	-70.2	-79	0	0	0	114.7
729	E	24	Very low	26.8	Very low	185 Å²	185	156.7 Å²	156.7	86%	0.864	79%	0.786	S	S	*	*				-159.4	-172.8	54.6	-144.5	165.8	-167.9	0	0	113.2
730	F	22.5	Very low	26.9	Very low	206 Å²	206	157.7 Å²	157.7	90%	0.904	79%	0.786	S	S	*	*			trans	-77	149.9	168.9	-79.6	-109	0	0	0	110.9
731	G	23.3	Very low	26.3	Very low	77 Å²	77	159.5 Å²	159.5	79%	0.794	79%	0.79	S	S	*	*			trans	-163.1	123.6	172	0	0	0	0	0	113.3
732	Y	25.8	Very low	27.2	Very low	201 Å²	201	159.5 Å²	159.5	79%	0.788	79%	0.792	S	S	*	*			trans	-79	158.7	176.6	-88.7	-102.2	0	0	0	112.5
733	S	26	Very low	27.1	Very low	125 Å²	125	158.4 Å²	158.4	87%	0.874	78%	0.783	S	S	*	*			trans	-144.2	129.6	144.5	-75	0	0	0	0	108.4
734	N	26.5	Very low	27.1	Very low	124 Å²	124	153.2 Å²	153.2	66%	0.663	78%	0.776	S	S	*	*			trans	-112.8	-177.6	-168.5	-89.9	-15.9	0	0	0	111.6
735	L	30	Very low	27.2	Very low	151 Å²	151	150.4 Å²	150.4	79%	0.791	77%	0.774	S	S	*	*			trans	98	128.7	162.1	-52.4	172.4	0	0	0	114.6
736	D	27.9	Very low	27.4	Very low	129 Å²	129	144.7 Å²	144.7	69%	0.69	77%	0.77	S	S	*	*			cis	-149.4	171	2.3	-140	-19.8	0	0	0	116.1
737	H	29	Very low	27.5	Very low	162 Å²	162	145.4 Å²	145.4	75%	0.75	77%	0.766	S	S	*	*			trans	-56.9	145.3	-165.5	-72.2	-75.6	0	0	0	118
738	K	28.4	Very low	27.5	Very low	211 Å²	211	145.5 Å²	145.5	92%	0.917	77%	0.772	S	S	*	*				-137.3	168.9	115.4	-117.5	172.7	-175.4	177	0	111.5
739	K	29.5	Very low	27.7	Very low	156 Å²	156	144.5 Å²	144.5	68%	0.678	77%	0.771	S	S	*	*			trans	-109.5	154.8	-146	-105.8	-179.3	158.1	-141.8	0	115.8
740	E	26.5	Very low	27.9	Very low	153 Å²	153	141 Å²	141	72%	0.715	77%	0.767	S	S	*	*			trans	77.4	100.2	143.4	-75.3	155.6	-174.7	0	0	120.6
741	D	22.9	Very low	28.4	Very low	155 Å²	155	136.2 Å²	136.2	83%	0.829	77%	0.765	S	S	*	*			trans	-41.3	174.7	138.9	-85.6	-56.5	0	0	0	115.8
742	P	44.3	Very low	28.6	Very low	114 Å²	114	137.5 Å²	137.5	74%	0.74	77%	0.768	S	S	*	*			cis	-131.6	178.6	-7.7	24.3	-1.3	0	0	0	114.2
743	A	25.2	Very low	28.7	Very low	80 Å²	80	136.8 Å²	136.8	66%	0.661	77%	0.772	S	S	*	*				151.5	136.8	113.6	0	0	0	0	0	116.7
744	T	27.1	Very low	28.7	Very low	120 Å²	120	138.4 Å²	138.4	74%	0.736	77%	0.77	S	S	*	*			trans	58.7	110.2	149.7	50.2	0	0	0	0	122.2
745	L	26	Very low	28.6	Very low	148 Å²	148	140.8 Å²	140.8	78%	0.775	78%	0.782	S	S	*	*			trans	68.3	140.9	131.5	-64.4	160.5	0	0	0	118.9	F747	L745-F747 HydrophobicContact CD2-CD2 4.21Å; L745-F747 HydrophobicContact CD2-CE2 3.66Å
746	A	30.8	Very low	28.4	Very low	85 Å²	85	141.8 Å²	141.8	70%	0.702	78%	0.782	S	S	*	*			cis	-144.6	134.5	13	0	0	0	0	0	114.9
747	F	29.3	Very low	28.3	Very low	177 Å²	177	144.6 Å²	144.6	78%	0.776	79%	0.789	S	S	*	*			trans	35.8	110.6	147	-63.5	-74.7	0	0	0	122.9	L745	L745-F747 HydrophobicContact CD2-CD2 4.21Å; L745-F747 HydrophobicContact CD2-CE2 3.66Å
748	T	27.2	Very low	28	Very low	125 Å²	125	145 Å²	145	77%	0.767	79%	0.791	S	S	*	*			trans	-78.1	175.2	135.6	50.1	0	0	0	0	111.1
749	I	30.1	Very low	27.9	Very low	151 Å²	151	140.5 Å²	140.5	77%	0.774	79%	0.786	S	S	*	*				-179.6	155	122.7	-94.2	159.9	0	0	0	111.6
750	S	28.4	Very low	27.6	Very low	111 Å²	111	138.3 Å²	138.3	78%	0.776	79%	0.79	S	S	*	*			trans	-122.4	151.1	172.3	-55.6	0	0	0	0	110.8
751	A	31.3	Very low	27.9	Very low	105 Å²	105	136.2 Å²	136.2	87%	0.868	79%	0.79	S	S	*	*			trans	43.5	129.1	155.5	0	0	0	0	0	121
752	A	29.1	Very low	28	Very low	104 Å²	104	138.9 Å²	138.9	86%	0.86	79%	0.788	S	S	*	*			trans	-159.9	171.7	152.7	0	0	0	0	0	113.4
753	E	27.3	Very low	27.3	Very low	187 Å²	187	140.2 Å²	140.2	87%	0.874	79%	0.785	S	S	*	*			trans	-75.5	-169.4	-167.1	-62	163.6	100.7	0	0	117.1
754	L	25.6	Very low	28.3	Very low	159 Å²	159	141.5 Å²	141.5	83%	0.832	79%	0.786	S	S	*	*			trans	-58	151.1	172.7	-72.7	65.3	0	0	0	113.5
755	L	24.4	Very low	28.4	Very low	174 Å²	174	143.4 Å²	143.4	91%	0.911	79%	0.787	S	S	*	*				-155.7	144.7	122.4	-126.7	144.4	0	0	0	112.1
756	E	26.7	Very low	28.8	Very low	171 Å²	171	143 Å²	143	80%	0.799	79%	0.785	S	S	*	*			trans	-81.4	154.6	-178.5	-54.9	174.2	103.1	0	0	113.3
757	K	25	Very low	28.8	Very low	189 Å²	189	145.3 Å²	145.3	82%	0.822	79%	0.785	S	S	*	*				-165.4	148.8	120.3	-116.7	173.9	-178	170.1	0	117
758	Q	23.8	Very low	29	Very low	170 Å²	170	146 Å²	146	79%	0.794	78%	0.783	S	S	*	*			trans	89.9	142.7	147	-78.9	177.4	-30.3	0	0	122.5
759	S	24.8	Very low	29.3	Very low	116 Å²	116	146.8 Å²	146.8	81%	0.811	78%	0.779	S	S	*	*			trans	62.9	97.1	164.7	48.6	0	0	0	0	119.9
760	S	23.2	Very low	29.4	Very low	111 Å²	111	145.2 Å²	145.2	78%	0.776	77%	0.771	S	S	*	*				-79.3	166.4	130	67.7	0	0	0	0	109.3
761	P	33.8	Very low	29.6	Very low	108 Å²	108	146.9 Å²	146.9	70%	0.701	77%	0.77	S	S	*	*				-149.2	153.8	80.1	38.8	-21.2	0	0	0	116.8
762	R	25.3	Very low	29.5	Very low	212 Å²	212	145.6 Å²	145.6	80%	0.8	76%	0.76	S	S	*	*			trans	65.6	154.6	142.4	-73.9	-173.7	149.1	128.4	5.4	120.3
763	E	29.6	Very low	29.4	Very low	141 Å²	141	147.6 Å²	147.6	66%	0.659	75%	0.751	S	S	*	*			cis	-176.5	178	-24.7	-112.5	172.8	167.7	0	0	105.5
764	P	45.5	Very low	29.3	Very low	108 Å²	108	148.7 Å²	148.7	70%	0.701	75%	0.747	S	S	*	*				-111.3	-149.6	-62.1	37.2	-17.9	0	0	0	109.1
765	E	30.1	Very low	29.4	Very low	160 Å²	160	147.8 Å²	147.8	75%	0.748	75%	0.748	S	S	*	*			cis	-167.2	158.6	46.9	-153	172.8	-137.8	0	0	113.1
766	L	32.8	Very low	29.5	Very low	140 Å²	140	147.2 Å²	147.2	73%	0.733	74%	0.738	S	S	*	*			trans	68.4	117.8	172.1	-50.4	-179.3	0	0	0	116
767	L	32	Very low	29.5	Very low	133 Å²	133	146.5 Å²	146.5	70%	0.696	74%	0.735	S	S	*	*			cis	65.1	137.6	31.3	-49	176.6	0	0	0	113.4
768	Y	32.7	Very low	29.6	Very low	191 Å²	191	145.4 Å²	145.4	75%	0.749	74%	0.737	S	S	*	*			cis	-153.7	-179.1	1.7	-120.6	-31	0	0	0	107
769	Q	33.7	Very low	30.2	Very low	142 Å²	142	142.7 Å²	142.7	66%	0.664	73%	0.734	S	S	*	*			cis	-161.6	-177.1	10.2	-135.3	178.6	55.5	0	0	106
770	N	32.4	Very low	30.2	Very low	117 Å²	117	141.8 Å²	141.8	63%	0.626	73%	0.734	S	S	*	*			cis	-160.1	-176.6	-3.8	-143.6	-1.4	0	0	0	105.4
771	I	32.9	Very low	30.3	Very low	147 Å²	147	140.7 Å²	140.7	75%	0.754	74%	0.74	S	S	*	*			cis	-142.4	-101.8	-0.1	-169.5	167.9	0	0	0	112.3
772	A	28.7	Very low	29.7	Very low	78 Å²	78	138.7 Å²	138.7	65%	0.645	74%	0.739	S	S	*	*			trans	-167.1	178.4	-160.6	0	0	0	0	0	110.7
773	E	26.4	Very low	29.7	Very low	146 Å²	146	136.9 Å²	136.9	68%	0.682	74%	0.744	S	S	*	*			cis	-144.9	159.8	23.6	-82.6	-157.7	102.1	0	0	115.8
774	R	26.5	Very low	29.6	Very low	210 Å²	210	135.8 Å²	135.8	79%	0.792	75%	0.747	S	S	*	*			trans	33.9	126.7	146.3	-58.5	177.9	-162.3	-111.2	-0.5	120.6
775	V	26.5	Very low	28.8	Very low	139 Å²	139	139 Å²	139	84%	0.842	75%	0.752	S	S	*	*			cis	83.3	107.5	47.1	175.9	0	0	0	0	115.4
776	K	27.8	Very low	28.6	Very low	162 Å²	162	141.8 Å²	141.8	70%	0.704	76%	0.757	S	S	*	*			trans	164.7	152.1	153.6	-96.3	-173.1	175.2	-71	0	107.1
777	E	27	Very low	28.2	Very low	157 Å²	157	141.3 Å²	141.3	73%	0.734	76%	0.755	S	S	*	*			cis	-163.8	168.2	-19.8	-122.7	157.6	-154.7	0	0	107.1
778	L	26.5	Very low	27.9	Very low	165 Å²	165	144 Å²	144	86%	0.864	76%	0.762	S	S	*	*			trans	-80.7	173.5	175.2	-82.2	159.9	0	0	0	111.2
779	P	35.8	Very low	27.5	Very low	113 Å²	113	139.9 Å²	139.9	73%	0.734	76%	0.76	S	S	*	*			cis	-150.5	176	25.8	45.4	-24.6	0	0	0	120.3
780	A	24.9	Very low	27	Very low	98 Å²	98	139.9 Å²	139.9	81%	0.81	77%	0.77	S	S	*	*			trans	41.2	128.5	139.2	0	0	0	0	0	125
781	G	24.5	Very low	27.4	Very low	87 Å²	87	142.2 Å²	142.2	90%	0.897	78%	0.782	S	S	*	*			trans	90.7	146.4	146.6	0	0	0	0	0	117.5
782	G	22.9	Very low	27.2	Very low	66 Å²	66	141 Å²	141	68%	0.68	78%	0.783	S	S	*	*			cis	162.7	130.2	-9.3	0	0	0	0	0	113.1
783	L	25.5	Very low	27	Very low	175 Å²	175	147.3 Å²	147.3	92%	0.916	80%	0.796	S	S	*	*			trans	62.3	168.8	-175.8	-83.2	66.1	0	0	0	113.3
784	V	26.5	Very low	27	Very low	118 Å²	118	150.1 Å²	150.1	72%	0.715	80%	0.8	S	S	*	*			cis	-138.8	155.6	23.8	-179.5	0	0	0	0	111.2	Y786	V784-Y786 HydrophobicContact CG1-CE2 4.41Å
785	H	27.9	Very low	26.9	Very low	176 Å²	176	146.9 Å²	146.9	82%	0.815	79%	0.794	S	S	*	*			trans	-77.9	145.1	173.3	-112	60.7	0	0	0	113.2
786	Y	27.5	Very low	26.7	Very low	217 Å²	217	145.1 Å²	145.1	85%	0.851	78%	0.776	S	S	*	*			trans	-153.8	173.4	153.7	-94.4	-56.9	0	0	0	114.5	V784	V784-Y786 HydrophobicContact CG1-CE2 4.41Å
787	N	24.6	Very low	26.6	Very low	130 Å²	130	141.2 Å²	141.2	70%	0.695	77%	0.773	S	S	*	*			trans	-98.5	150.1	-148.1	-91.9	-25.9	0	0	0	117.4
788	F	24.2	Very low	26.9	Very low	190 Å²	190	139.9 Å²	139.9	83%	0.833	78%	0.778	S	S	*	*			trans	65.1	154.7	144.1	-87	-93.8	0	0	0	123.1
789	C	25.1	Very low	27	Very low	105 Å²	105	134.9 Å²	134.9	71%	0.709	76%	0.757	S	S	*	*			trans	-32.1	146.6	-178.5	-55.1	0	0	0	0	120.2
790	T	23.5	Very low	26.7	Very low	142 Å²	142	135.2 Å²	135.2	87%	0.871	75%	0.745	S	S	*	*				-165.1	156.3	120.8	9.4	0	0	0	0	114.2
791	L	40.3	Very low	26.8	Very low	166 Å²	166	135.5 Å²	135.5	87%	0.869	73%	0.729	S	S	*	*			trans	-75.1	151.4	160.3	-79.7	151.1	0	0	0	110.6
792	P	28.5	Very low	26.9	Very low	122 Å²	122	137.1 Å²	137.1	79%	0.792	73%	0.727	S	S	*	*			trans	-119.9	141.7	153.1	33.2	-22.4	0	0	0	113.6
793	K	23.8	Very low	27.2	Very low	210 Å²	210	143.4 Å²	143.4	91%	0.913	73%	0.73	S	S	*	*			trans	-92.3	164.4	160.5	-83	-176.6	174.5	-179.6	0	110.1
794	R	27.6	Very low	27.4	Very low	204 Å²	204	146.1 Å²	146.1	77%	0.77	73%	0.728	S	S	*	*			trans	-45.9	152.9	172.3	-61.5	169.9	168.9	169.9	-5.5	113.7
795	Q	24.4	Very low	27.5	Very low	143 Å²	143	149.4 Å²	149.4	67%	0.668	74%	0.736	S	S	*	*				178.1	137.2	96.5	-89.4	-173.4	9.6	0	0	115.3
796	F	22	Very low	27.4	Very low	102 Å²	102	148.3 Å²	148.3	45%	0.447	74%	0.736	S	S	.	*			trans	61.3	117.3	141.3	-79.3	-122.5	0	0	0	124.5	K277 P279	K277-F796 HydrophobicContact CB-CZ 4.26Å; K277-F796 WeakPolarHBondContact O-CZ 3.13Å; P279-F796 HydrophobicContact CB-CD1 3.75Å; P279-F796 HydrophobicContact CB-CE1 3.53Å; P279-F796 HydrophobicContact CB-CG 4.44Å; P279-F796 HydrophobicContact CB-CZ 4.07Å; P279-F796 VanDerWaalsContact CD-CZ 3.46Å; P279-F796 HydrophobicContact CG-CD1 4.19Å; P279-F796 HydrophobicContact CG-CD2 4.49Å; P279-F796 HydrophobicContact CG-CE1 4.01Å; P279-F796 HydrophobicContact CG-CE2 4.32Å; P279-F796 HydrophobicContact CG-CG 4.44Å; P279-F796 HydrophobicContact CG-CZ 4.08Å
797	A	24.7	Very low	27.7	Very low	79 Å²	79	145.5 Å²	145.5	65%	0.653	73%	0.731	S	S	*	*				56.8	156	127.6	0	0	0	0	0	121.6
798	P	33.4	Very low	27.9	Very low	130 Å²	130	145.1 Å²	145.1	84%	0.844	73%	0.728	S	S	*	*			cis	-131.6	-144.4	16.7	44.2	-24.8	0	0	0	114.8
799	S	28.4	Very low	28.3	Very low	60 Å²	60	146.1 Å²	146.1	42%	0.42	73%	0.727	S	S	.	*			trans	-175.7	161	-168.4	56.2	0	0	0	0	112.8	L281	L281-S799 WeakPolarHBondContact CD2-OG 3.36Å; L281-S799 WeakPolarHBondContact CG-OG 3.32Å
800	Y	29.6	Very low	28.7	Very low	120 Å²	120	147.8 Å²	147.8	47%	0.471	73%	0.727	S	S	.	*			trans	-164.1	153.8	148.4	-132.8	-120.9	0	0	0	118.3	S282 D283	S282-Y800 WeakPolarHBondContact O-CE2 2.91Å; S282-Y800 PolarHBondContact O-OH 2.87Å; S282-Y800 VanDerWaalsContact OG-CD2 3.31Å; S282-Y800 WeakPolarHBondContact OG-CD2 3.48Å; S282-Y800 WeakPolarHBondContact OG-CE2 3.49Å; D283-Y800 PolarHBondContact N-OH 3.38Å; D283-Y800 WeakPolarHBondContact O-CE2 3.48Å; D283-Y800 PolarHBondContact O-OH 2.95Å
801	E	28.6	Very low	29.2	Very low	103 Å²	103	146.8 Å²	146.8	48%	0.481	72%	0.716	S	S	.	*			trans	21.9	133.3	163.3	-90.2	-171.6	132.1	0	0	125.7	R803	E801-R803 PolarHBondContact OE1-NH1 2.91Å; E801-R803 IonicContact OE1-NH1 2.6Å; E801-R803 IonicContact OE1-CZ 2.73Å; E801-R803 WeakPolarHBondContact OE1-CD 3.43Å
802	S	26.5	Very low	28.9	Very low	122 Å²	122	148.7 Å²	148.7	85%	0.853	72%	0.718	S	S	*	*				-179.3	172.6	103.4	-78.5	0	0	0	0	113.7
803	R	28	Very low	28.9	Very low	197 Å²	197	148.6 Å²	148.6	74%	0.743	72%	0.715	S	S	*	*				-157.6	162.7	-98.2	-172.8	171.1	176.1	175.2	-3.6	112.4	E801	E801-R803 PolarHBondContact OE1-NH1 2.91Å; E801-R803 IonicContact OE1-NH1 2.6Å; E801-R803 IonicContact OE1-CZ 2.73Å; E801-R803 WeakPolarHBondContact OE1-CD 3.43Å
804	R	29.3	Very low	29.3	Very low	233 Å²	233	144.2 Å²	144.2	88%	0.879	71%	0.705	S	S	*	*			trans	82.8	154.7	176.7	-52.7	-177.6	179.2	-173.8	-0.7	114.2
805	Q	29.4	Very low	29.4	Very low	187 Å²	187	141.7 Å²	141.7	87%	0.874	71%	0.706	S	S	*	*			cis	-134.4	171.6	13	-158	159.4	-11.3	0	0	112.2
806	N	27.1	Very low	29.7	Very low	153 Å²	153	146 Å²	146	82%	0.818	72%	0.718	S	S	*	*			trans	-155.1	174.2	-168	-165.5	8	0	0	0	111.6
807	Q	32.2	Very low	30	Very low	158 Å²	158	144.5 Å²	144.5	74%	0.738	73%	0.731	S	S	*	*			trans	102.1	144.1	178.4	-69.9	179.6	-119.5	0	0	115.9
808	D	30.3	Very low	30.3	Very low	121 Å²	121	147.3 Å²	147.3	65%	0.647	74%	0.74	S	S	*	*			cis	-133.3	165.8	17	-123.7	-41.2	0	0	0	118.8
809	R	31.7	Very low	30.3	Very low	212 Å²	212	147.2 Å²	147.2	80%	0.8	74%	0.74	S	S	*	*			trans	-48.6	170.4	170.6	-74.6	164.6	149.3	-171.1	-6.7	115.5
810	I	34.2	Very low	30.3	Very low	140 Å²	140	155.2 Å²	155.2	72%	0.718	76%	0.761	S	S	*	*			cis	-160.4	167.1	8.6	-122.3	155.3	0	0	0	107
811	N	32.3	Very low	30.5	Very low	120 Å²	120	159.2 Å²	159.2	64%	0.642	78%	0.781	S	S	*	*			cis	173.5	130.2	-37.4	172.5	39.8	0	0	0	108.8
812	K	34.3	Very low	30.3	Very low	207 Å²	207	164.4 Å²	164.4	90%	0.9	80%	0.797	S	S	*	*			trans	-159.4	134	149.4	-118.2	175.9	-172.9	-179.7	0	112.8
813	T	29.6	Very low	30.3	Very low	119 Å²	119	168 Å²	168	73%	0.73	80%	0.798	S	S	*	*			trans	-104.5	174.1	175.3	49.8	0	0	0	0	109.5
814	V	31.1	Very low	30.3	Very low	118 Å²	118	163.1 Å²	163.1	72%	0.715	80%	0.8	S	S	*	*			cis	-153	171.6	11.2	86.7	0	0	0	0	112.1
815	L	31	Very low	30.1	Very low	151 Å²	151	160.8 Å²	160.8	79%	0.791	80%	0.799	S	S	*	*			trans	-17.4	147.3	165.5	-63.7	157.1	0	0	0	119.5
816	Y	29.5	Very low	30.1	Very low	235 Å²	235	160.8 Å²	160.8	92%	0.922	80%	0.799	S	S	*	*			trans	-127.2	145	146.6	-102.4	-88.1	0	0	0	111
817	G	28	Very low	30.1	Very low	69 Å²	69	158.8 Å²	158.8	71%	0.711	80%	0.797	S	S	*	*			trans	-108.5	163.9	-179.4	0	0	0	0	0	113.6
818	T	32.1	Very low	30	Very low	139 Å²	139	160.4 Å²	160.4	85%	0.853	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-71	135.2	-177.3	52.2	0	0	0	0	113.3
819	P	33.4	Very low	30.5	Very low	127 Å²	127	160 Å²	160	83%	0.825	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-80.2	141.8	178.5	32.2	-34.5	0	0	0	113
820	R	27.3	Very low	30.3	Very low	228 Å²	228	158 Å²	158	86%	0.86	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-103.3	137	157.7	-78.8	-179.4	167.7	177.9	-5	108.8
821	K	33.8	Very low	30.1	Very low	205 Å²	205	159.9 Å²	159.9	89%	0.891	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-91.7	132.6	165.4	-75	-177.1	174.2	179.4	0	109.7
822	Y	24.9	Very low	31.1	Very low	211 Å²	211	159 Å²	159	83%	0.827	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-101.9	152.2	159.6	-97.4	-92.2	0	0	0	108.4
823	F	27.6	Very low	30.8	Very low	197 Å²	197	156.5 Å²	156.5	86%	0.864	81%	0.807	S	S	*	*			trans	-123	153.2	157.9	-106.9	-85.7	0	0	0	108.2
824	A	26.5	Very low	30.8	Very low	95 Å²	95	157.8 Å²	157.8	79%	0.785	81%	0.809	S	S	*	*			trans	-138	152.8	173.2	0	0	0	0	0	109.1
825	E	26.7	Very low	30.7	Very low	185 Å²	185	160.9 Å²	160.9	86%	0.864	82%	0.816	S	S	*	*			trans	-84.1	158.4	-173.2	-54.5	166	103.5	0	0	112.6
826	Q	28.9	Very low	30.6	Very low	186 Å²	186	157.4 Å²	157.4	87%	0.869	82%	0.816	S	S	*	*				-175.5	141.1	116.3	-100.5	169.8	23.2	0	0	115.1
827	S	27.3	Very low	30.6	Very low	112 Å²	112	155.9 Å²	155.9	78%	0.783	81%	0.814	S	S	*	*			trans	54.3	130.1	150.2	56.1	0	0	0	0	123.6
828	K	30.2	Very low	30.7	Very low	192 Å²	192	160.9 Å²	160.9	84%	0.835	82%	0.823	S	S	*	*			trans	-72.2	175.3	158	-104	-173.7	179.1	-174.1	0	112.2
829	P	40.4	Very low	30.6	Very low	113 Å²	113	162.2 Å²	162.2	73%	0.734	82%	0.82	S	S	*	*			cis	-134.3	-158.4	27.6	35	-9.4	0	0	0	113.1
830	E	26.4	Very low	30.5	Very low	170 Å²	170	162.7 Å²	162.7	79%	0.794	82%	0.821	S	S	*	*			cis	-133.9	-104.8	8.5	-65.2	-174.7	67	0	0	114.6
831	H	30.6	Very low	30.9	Very low	178 Å²	178	160.9 Å²	160.9	82%	0.824	82%	0.822	S	S	*	*			trans	-163.8	173.4	-156.4	-82.6	-75.8	0	0	0	110.5
832	P	52.6	Low	31.3	Very low	102 Å²	102	157 Å²	157	66%	0.662	82%	0.818	S	S	*	*			cis	-135.9	-157.5	-42.6	38.1	-18.6	0	0	0	112.2
833	L	29.8	Very low	32	Very low	154 Å²	154	153.6 Å²	153.6	81%	0.806	81%	0.814	S	S	*	*			trans	79.7	150.5	174.7	-54	160.8	0	0	0	114.9
834	L	29	Very low	32.4	Very low	146 Å²	146	154.1 Å²	154.1	76%	0.764	81%	0.811	S	S	*	*			cis	-145.9	-174.5	0.5	-132.1	163.6	0	0	0	111
835	Q	28.9	Very low	33.2	Very low	184 Å²	184	155.9 Å²	155.9	86%	0.86	81%	0.807	S	S	*	*			trans	-76	155.4	-174	-65.2	166.8	-26.4	0	0	114.4
836	G	28.9	Very low	34	Very low	77 Å²	77	153.6 Å²	153.6	79%	0.794	80%	0.796	S	S	*	*			trans	-163.5	122.5	163.4	0	0	0	0	0	112.3
837	K	29.7	Very low	34.9	Very low	204 Å²	204	149.9 Å²	149.9	89%	0.887	79%	0.786	S	S	*	*			trans	-85.5	150.6	171.6	-58.9	176.7	-178.8	179.2	0	109.9
838	L	30.4	Very low	35.7	Very low	173 Å²	173	151.4 Å²	151.4	91%	0.906	79%	0.785	S	S	*	*				-170	149.8	119.1	-105.4	153.1	0	0	0	112
839	Q	28.9	Very low	36.6	Very low	168 Å²	168	150.2 Å²	150.2	79%	0.785	78%	0.782	S	S	*	*			trans	-89.1	155.4	165.1	-61	154.2	-84.5	0	0	108.4
840	T	31.2	Very low	36.8	Very low	136 Å²	136	151.2 Å²	151.2	83%	0.834	78%	0.775	S	S	*	*				159	129.1	123.4	44.4	0	0	0	0	110.4
841	E	36.4	Very low	37.7	Very low	191 Å²	191	151.2 Å²	151.2	89%	0.893	78%	0.775	S	S	*	*			trans	-79.3	146.4	158.5	-63.1	169.2	124	0	0	109.7
842	P	41.5	Very low	38.4	Very low	123 Å²	123	148.7 Å²	148.7	80%	0.799	77%	0.772	S	S	*	*			trans	-104.1	146.4	158.7	35	-27.9	0	0	0	111.8
843	D	39.7	Very low	38.1	Very low	140 Å²	140	147.6 Å²	147.6	75%	0.749	77%	0.772	S	S	*	*			trans	-80.9	159.8	-170.3	-164.2	4	0	0	0	114	L845	D843-L845 VanDerWaalsContact C-N 3.34Å; D843-L845 PolarHBondContact O-N 2.9Å
844	Y	36	Very low	38.4	Very low	207 Å²	207	146.7 Å²	146.7	81%	0.812	77%	0.766	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.6	-1.8	-163.7	-157.6	-104.5	0	0	0	115.1
845	L	44.7	Very low	39	Very low	132 Å²	132	145.3 Å²	145.3	69%	0.691	77%	0.769	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.3	-29.3	-168.9	-93.1	79.7	0	0	0	116	D843 V847	D843-L845 VanDerWaalsContact C-N 3.34Å; D843-L845 PolarHBondContact O-N 2.9Å; L845-V847 VanDerWaalsContact C-N 3.26Å; L845-V847 PolarHBondContact O-N 2.78Å
846	E	43.4	Very low	39.5	Very low	138 Å²	138	144.7 Å²	144.7	65%	0.645	77%	0.766	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.9	-9.8	-169.7	-143.9	-154.3	131.3	0	0	114.7	K850	E846-K850 IonicContact OE1-NZ 2.86Å; E846-K850 PolarHBondContact OE1-NZ 3.04Å
847	V	46.6	Very low	39.6	Very low	107 Å²	107	152.7 Å²	152.7	65%	0.648	79%	0.789	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.7	-30.4	-177.2	-177.8	0	0	0	0	112.1	L845	L845-V847 VanDerWaalsContact C-N 3.26Å; L845-V847 PolarHBondContact O-N 2.78Å
848	L	45.4	Very low	40.1	Very low	144 Å²	144	150.2 Å²	150.2	75%	0.754	78%	0.784	S	S	*	*	G	3₁₀ helix	trans	-77.8	-29.7	-168.6	-149.1	73.9	0	0	0	113.6	K850	L848-K850 VanDerWaalsContact C-N 3.32Å; L848-K850 PolarHBondContact O-N 2.85Å
849	E	48.3	Very low	40.6	Very low	167 Å²	167	148.9 Å²	148.9	78%	0.78	78%	0.778	S	S	*	*	G	3₁₀ helix	trans	-79.6	-8.6	-179.4	-64.4	-163.6	134.2	0	0	114.2
850	K	44.1	Very low	41.3	Very low	135 Å²	135	147.9 Å²	147.9	59%	0.587	78%	0.778	S	S	*	*	G	3₁₀ helix	trans	-101.9	3.6	-173.9	-78.6	173.3	179.6	166.3	0	115.7	E846 L848	E846-K850 IonicContact OE1-NZ 2.86Å; E846-K850 PolarHBondContact OE1-NZ 3.04Å; L848-K850 VanDerWaalsContact C-N 3.32Å; L848-K850 PolarHBondContact O-N 2.85Å
851	Q	45.1	Very low	41.9	Very low	169 Å²	169	148.6 Å²	148.6	79%	0.79	77%	0.774	S	S	*	*	S	Bend	trans	-114.9	-5	-179.4	-74.4	-164.9	-31.8	0	0	116.2
852	T	46.8	Very low	42.2	Very low	126 Å²	126	145.9 Å²	145.9	77%	0.773	77%	0.767	S	S	*	*	S	Bend	trans	-93.1	7.9	177.6	42.1	0	0	0	0	114.4
853	A	44.5	Very low	42.3	Very low	79 Å²	79	147.5 Å²	147.5	65%	0.653	77%	0.765	S	S	*	*	S	Bend	trans	-128.2	15.3	-169.6	0	0	0	0	0	116.3
854	I	37.7	Very low	42.5	Very low	134 Å²	134	148 Å²	148	69%	0.687	77%	0.766	S	S	*	*			trans	-124.1	83.8	158.3	-63.5	86.9	0	0	0	108.6
855	S	41.8	Very low	42.9	Very low	117 Å²	117	143.5 Å²	143.5	82%	0.818	76%	0.763	S	S	*	*			trans	-129.1	40.6	153.7	77.3	0	0	0	0	110.2
856	Q	38.3	Very low	42.8	Very low	172 Å²	172	144.4 Å²	144.4	80%	0.804	77%	0.769	S	S	*	*			trans	-126.8	127.2	152.9	-72.4	-167.6	-7.6	0	0	106.5
857	L	31.7	Very low	42.7	Very low	245 Å²	245	145 Å²	145	100%	1.283	78%	0.78	S	S	*	*			trans	71.9	0	-167.2	-55.7	168.2	0	0	0	113.7

Retrieved 857 of 857 residues in 1120.2 ms (Link to these results)

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