A0A096MY03_PAPAN Loading...

Myotubularin related protein 11

AlphaFold DB , UniProt , Accession A0A096MY03, Species PAPAN (Papio anubis, Olive baboon), Gene MTMR11, Length 709 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	27.8	Very low	25.9	Very low	238 Å²	238	165.6 Å²	165.6	100%	1.172	86%	0.862	S	S	*	*				0	95.5	0	-59.6	-179.3	-157.7	0	0	105.9
2	W	24.5	Very low	25.9	Very low	223 Å²	223	165.8 Å²	165.8	85%	0.845	86%	0.861	S	S	*	*				60.2	138.8	88.4	-94.6	57.6	0	0	0	115.8
3	W	28.1	Very low	26.2	Very low	219 Å²	219	160 Å²	160	83%	0.83	85%	0.853	S	S	*	*			trans	90.3	127	170.7	-56.1	95.5	0	0	0	116.8
4	G	24.7	Very low	26.2	Very low	77 Å²	77	157.6 Å²	157.6	79%	0.794	85%	0.851	S	S	*	*			cis	117	121.6	2.3	0	0	0	0	0	113.4
5	G	24.2	Very low	26	Very low	71 Å²	71	160.2 Å²	160.2	73%	0.732	86%	0.855	S	S	*	*			trans	165.7	101.5	165.1	0	0	0	0	0	111.2
6	R	28	Very low	25.9	Very low	256 Å²	256	163.2 Å²	163.2	97%	0.966	86%	0.858	S	S	*	*				85.9	130.8	76.3	-84.9	-162.7	-148	-121.8	4.7	115.2
7	G	26.1	Very low	25.8	Very low	71 Å²	71	164.8 Å²	164.8	73%	0.732	86%	0.86	S	S	*	*			trans	136	84.3	155.9	0	0	0	0	0	113.5
8	Q	26.9	Very low	25.6	Very low	197 Å²	197	165.8 Å²	165.8	92%	0.921	86%	0.86	S	S	*	*				93.5	134	93.6	-91.6	-171	-5.2	0	0	114.8
9	S	26.4	Very low	25.5	Very low	104 Å²	104	163.9 Å²	163.9	73%	0.727	86%	0.859	S	S	*	*			trans	-105.2	148.2	-167.1	42.6	0	0	0	0	113
10	F	23.3	Very low	25.4	Very low	205 Å²	205	164.8 Å²	164.8	90%	0.899	86%	0.858	S	S	*	*			trans	-145.8	128.7	156.3	-85.5	-81	0	0	0	111.5
11	N	25.3	Very low	25.2	Very low	161 Å²	161	165.7 Å²	165.7	86%	0.861	86%	0.86	S	S	*	*			trans	-88.8	133	169.4	-86.1	-35.1	0	0	0	109.6
12	I	25.6	Very low	25	Very low	167 Å²	167	158 Å²	158	86%	0.856	84%	0.842	S	S	*	*			trans	-150.5	130.1	150.2	-58.6	-174.4	0	0	0	109
13	A	29.3	Very low	24.9	Very low	91 Å²	91	153.2 Å²	153.2	75%	0.752	84%	0.843	S	S	*	*			trans	-79.4	166	175.5	0	0	0	0	0	112.7
14	P	27.2	Very low	24.7	Very low	127 Å²	127	150 Å²	150	83%	0.825	85%	0.847	S	S	*	*			trans	-127.6	136.1	151.2	28.3	-11.2	0	0	0	113.9
15	Q	23	Very low	24.7	Very low	196 Å²	196	155.4 Å²	155.4	92%	0.916	85%	0.852	S	S	*	*			trans	-63.1	149.9	161	-69.1	177.3	-43.3	0	0	110.6
16	K	24.7	Very low	24.6	Very low	208 Å²	208	161.2 Å²	161.2	90%	0.904	86%	0.86	S	S	*	*			trans	-145	117.9	163.4	-138.8	175.9	-176.6	-177.1	0	110.5
17	E	23.3	Very low	24.3	Very low	191 Å²	191	154.7 Å²	154.7	89%	0.893	85%	0.853	S	S	*	*			trans	-72.1	146.1	172	-68.4	171.1	148.6	0	0	110.8
18	E	22.2	Very low	24.2	Very low	183 Å²	183	162.9 Å²	162.9	86%	0.855	86%	0.862	S	S	*	*			trans	-77.7	158.7	169.2	-70.6	-175.8	151.9	0	0	111.8
19	P	24.7	Very low	24	Very low	129 Å²	129	162 Å²	162	84%	0.838	86%	0.86	S	S	*	*				-135.4	156.9	125.4	32.2	-17.7	0	0	0	114.4
20	E	22.9	Very low	23.9	Very low	181 Å²	181	162.6 Å²	162.6	85%	0.846	86%	0.862	S	S	*	*			trans	-71.9	161.6	-173.2	-66.2	-178.9	138.9	0	0	116.8
21	M	22	Very low	23.9	Very low	184 Å²	184	161 Å²	161	91%	0.906	86%	0.857	S	S	*	*			trans	113.3	127.8	141.9	-81.8	-133	-74.4	0	0	118.8
22	G	21.9	Very low	23.9	Very low	77 Å²	77	159.5 Å²	159.5	79%	0.794	86%	0.856	S	S	*	*			trans	120.7	100.9	140.4	0	0	0	0	0	116.1
23	S	23.6	Very low	23.8	Very low	123 Å²	123	163 Å²	163	86%	0.86	86%	0.858	S	S	*	*			trans	-56.8	132.1	173.5	50.7	0	0	0	0	115.4
24	V	22.8	Very low	23.7	Very low	150 Å²	150	163.9 Å²	163.9	91%	0.909	86%	0.859	S	S	*	*			trans	-142.6	137.6	147	-177.2	0	0	0	0	109.6
25	Q	24.9	Very low	23.8	Very low	192 Å²	192	169.2 Å²	169.2	90%	0.897	86%	0.862	S	S	*	*			trans	-87.7	123.4	-165.1	-165.7	167.7	7.7	0	0	110.7
26	E	22.8	Very low	24.2	Very low	193 Å²	193	168.3 Å²	168.3	90%	0.902	86%	0.858	S	S	*	*			trans	-123.9	127.7	171.9	-126.1	176.1	-166.6	0	0	110.6	R28	E26-R28 PolarHBondContact O-N 2.87Å
27	S	22.1	Very low	24.8	Very low	118 Å²	118	161.9 Å²	161.9	83%	0.825	84%	0.838	S	S	*	*	P	Polyproline II helix	trans	-67.8	120.8	-165.8	55.6	0	0	0	0	113.7
28	R	23.3	Very low	25.6	Very low	243 Å²	243	156 Å²	156	92%	0.917	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-71.1	124.6	163.4	-82	-177.6	178.9	177.9	-0.4	110.8	E26	E26-R28 PolarHBondContact O-N 2.87Å
29	M	22	Very low	26.6	Very low	178 Å²	178	152.4 Å²	152.4	88%	0.877	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-62.1	139.7	156.4	-84.4	-90.1	159.4	0	0	109.9
30	P	23.9	Very low	27.4	Very low	117 Å²	117	149.4 Å²	149.4	76%	0.76	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-78.3	136.1	-170.7	28.3	-30.7	0	0	0	112.9
31	E	23.8	Very low	28.7	Very low	173 Å²	173	141.5 Å²	141.5	81%	0.808	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-53.1	140.7	167.5	-67.2	176.4	159.1	0	0	111.2	R33	E31-R33 PolarHBondContact O-N 3.37Å
32	P	25.1	Very low	29.8	Very low	128 Å²	128	135.2 Å²	135.2	83%	0.831	74%	0.735	S	S	*	*			trans	-68.9	109.8	173.5	27.4	-29.6	0	0	0	108.6	S34	P32-S34 PolarHBondContact O-N 2.8Å
33	R	23.4	Very low	30.9	Very low	242 Å²	242	135.9 Å²	135.9	91%	0.913	73%	0.727	S	S	*	*			trans	-48.5	107.6	171.8	-72.1	178.2	173.5	174.9	-2.6	109.7	E31 R35	E31-R33 PolarHBondContact O-N 3.37Å; R33-R35 PolarHBondContact O-N 3.26Å
34	S	28.6	Very low	32.5	Very low	108 Å²	108	133.6 Å²	133.6	76%	0.755	70%	0.7	S	S	*	*			trans	-57.6	108.3	163.3	46.6	0	0	0	0	107.8	P32 Q36	P32-S34 PolarHBondContact O-N 2.8Å; S34-Q36 PolarHBondContact O-N 3.32Å
35	R	28.9	Very low	34.2	Very low	240 Å²	240	128 Å²	128	91%	0.906	67%	0.667	S	S	*	*			trans	-62.5	110.7	161	-75.2	-175.5	176.8	-179.2	-0.7	105.5	R33	R33-R35 PolarHBondContact O-N 3.26Å
36	Q	31.3	Very low	35.9	Very low	176 Å²	176	120.7 Å²	120.7	82%	0.822	63%	0.634	S	S	*	*	P	Polyproline II helix	trans	-49	142.8	168.8	-75.4	-174	-21.3	0	0	108.9	S34 S38	S34-Q36 PolarHBondContact O-N 3.32Å; Q36-S38 PolarHBondContact O-N 3.27Å
37	P	36.6	Very low	37.4	Very low	73 Å²	73	114 Å²	114	47%	0.474	61%	0.607	S	S	.	*	P	Polyproline II helix	trans	-53.9	137	173.1	23.2	-31.3	0	0	0	108.3	S39	P37-S39 PolarHBondContact O-N 3.14Å
38	S	41.3	Very low	39.4	Very low	69 Å²	69	110.5 Å²	110.5	48%	0.483	59%	0.59	S	S	.	*	P	Polyproline II helix	trans	-52.2	134.2	168.3	50.5	0	0	0	0	107.7	Q36 C40 L41	Q36-S38 PolarHBondContact O-N 3.27Å; S38-C40 PolarHBondContact O-N 3.46Å; S38-L41 PolarHBondContact O-N 3.24Å; S38-L41 WeakPolarHBondContact OG-CD1 3.46Å
39	S	42.3	Very low	41.8	Very low	106 Å²	106	99.6 Å²	99.6	74%	0.741	55%	0.549	S	S	*	.	H	α-helix	trans	-51.3	-25.5	-175.5	60.6	0	0	0	0	113.2	P37 S43	P37-S39 PolarHBondContact O-N 3.14Å; S39-S43 PolarHBondContact O-N 3.49Å; S39-S43 VanDerWaalsContact O-N 3.14Å
40	C	41	Very low	44.6	Very low	67 Å²	67	97.2 Å²	97.2	45%	0.453	54%	0.536	S	S	.	.	H	α-helix	trans	-72.8	-22.8	178.1	-146.9	0	0	0	0	115	S38 S43 R44	S38-C40 PolarHBondContact O-N 3.46Å; C40-S43 PolarHBondContact O-OG 3.32Å; C40-S43 VanDerWaalsContact O-OG 3.12Å; C40-R44 WeakPolarHBondContact O-CD 3.07Å; C40-R44 WeakPolarHBondContact O-CG 3.36Å; C40-R44 PolarHBondContact O-NE 3.41Å; C40-R44 VanDerWaalsContact O-NE 3.11Å
41	L	50.5	Low	47.6	Very low	14 Å²	14	93.9 Å²	93.9	7%	0.073	51%	0.512	C	S	.	.	H	α-helix	trans	-84.4	-36.7	172.5	-74.6	169.3	0	0	0	111.3	S38 R44 I51 W54 I71	S38-L41 PolarHBondContact O-N 3.24Å; S38-L41 WeakPolarHBondContact OG-CD1 3.46Å; L41-R44 PolarHBondContact O-N 3.2Å; L41-I51 HydrophobicContact CB-CD1 4.18Å; L41-W54 HydrophobicContact CD1-CD2 4.32Å; L41-W54 HydrophobicContact CD1-CE3 4.32Å; L41-W54 HydrophobicContact CD1-CZ3 4.48Å; L41-I71 HydrophobicContact CD2-CD1 3.84Å
42	A	46.2	Very low	50.6	Low	53 Å²	53	89.5 Å²	89.5	44%	0.438	49%	0.493	S	S	.	.	H	α-helix	trans	-70.6	-30.3	178.3	0	0	0	0	0	112.8	R44	A42-R44 PolarHBondContact O-N 3.26Å; A42-R44 VanDerWaalsContact O-N 3.12Å
43	S	44.6	Very low	53.7	Low	90 Å²	90	83.9 Å²	83.9	63%	0.629	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68	-4.6	176	65.2	0	0	0	0	114.6	S39 C40	S39-S43 PolarHBondContact O-N 3.49Å; S39-S43 VanDerWaalsContact O-N 3.14Å; C40-S43 PolarHBondContact O-OG 3.32Å; C40-S43 VanDerWaalsContact O-OG 3.12Å
44	R	56.4	Low	56.9	Low	75 Å²	75	77.7 Å²	77.7	28%	0.283	44%	0.435	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.6	-4.3	-174.6	-61.1	178.2	-177.5	160.8	6.5	114	C40 L41 A42	C40-R44 WeakPolarHBondContact O-CD 3.07Å; C40-R44 WeakPolarHBondContact O-CG 3.36Å; C40-R44 PolarHBondContact O-NE 3.41Å; C40-R44 VanDerWaalsContact O-NE 3.11Å; L41-R44 PolarHBondContact O-N 3.2Å; A42-R44 PolarHBondContact O-N 3.26Å; A42-R44 VanDerWaalsContact O-N 3.12Å
45	C	58.9	Low	59.6	Low	33 Å²	33	72.6 Å²	72.6	22%	0.223	40%	0.399	C	S	.	.	S	Bend	trans	-83.8	140.3	179.3	-67.7	0	0	0	0	110.4	E49 I51	C45-E49 WeakPolarHBondContact CA-OE2 3.39Å; C45-E49 HydrophobicContact CB-CB 4.04Å; C45-E49 HydrophobicContact CB-CG 4.17Å; C45-I51 WeakPolarHBondContact SG-CG1 3.28Å
46	L	61.2	Low	62.2	Low	39 Å²	39	63.2 Å²	63.2	20%	0.204	37%	0.369	C	S	.	.	P	Polyproline II helix	trans	-58.5	150.7	166.9	-57.3	-179.9	0	0	0	109.5	G48 E49 L92	L46-G48 PolarHBondContact O-N 3.1Å; L46-G48 VanDerWaalsContact O-N 3.16Å; L46-E49 HydrophobicContact CB-CB 3.95Å; L46-E49 WeakPolarHBondContact CG-OE2 3.44Å; L46-E49 PolarHBondContact N-OE2 3.22Å; L46-E49 WeakPolarHBondContact O-CA 3.34Å; L46-E49 WeakPolarHBondContact O-CB 3.48Å; L46-E49 PolarHBondContact O-N 2.81Å; L46-L92 HydrophobicContact CD1-CD2 3.95Å; L46-L92 HydrophobicContact CD2-CD2 3.2Å; L46-L92 HydrophobicContact CG-CD2 4.22Å
47	P	53.3	Low	63.9	Low	52 Å²	52	56.6 Å²	56.6	34%	0.338	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	126.2	177.5	-21.6	32.3	0	0	0	111	E49 S180	P47-E49 VanDerWaalsContact C-N 3.3Å; P47-S180 WeakPolarHBondContact CB-OG 3.38Å
48	G	64.4	Low	65.7	Low	45 Å²	45	53.1 Å²	53.1	46%	0.464	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.5	-11.4	-171.5	0	0	0	0	0	114.7	L46 N74 F75	L46-G48 PolarHBondContact O-N 3.1Å; L46-G48 VanDerWaalsContact O-N 3.16Å; G48-N74 PolarHBondContact O-ND2 2.98Å; G48-F75 WeakPolarHBondContact O-CE2 3.44Å
49	E	74.3	Confident	67.3	Low	13 Å²	13	53.7 Å²	53.7	6%	0.061	32%	0.317	C	S	.	.			trans	-75.7	129.8	168.8	-176.2	175.7	-150.7	0	0	109.9	C45 L46 P47 T73 N74 F75 R76	C45-E49 WeakPolarHBondContact CA-OE2 3.39Å; C45-E49 HydrophobicContact CB-CB 4.04Å; C45-E49 HydrophobicContact CB-CG 4.17Å; L46-E49 HydrophobicContact CB-CB 3.95Å; L46-E49 WeakPolarHBondContact CG-OE2 3.44Å; L46-E49 PolarHBondContact N-OE2 3.22Å; L46-E49 WeakPolarHBondContact O-CA 3.34Å; L46-E49 WeakPolarHBondContact O-CB 3.48Å; L46-E49 PolarHBondContact O-N 2.81Å; P47-E49 VanDerWaalsContact C-N 3.3Å; E49-T73 VanDerWaalsContact CG-CB 3.48Å; E49-T73 HydrophobicContact CG-CG2 3.74Å; E49-T73 WeakPolarHBondContact CG-OG1 3.44Å; E49-T73 VanDerWaalsContact OE1-CB 3.31Å; E49-T73 WeakPolarHBondContact OE1-CB 3.33Å; E49-T73 VanDerWaalsContact OE1-CG2 3.22Å; E49-T73 WeakPolarHBondContact OE1-CG2 3.46Å; E49-T73 PolarHBondContact OE1-OG1 3.22Å; E49-N74 WeakPolarHBondContact CA-OD1 3.41Å; E49-F75 HydrophobicContact CB-CD2 3.79Å; E49-F75 HydrophobicContact CB-CE2 4.31Å; E49-F75 HydrophobicContact CG-CD2 4Å; E49-R76 WeakPolarHBondContact OE1-CG 3.39Å; E49-R76 IonicContact OE1-CZ 3.6Å; E49-R76 IonicContact OE1-NE 3.56Å; E49-R76 PolarHBondContact OE1-NE 3.47Å; E49-R76 IonicContact OE1-NH2 3.13Å; E49-R76 IonicContact OE2-CZ 2.65Å; E49-R76 IonicContact OE2-NE 2.77Å; E49-R76 IonicContact OE2-NH2 2.9Å; E49-R76 PolarHBondContact OE2-NH2 2.95Å
50	Q	80.5	Confident	68.7	Low	128 Å²	128	51 Å²	51	60%	0.598	29%	0.292	S	S	*	.			trans	-122.7	131.4	-178.8	-63.4	-177.6	9	0	0	109.1	L52 T73 N74	Q50-L52 PolarHBondContact O-N 3.32Å; Q50-T73 CarbonylContact O-C 3.57Å; Q50-T73 WeakPolarHBondContact O-CA 3.49Å; Q50-T73 VanDerWaalsContact O-CB 3.29Å; Q50-T73 WeakPolarHBondContact O-CB 3.46Å; Q50-N74 PolarHBondContact N-OD1 2.85Å; Q50-N74 PolarHBondContact O-N 3.36Å; Q50-N74 VanDerWaalsContact O-N 3.09Å; Q50-N74 PolarHBondContact O-OD1 3.29Å
51	I	86.4	Confident	69.7	Low	48 Å²	48	48.9 Å²	48.9	25%	0.246	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	120.7	173.5	-57.6	178	0	0	0	108.3	L41 C45 I71 T73	L41-I51 HydrophobicContact CB-CD1 4.18Å; C45-I51 WeakPolarHBondContact SG-CG1 3.28Å; I51-I71 HydrophobicContact CD1-CG2 4.39Å; I51-I71 HydrophobicContact CG1-CG2 4.19Å; I51-I71 HydrophobicContact CG2-CG2 3.93Å; I51-T73 HydrophobicContact CG1-CG2 4.43Å
52	L	88.1	Confident	69.7	Low	80 Å²	80	53.2 Å²	53.2	42%	0.419	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	-40.5	176.9	-59.4	178.8	0	0	0	111.1	Q50 C72 N74 A160 A164	Q50-L52 PolarHBondContact O-N 3.32Å; L52-C72 PolarHBondContact N-O 2.85Å; L52-N74 HydrophobicContact CD1-CB 4.33Å; L52-A160 HydrophobicContact CB-CB 4.29Å; L52-A164 HydrophobicContact CD1-CB 3.64Å
53	A	90.3	Very high	69.7	Low	11 Å²	11	58.5 Å²	58.5	9%	0.091	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.4	159.4	176.9	0	0	0	0	0	110.9	C72 V157 A160	A53-C72 PolarHBondContact N-O 3.37Å; A53-C72 PolarHBondContact O-N 2.81Å; A53-V157 HydrophobicContact CB-CB 4.38Å; A53-V157 HydrophobicContact CB-CG2 3.81Å; A53-A160 HydrophobicContact CB-CB 3.51Å
54	W	88.8	Confident	70.1	Confident	112 Å²	112	58.9 Å²	58.9	42%	0.424	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	152.4	174.8	63.8	-75.6	0	0	0	111.6	L41 P56 T69 L70 I71	L41-W54 HydrophobicContact CD1-CD2 4.32Å; L41-W54 HydrophobicContact CD1-CE3 4.32Å; L41-W54 HydrophobicContact CD1-CZ3 4.48Å; W54-P56 HydrophobicContact CE3-CB 4.18Å; W54-P56 HydrophobicContact CE3-CG 4.02Å; W54-P56 HydrophobicContact CH2-CG 4.18Å; W54-P56 HydrophobicContact CZ3-CB 3.7Å; W54-P56 HydrophobicContact CZ3-CG 3.44Å; W54-P56 VanDerWaalsContact CZ3-CG 3.44Å; W54-T69 HydrophobicContact CE3-CG2 3.93Å; W54-L70 CarbonylContact C-O 3.57Å; W54-L70 WeakPolarHBondContact CA-O 3.34Å; W54-I71 HydrophobicContact CB-CG1 4.15Å
55	A	86.4	Confident	70.5	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	111.1	177.6	0	0	0	0	0	109.4	V58 T69 L70 F145 Q153 V157	A55-V58 HydrophobicContact CB-CG1 3.96Å; A55-T69 CarbonylContact O-C 3.59Å; A55-T69 WeakPolarHBondContact O-CA 3.38Å; A55-L70 PolarHBondContact N-O 3.01Å; A55-L70 PolarHBondContact O-N 3.15Å; A55-F145 HydrophobicContact CB-CD1 4.48Å; A55-F145 HydrophobicContact CB-CE1 3.88Å; A55-Q153 HydrophobicContact CB-CB 4.03Å; A55-V157 HydrophobicContact CB-CG2 3.78Å
56	P	83.1	Confident	71.1	Confident	44 Å²	44	62.3 Å²	62.3	29%	0.286	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	161.6	174.9	33.5	-32.3	0	0	0	111.9	W54 V58 L150	W54-P56 HydrophobicContact CE3-CB 4.18Å; W54-P56 HydrophobicContact CE3-CG 4.02Å; W54-P56 HydrophobicContact CH2-CG 4.18Å; W54-P56 HydrophobicContact CZ3-CB 3.7Å; W54-P56 HydrophobicContact CZ3-CG 3.44Å; W54-P56 VanDerWaalsContact CZ3-CG 3.44Å; P56-V58 PolarHBondContact O-N 3.42Å; P56-L150 WeakPolarHBondContact O-CD1 3.06Å; P56-L150 WeakPolarHBondContact O-CD2 3.35Å
57	G	67	Low	71.9	Confident	37 Å²	37	62.8 Å²	62.8	38%	0.381	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	70.8	21.4	174.1	0	0	0	0	0	113.7	G68	G57-G68 PolarHBondContact N-O 3.24Å
58	V	75.5	Confident	73.3	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	147.7	176.3	-72.8	0	0	0	0	110.5	A55 P56 S67 G68 L70 F79 V143 F145	A55-V58 HydrophobicContact CB-CG1 3.96Å; P56-V58 PolarHBondContact O-N 3.42Å; V58-S67 CarbonylContact O-C 3.58Å; V58-S67 WeakPolarHBondContact O-CA 3.2Å; V58-G68 VanDerWaalsContact CG2-O 3.23Å; V58-G68 WeakPolarHBondContact CG2-O 3.27Å; V58-G68 PolarHBondContact N-O 3.45Å; V58-G68 PolarHBondContact O-N 3.46Å; V58-L70 HydrophobicContact CG1-CB 4.41Å; V58-L70 HydrophobicContact CG2-CB 3.89Å; V58-F79 HydrophobicContact CB-CE2 4.38Å; V58-F79 HydrophobicContact CG2-CD2 3.91Å; V58-F79 HydrophobicContact CG2-CE2 3.51Å; V58-V143 HydrophobicContact CB-CG1 3.55Å; V58-V143 HydrophobicContact CG1-CG1 3.94Å; V58-V143 HydrophobicContact CG2-CG1 4.05Å; V58-F145 HydrophobicContact CG1-CD1 3.56Å; V58-F145 HydrophobicContact CG1-CE1 3.55Å; V58-F145 HydrophobicContact CG1-CZ 4.49Å
59	R	73.8	Confident	74.3	Confident	80 Å²	80	59.5 Å²	59.5	30%	0.302	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	132.2	175.7	-66.2	-168.4	-177.4	-177.8	11.1	110.8	E65 L66 V143 G144 E146	R59-E65 IonicContact CZ-OE2 3.03Å; R59-E65 IonicContact NH1-OE2 3.99Å; R59-E65 PolarHBondContact NH1-OE2 3.43Å; R59-L66 WeakPolarHBondContact CA-O 3.35Å; R59-V143 CarbonylContact O-C 3.59Å; R59-V143 WeakPolarHBondContact O-CA 3.48Å; R59-G144 PolarHBondContact N-O 3.03Å; R59-G144 PolarHBondContact O-N 3.03Å; R59-E146 HydrophobicContact CG-CG 4.18Å; R59-E146 IonicContact CZ-OE1 2.64Å; R59-E146 IonicContact CZ-OE2 3.71Å; R59-E146 IonicContact NE-OE1 2.65Å; R59-E146 PolarHBondContact NE-OE1 3.26Å; R59-E146 VanDerWaalsContact NE-OE1 3.11Å; R59-E146 IonicContact NE-OE2 3.56Å; R59-E146 PolarHBondContact NE-OE2 3.16Å; R59-E146 IonicContact NH1-OE1 3.52Å; R59-E146 PolarHBondContact NH1-OE1 3Å; R59-E146 IonicContact NH2-OE1 3.07Å; R59-E146 PolarHBondContact NH2-OE1 3.47Å; R59-E146 IonicContact NH2-OE2 2.69Å; R59-E146 PolarHBondContact NH2-OE2 3.22Å
60	K	71.9	Confident	75	Confident	51 Å²	51	58.9 Å²	58.9	22%	0.222	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	122.7	164.3	-178.8	-173.1	171.6	-164.9	0	108.5	E65 L66 F79 Y96 L141 R142	K60-E65 WeakPolarHBondContact O-CA 3.45Å; K60-L66 HydrophobicContact CB-CB 4.45Å; K60-L66 PolarHBondContact N-O 3.47Å; K60-L66 PolarHBondContact O-N 3.34Å; K60-F79 HydrophobicContact CB-CE1 3.93Å; K60-F79 HydrophobicContact CB-CE2 4.22Å; K60-F79 HydrophobicContact CB-CZ 3.78Å; K60-Y96 HydrophobicContact CD-CD1 4.09Å; K60-Y96 HydrophobicContact CD-CE1 3.61Å; K60-Y96 VanDerWaalsContact NZ-CE1 3.26Å; K60-L141 HydrophobicContact CD-CD1 4.3Å; K60-L141 HydrophobicContact CG-CD1 4.23Å; K60-R142 WeakPolarHBondContact CA-O 3.38Å
61	G	61.4	Low	75.4	Confident	22 Å²	22	53.2 Å²	53.2	23%	0.227	29%	0.285	C	S	.	.			trans	-101.8	173.1	170	0	0	0	0	0	111.9	R142	G61-R142 PolarHBondContact N-O 3.29Å
62	L	51.8	Low	75.6	Confident	104 Å²	104	51 Å²	51	55%	0.545	27%	0.273	S	S	.	.	S	Bend	cis	-74.6	174.7	-32.8	-114.1	110.6	0	0	0	110.2
63	E	45.9	Very low	75.6	Confident	164 Å²	164	47.2 Å²	47.2	77%	0.766	25%	0.254	S	S	*	.	S	Bend	trans	-27.5	136.1	-170.1	-67.2	-167.9	161.6	0	0	118.3
64	P	52.8	Low	75.3	Confident	98 Å²	98	49.1 Å²	49.1	64%	0.636	26%	0.262	S	S	*	.	S	Bend	cis	-76.4	138.4	-8	29.4	-31.6	0	0	0	111.4	L66	P64-L66 PolarHBondContact O-N 2.91Å
65	E	64.3	Low	74.7	Confident	126 Å²	126	44.8 Å²	44.8	59%	0.589	25%	0.246	S	C	*	.			trans	-62.9	105.4	171.1	-73.5	-172.2	-177.7	0	0	109.6	R59 K60	R59-E65 IonicContact CZ-OE2 3.03Å; R59-E65 IonicContact NH1-OE2 3.99Å; R59-E65 PolarHBondContact NH1-OE2 3.43Å; K60-E65 WeakPolarHBondContact O-CA 3.45Å
66	L	71.5	Confident	74.7	Confident	54 Å²	54	46.4 Å²	46.4	28%	0.283	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	117.9	175.7	-67	170.2	0	0	0	108.1	R59 K60 P64 F79 Y96	R59-L66 WeakPolarHBondContact CA-O 3.35Å; K60-L66 HydrophobicContact CB-CB 4.45Å; K60-L66 PolarHBondContact N-O 3.47Å; K60-L66 PolarHBondContact O-N 3.34Å; P64-L66 PolarHBondContact O-N 2.91Å; L66-F79 HydrophobicContact CB-CE1 4.39Å; L66-F79 VanDerWaalsContact O-CZ 3.31Å; L66-F79 WeakPolarHBondContact O-CZ 3.35Å; L66-Y96 HydrophobicContact CD1-CE1 4.42Å; L66-Y96 WeakPolarHBondContact CD1-OH 3.45Å
67	S	78.2	Confident	74.9	Confident	50 Å²	50	44.3 Å²	44.3	35%	0.35	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	144.2	167.2	-61.5	0	0	0	0	109.7	V58 P81 C82	V58-S67 CarbonylContact O-C 3.58Å; V58-S67 WeakPolarHBondContact O-CA 3.2Å; S67-P81 CarbonylContact O-C 3.49Å; S67-P81 WeakPolarHBondContact O-CA 3.36Å; S67-C82 WeakPolarHBondContact O-CB 3.02Å; S67-C82 PolarHBondContact O-N 3.32Å; S67-C82 PolarHBondContact O-SG 2.91Å; S67-C82 VanDerWaalsContact O-SG 3.41Å
68	G	83.9	Confident	75.9	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-167.4	-165.9	-175.1	0	0	0	0	0	114.6	G57 V58 Q80	G57-G68 PolarHBondContact N-O 3.24Å; V58-G68 VanDerWaalsContact CG2-O 3.23Å; V58-G68 WeakPolarHBondContact CG2-O 3.27Å; V58-G68 PolarHBondContact N-O 3.45Å; V58-G68 PolarHBondContact O-N 3.46Å; G68-Q80 CarbonylContact C-O 3.47Å; G68-Q80 WeakPolarHBondContact CA-O 3.36Å
69	T	85.3	Confident	76.3	Confident	27 Å²	27	43.8 Å²	43.8	17%	0.166	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	126.1	173.1	-57.1	0	0	0	0	109.4	W54 A55 I71 Q80	W54-T69 HydrophobicContact CE3-CG2 3.93Å; A55-T69 CarbonylContact O-C 3.59Å; A55-T69 WeakPolarHBondContact O-CA 3.38Å; T69-I71 HydrophobicContact CG2-CD1 4.36Å; T69-I71 HydrophobicContact CG2-CG1 3.89Å; T69-Q80 PolarHBondContact N-O 2.79Å; T69-Q80 PolarHBondContact O-N 3.1Å
70	L	88.8	Confident	76.6	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	128.9	171.4	-175.9	68.1	0	0	0	109.1	W54 A55 V58 V77 F79 I131 L141 V143 F145 V157	W54-L70 CarbonylContact C-O 3.57Å; W54-L70 WeakPolarHBondContact CA-O 3.34Å; A55-L70 PolarHBondContact N-O 3.01Å; A55-L70 PolarHBondContact O-N 3.15Å; V58-L70 HydrophobicContact CG1-CB 4.41Å; V58-L70 HydrophobicContact CG2-CB 3.89Å; L70-V77 HydrophobicContact CD1-CG1 3.61Å; L70-V77 HydrophobicContact CG-CG1 4.36Å; L70-F79 HydrophobicContact CD1-CB 4.31Å; L70-I131 HydrophobicContact CD2-CD1 3.55Å; L70-L141 HydrophobicContact CD1-CD2 4.44Å; L70-V143 HydrophobicContact CD1-CG2 4.35Å; L70-V143 HydrophobicContact CD2-CG1 4.29Å; L70-F145 HydrophobicContact CD2-CZ 4.26Å; L70-V157 HydrophobicContact CD2-CG1 3.65Å; L70-V157 HydrophobicContact CG-CG1 4.08Å
71	I	88.8	Confident	76.9	Confident	10 Å²	10	39.3 Å²	39.3	5%	0.051	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	128.6	-178.6	-54	171.9	0	0	0	108.4	L41 I51 W54 T69 T73 V77 T78	L41-I71 HydrophobicContact CD2-CD1 3.84Å; I51-I71 HydrophobicContact CD1-CG2 4.39Å; I51-I71 HydrophobicContact CG1-CG2 4.19Å; I51-I71 HydrophobicContact CG2-CG2 3.93Å; W54-I71 HydrophobicContact CB-CG1 4.15Å; T69-I71 HydrophobicContact CG2-CD1 4.36Å; T69-I71 HydrophobicContact CG2-CG1 3.89Å; I71-T73 HydrophobicContact CG2-CG2 4.08Å; I71-V77 WeakPolarHBondContact O-CA 3.28Å; I71-T78 HydrophobicContact CB-CG2 3.78Å; I71-T78 HydrophobicContact CD1-CG2 4.42Å; I71-T78 HydrophobicContact CG1-CG2 4.5Å; I71-T78 HydrophobicContact CG2-CG2 4.46Å; I71-T78 PolarHBondContact N-O 3.09Å; I71-T78 PolarHBondContact O-N 3.23Å
72	C	90.6	Very high	77.3	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	124.6	170	-176.4	0	0	0	0	109.1	L52 A53 V157 A160 I161	L52-C72 PolarHBondContact N-O 2.85Å; A53-C72 PolarHBondContact N-O 3.37Å; A53-C72 PolarHBondContact O-N 2.81Å; C72-V157 HydrophobicContact CB-CG1 4.39Å; C72-A160 HydrophobicContact CB-CB 4.39Å; C72-I161 HydrophobicContact CB-CG1 3.86Å; C72-I161 VanDerWaalsContact SG-CG1 3.55Å
73	T	88.1	Confident	77.6	Confident	2 Å²	2	41.4 Å²	41.4	1%	0.012	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	176.9	172.6	74.4	0	0	0	0	110.5	E49 Q50 I51 I71 F75 R76	E49-T73 VanDerWaalsContact CG-CB 3.48Å; E49-T73 HydrophobicContact CG-CG2 3.74Å; E49-T73 WeakPolarHBondContact CG-OG1 3.44Å; E49-T73 VanDerWaalsContact OE1-CB 3.31Å; E49-T73 WeakPolarHBondContact OE1-CB 3.33Å; E49-T73 VanDerWaalsContact OE1-CG2 3.22Å; E49-T73 WeakPolarHBondContact OE1-CG2 3.46Å; E49-T73 PolarHBondContact OE1-OG1 3.22Å; Q50-T73 CarbonylContact O-C 3.57Å; Q50-T73 WeakPolarHBondContact O-CA 3.49Å; Q50-T73 VanDerWaalsContact O-CB 3.29Å; Q50-T73 WeakPolarHBondContact O-CB 3.46Å; I51-T73 HydrophobicContact CG1-CG2 4.43Å; I71-T73 HydrophobicContact CG2-CG2 4.08Å; T73-F75 PolarHBondContact O-N 3.49Å; T73-F75 PolarHBondContact OG1-N 3.22Å; T73-F75 VanDerWaalsContact OG1-N 3.14Å; T73-R76 PolarHBondContact N-O 2.92Å; T73-R76 PolarHBondContact OG1-N 3.2Å; T73-R76 PolarHBondContact OG1-O 3.35Å; T73-R76 VanDerWaalsContact OG1-O 3.11Å
74	N	82.9	Confident	77.9	Confident	50 Å²	50	39.1 Å²	39.1	27%	0.267	23%	0.228	S	C	.	.	S	Bend	trans	-69.2	-2.7	169.7	62.4	-28.1	0	0	0	114	G48 E49 Q50 L52 L100	G48-N74 PolarHBondContact O-ND2 2.98Å; E49-N74 WeakPolarHBondContact CA-OD1 3.41Å; Q50-N74 PolarHBondContact N-OD1 2.85Å; Q50-N74 PolarHBondContact O-N 3.36Å; Q50-N74 VanDerWaalsContact O-N 3.09Å; Q50-N74 PolarHBondContact O-OD1 3.29Å; L52-N74 HydrophobicContact CD1-CB 4.33Å; N74-L100 WeakPolarHBondContact O-CD1 3.08Å
75	F	77.4	Confident	77.8	Confident	21 Å²	21	43.1 Å²	43.1	9%	0.092	24%	0.238	C	C	.	.	S	Bend	trans	-121.7	-39.7	-178.5	-76.2	-77.2	0	0	0	114.7	G48 E49 T73 L100 Q173 I177	G48-F75 WeakPolarHBondContact O-CE2 3.44Å; E49-F75 HydrophobicContact CB-CD2 3.79Å; E49-F75 HydrophobicContact CB-CE2 4.31Å; E49-F75 HydrophobicContact CG-CD2 4Å; T73-F75 PolarHBondContact O-N 3.49Å; T73-F75 PolarHBondContact OG1-N 3.22Å; T73-F75 VanDerWaalsContact OG1-N 3.14Å; F75-L100 WeakPolarHBondContact O-CG 3.14Å; F75-L100 PolarHBondContact O-N 2.97Å; F75-Q173 HydrophobicContact CD1-CB 4.05Å; F75-Q173 HydrophobicContact CD1-CG 3.89Å; F75-Q173 HydrophobicContact CE1-CB 3.54Å; F75-Q173 HydrophobicContact CE1-CG 3.7Å; F75-Q173 WeakPolarHBondContact CE1-O 3.33Å; F75-Q173 WeakPolarHBondContact CZ-O 3.49Å; F75-I177 HydrophobicContact CD1-CD1 4.22Å; F75-I177 HydrophobicContact CE1-CD1 3.93Å; F75-I177 HydrophobicContact CE1-CG1 4.19Å; F75-I177 HydrophobicContact CZ-CG1 4.31Å
76	R	85.3	Confident	77	Confident	35 Å²	35	41.8 Å²	41.8	13%	0.132	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	166.5	-173.1	57	174.1	170.5	179.9	-3.5	111.9	E49 T73 D97 F98	E49-R76 WeakPolarHBondContact OE1-CG 3.39Å; E49-R76 IonicContact OE1-CZ 3.6Å; E49-R76 IonicContact OE1-NE 3.56Å; E49-R76 PolarHBondContact OE1-NE 3.47Å; E49-R76 IonicContact OE1-NH2 3.13Å; E49-R76 IonicContact OE2-CZ 2.65Å; E49-R76 IonicContact OE2-NE 2.77Å; E49-R76 IonicContact OE2-NH2 2.9Å; E49-R76 PolarHBondContact OE2-NH2 2.95Å; T73-R76 PolarHBondContact N-O 2.92Å; T73-R76 PolarHBondContact OG1-N 3.2Å; T73-R76 PolarHBondContact OG1-O 3.35Å; T73-R76 VanDerWaalsContact OG1-O 3.11Å; R76-D97 IonicContact CZ-OD2 3.5Å; R76-D97 IonicContact NH1-OD2 3.66Å; R76-D97 PolarHBondContact NH1-OD2 2.98Å; R76-F98 CarbonylContact C-O 3.48Å; R76-F98 WeakPolarHBondContact CA-O 3.29Å; R76-F98 VanDerWaalsContact CB-O 3.29Å; R76-F98 WeakPolarHBondContact CB-O 3.37Å
77	V	88.6	Confident	75.8	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	127.2	162.3	-175.6	0	0	0	0	106.8	L70 I71 F98 L100 I103 I133 I161	L70-V77 HydrophobicContact CD1-CG1 3.61Å; L70-V77 HydrophobicContact CG-CG1 4.36Å; I71-V77 WeakPolarHBondContact O-CA 3.28Å; V77-F98 PolarHBondContact N-O 2.79Å; V77-F98 PolarHBondContact O-N 3.15Å; V77-L100 HydrophobicContact CG2-CD2 4.01Å; V77-I103 HydrophobicContact CG2-CD1 3.87Å; V77-I133 HydrophobicContact CB-CD1 4.37Å; V77-I133 HydrophobicContact CG1-CD1 3.79Å; V77-I161 HydrophobicContact CG1-CD1 4.09Å; V77-I161 HydrophobicContact CG2-CD1 4.01Å; V77-I161 HydrophobicContact CG2-CG1 3.74Å; V77-I161 HydrophobicContact CG2-CG2 4.08Å
78	T	86.8	Confident	74.2	Confident	23 Å²	23	52.4 Å²	52.4	14%	0.141	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	136.7	179.1	-179.8	0	0	0	0	109.9	I71 D97	I71-T78 HydrophobicContact CB-CG2 3.78Å; I71-T78 HydrophobicContact CD1-CG2 4.42Å; I71-T78 HydrophobicContact CG1-CG2 4.5Å; I71-T78 HydrophobicContact CG2-CG2 4.46Å; I71-T78 PolarHBondContact N-O 3.09Å; I71-T78 PolarHBondContact O-N 3.23Å; T78-D97 WeakPolarHBondContact CB-OD1 3.43Å; T78-D97 PolarHBondContact OG1-OD1 3.37Å
79	F	83.9	Confident	72.3	Confident	2 Å²	2	58.9 Å²	58.9	1%	0.009	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	122.7	170.3	174.5	-87.7	0	0	0	109.3	V58 K60 L66 L70 P81 Y96 L141 V143	V58-F79 HydrophobicContact CB-CE2 4.38Å; V58-F79 HydrophobicContact CG2-CD2 3.91Å; V58-F79 HydrophobicContact CG2-CE2 3.51Å; K60-F79 HydrophobicContact CB-CE1 3.93Å; K60-F79 HydrophobicContact CB-CE2 4.22Å; K60-F79 HydrophobicContact CB-CZ 3.78Å; L66-F79 HydrophobicContact CB-CE1 4.39Å; L66-F79 VanDerWaalsContact O-CZ 3.31Å; L66-F79 WeakPolarHBondContact O-CZ 3.35Å; L70-F79 HydrophobicContact CD1-CB 4.31Å; F79-P81 HydrophobicContact CD1-CG 4.3Å; F79-P81 HydrophobicContact CE1-CB 4.44Å; F79-P81 HydrophobicContact CE1-CG 4.01Å; F79-Y96 HydrophobicContact CB-CD1 4.49Å; F79-Y96 AromaticContact CD1-CD1 3.69Å; F79-Y96 HydrophobicContact CD1-CD1 3.69Å; F79-Y96 HydrophobicContact CD1-CE1 4.16Å; F79-Y96 HydrophobicContact CD1-CG 4.25Å; F79-Y96 HydrophobicContact CE1-CD1 4.48Å; F79-Y96 PolarHBondContact N-O 3.29Å; F79-Y96 WeakPolarHBondContact O-CB 3.48Å; F79-L141 HydrophobicContact CB-CD1 4.12Å; F79-L141 HydrophobicContact CB-CD2 4Å; F79-L141 HydrophobicContact CG-CD1 4.4Å; F79-V143 HydrophobicContact CD2-CG2 4.38Å
80	Q	81.4	Confident	70.7	Confident	29 Å²	29	59.9 Å²	59.9	14%	0.136	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	112	-179.3	-176.7	170.6	8.8	0	0	111	G68 T69	G68-Q80 CarbonylContact C-O 3.47Å; G68-Q80 WeakPolarHBondContact CA-O 3.36Å; T69-Q80 PolarHBondContact N-O 2.79Å; T69-Q80 PolarHBondContact O-N 3.1Å
81	P	77.6	Confident	69.1	Low	8 Å²	8	61.1 Å²	61.1	5%	0.052	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62	148.4	175.5	-20.4	31.8	0	0	0	113.1	S67 F79 W84 Y96	S67-P81 CarbonylContact O-C 3.49Å; S67-P81 WeakPolarHBondContact O-CA 3.36Å; F79-P81 HydrophobicContact CD1-CG 4.3Å; F79-P81 HydrophobicContact CE1-CB 4.44Å; F79-P81 HydrophobicContact CE1-CG 4.01Å; P81-W84 HydrophobicContact CB-CG 4.42Å; P81-W84 HydrophobicContact CG-CG 4.41Å; P81-W84 PolarHBondContact O-N 3.4Å; P81-Y96 HydrophobicContact CG-CD2 4.41Å; P81-Y96 HydrophobicContact CG-CE1 4.44Å; P81-Y96 HydrophobicContact CG-CE2 4.06Å
82	C	68.9	Low	67.4	Low	91 Å²	91	62.3 Å²	62.3	62%	0.615	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	132.9	173.1	-71.6	0	0	0	0	110.5	S67	S67-C82 WeakPolarHBondContact O-CB 3.02Å; S67-C82 PolarHBondContact O-N 3.32Å; S67-C82 PolarHBondContact O-SG 2.91Å; S67-C82 VanDerWaalsContact O-SG 3.41Å
83	G	58.9	Low	65.7	Low	79 Å²	79	63.8 Å²	63.8	81%	0.814	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.5	-1.1	-178.7	0	0	0	0	0	115.2	Q85	G83-Q85 PolarHBondContact O-N 3.24Å
84	W	52.3	Low	64.4	Low	117 Å²	117	64.7 Å²	64.7	44%	0.443	35%	0.35	S	S	.	.			trans	-63.7	107.2	168.8	-105.1	48.3	0	0	0	110.8	P81 Y96	P81-W84 HydrophobicContact CB-CG 4.42Å; P81-W84 HydrophobicContact CG-CG 4.41Å; P81-W84 PolarHBondContact O-N 3.4Å; W84-Y96 HydrophobicContact CZ2-CD2 4.48Å; W84-Y96 HydrophobicContact CZ2-CE2 4.25Å
85	Q	50	Low	63.6	Low	181 Å²	181	69.6 Å²	69.6	85%	0.846	37%	0.372	S	S	*	.			trans	-86.7	117.5	165.1	-68.8	-95.1	-28.7	0	0	107.2	G83 N87	G83-Q85 PolarHBondContact O-N 3.24Å; Q85-N87 PolarHBondContact O-N 3.18Å
86	Q	48.8	Very low	63.4	Low	99 Å²	99	70 Å²	70	46%	0.463	37%	0.372	S	S	.	.			trans	-77.2	109.7	176	-162.2	174.7	9.8	0	0	107.5	T90	Q86-T90 VanDerWaalsContact CG-CB 3.46Å; Q86-T90 HydrophobicContact CG-CG2 3.9Å; Q86-T90 WeakPolarHBondContact CG-OG1 3.48Å
87	N	44.6	Very low	63.1	Low	123 Å²	123	69 Å²	69	66%	0.658	37%	0.37	S	S	*	.			trans	-61.5	146.8	163.5	-89.2	-9.4	0	0	0	108.1	Q85 D89 T90	Q85-N87 PolarHBondContact O-N 3.18Å; N87-D89 PolarHBondContact O-N 3.23Å; N87-T90 PolarHBondContact O-N 2.88Å; N87-T90 PolarHBondContact O-OG1 2.93Å
88	E	45.4	Very low	63	Low	204 Å²	204	69.2 Å²	69.2	95%	0.953	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-19.1	179.8	-66.6	-156.2	153.8	0	0	113.3	T90	E88-T90 VanDerWaalsContact C-N 3.35Å; E88-T90 PolarHBondContact O-N 3.46Å
89	D	43.7	Very low	63	Low	135 Å²	135	68.6 Å²	68.6	72%	0.722	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.5	34.1	176	-61.1	-39	0	0	0	114.7	N87 P91	N87-D89 PolarHBondContact O-N 3.23Å; D89-P91 VanDerWaalsContact O-CD 3.23Å; D89-P91 WeakPolarHBondContact O-CD 3.47Å
90	T	50.9	Low	63.1	Low	48 Å²	48	68.6 Å²	68.6	29%	0.294	37%	0.368	S	S	.	.			trans	-85.7	118.3	-173	-56.1	0	0	0	0	112.3	Q86 N87 E88	Q86-T90 VanDerWaalsContact CG-CB 3.46Å; Q86-T90 HydrophobicContact CG-CG2 3.9Å; Q86-T90 WeakPolarHBondContact CG-OG1 3.48Å; N87-T90 PolarHBondContact O-N 2.88Å; N87-T90 PolarHBondContact O-OG1 2.93Å; E88-T90 VanDerWaalsContact C-N 3.35Å; E88-T90 PolarHBondContact O-N 3.46Å
91	P	56.7	Low	63.1	Low	26 Å²	26	69.2 Å²	69.2	17%	0.169	37%	0.374	C	S	.	.			trans	-60.6	158.3	-178.2	17.9	-29.2	0	0	0	114.9	D89 S93 R521	D89-P91 VanDerWaalsContact O-CD 3.23Å; D89-P91 WeakPolarHBondContact O-CD 3.47Å; P91-S93 PolarHBondContact O-N 3.42Å; P91-S93 VanDerWaalsContact O-N 3.1Å; P91-R521 WeakPolarHBondContact CB-O 3.31Å
92	L	52.8	Low	63.6	Low	36 Å²	36	68.9 Å²	68.9	19%	0.188	37%	0.372	C	S	.	.	S	Bend	trans	-60.7	-15.6	174.5	-66.2	166.2	0	0	0	114.7	L46 K181 L520 R521	L46-L92 HydrophobicContact CD1-CD2 3.95Å; L46-L92 HydrophobicContact CD2-CD2 3.2Å; L46-L92 HydrophobicContact CG-CD2 4.22Å; L92-K181 VanDerWaalsContact CD2-NZ 3.31Å; L92-L520 HydrophobicContact CD1-CB 3.89Å; L92-L520 VanDerWaalsContact CD1-O 3.27Å; L92-L520 WeakPolarHBondContact CD1-O 3.2Å; L92-L520 WeakPolarHBondContact CG-O 3.46Å; L92-L520 PolarHBondContact N-O 2.95Å; L92-L520 VanDerWaalsContact N-O 3.17Å; L92-R521 HydrophobicContact CD1-CG 4.43Å
93	S	55.1	Low	64.5	Low	31 Å²	31	64.6 Å²	64.6	22%	0.217	34%	0.343	C	S	.	.			trans	-122.7	114.9	-176	-169.4	0	0	0	0	110.8	P91	P91-S93 PolarHBondContact O-N 3.42Å; P91-S93 VanDerWaalsContact O-N 3.1Å
94	S	60.8	Low	65.8	Low	20 Å²	20	62 Å²	62	14%	0.14	32%	0.316	C	S	.	.			trans	-103	153.8	164.6	-178.3	0	0	0	0	110.3	Y96 D97	S94-Y96 PolarHBondContact O-N 2.79Å; S94-Y96 WeakPolarHBondContact OG-CD2 3.33Å; S94-D97 PolarHBondContact N-OD2 3.15Å; S94-D97 WeakPolarHBondContact O-CB 3.43Å; S94-D97 PolarHBondContact O-N 2.88Å
95	E	65.2	Low	67.5	Low	154 Å²	154	61.1 Å²	61.1	72%	0.72	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	-24.2	172.9	-65	-173.7	148.4	0	0	112.4	R139	E95-R139 PolarHBondContact O-NH1 3.48Å
96	Y	73.1	Confident	69.5	Low	28 Å²	28	52.5 Å²	52.5	11%	0.11	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.8	0.7	-179.3	-55.8	-79.5	0	0	0	114.4	K60 L66 F79 P81 W84 S94	K60-Y96 HydrophobicContact CD-CD1 4.09Å; K60-Y96 HydrophobicContact CD-CE1 3.61Å; K60-Y96 VanDerWaalsContact NZ-CE1 3.26Å; L66-Y96 HydrophobicContact CD1-CE1 4.42Å; L66-Y96 WeakPolarHBondContact CD1-OH 3.45Å; F79-Y96 HydrophobicContact CB-CD1 4.49Å; F79-Y96 AromaticContact CD1-CD1 3.69Å; F79-Y96 HydrophobicContact CD1-CD1 3.69Å; F79-Y96 HydrophobicContact CD1-CE1 4.16Å; F79-Y96 HydrophobicContact CD1-CG 4.25Å; F79-Y96 HydrophobicContact CE1-CD1 4.48Å; F79-Y96 PolarHBondContact N-O 3.29Å; F79-Y96 WeakPolarHBondContact O-CB 3.48Å; P81-Y96 HydrophobicContact CG-CD2 4.41Å; P81-Y96 HydrophobicContact CG-CE1 4.44Å; P81-Y96 HydrophobicContact CG-CE2 4.06Å; W84-Y96 HydrophobicContact CZ2-CD2 4.48Å; W84-Y96 HydrophobicContact CZ2-CE2 4.25Å; S94-Y96 PolarHBondContact O-N 2.79Å; S94-Y96 WeakPolarHBondContact OG-CD2 3.33Å
97	D	80.4	Confident	71.5	Confident	16 Å²	16	48 Å²	48	9%	0.086	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	127.6	-176.9	-69.8	-5.8	0	0	0	112.3	R76 T78 S94 R139	R76-D97 IonicContact CZ-OD2 3.5Å; R76-D97 IonicContact NH1-OD2 3.66Å; R76-D97 PolarHBondContact NH1-OD2 2.98Å; T78-D97 WeakPolarHBondContact CB-OD1 3.43Å; T78-D97 PolarHBondContact OG1-OD1 3.37Å; S94-D97 PolarHBondContact N-OD2 3.15Å; S94-D97 WeakPolarHBondContact O-CB 3.43Å; S94-D97 PolarHBondContact O-N 2.88Å; D97-R139 PolarHBondContact O-NH1 2.95Å; D97-R139 PolarHBondContact O-NH2 3.24Å
98	F	86.3	Confident	73.7	Confident	3 Å²	3	42.2 Å²	42.2	1%	0.013	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	107.2	175.1	-73.7	-102.9	0	0	0	109.8	R76 V77 L100 I103 I133 R139 L141	R76-F98 CarbonylContact C-O 3.48Å; R76-F98 WeakPolarHBondContact CA-O 3.29Å; R76-F98 VanDerWaalsContact CB-O 3.29Å; R76-F98 WeakPolarHBondContact CB-O 3.37Å; V77-F98 PolarHBondContact N-O 2.79Å; V77-F98 PolarHBondContact O-N 3.15Å; F98-L100 PolarHBondContact O-N 2.98Å; F98-I103 HydrophobicContact CB-CG1 4.29Å; F98-I133 HydrophobicContact CD1-CG2 4.05Å; F98-I133 HydrophobicContact CE1-CG2 4.49Å; F98-I133 HydrophobicContact CG-CG2 4.24Å; F98-R139 HydrophobicContact CE1-CB 3.78Å; F98-R139 HydrophobicContact CZ-CB 3.56Å; F98-L141 HydrophobicContact CD2-CB 4.19Å; F98-L141 HydrophobicContact CD2-CD2 4.08Å; F98-L141 HydrophobicContact CE2-CB 3.51Å; F98-L141 HydrophobicContact CE2-CD2 4.1Å; F98-L141 HydrophobicContact CE2-CG 4.39Å; F98-L141 HydrophobicContact CZ-CB 3.85Å
99	A	85.3	Confident	75.7	Confident	10 Å²	10	33.2 Å²	33.2	8%	0.083	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-55.7	138.9	166.9	0	0	0	0	0	109.9	V101 N102 I103	A99-V101 HydrophobicContact CB-CG2 4.15Å; A99-V101 PolarHBondContact O-N 3.3Å; A99-V101 VanDerWaalsContact O-N 3.16Å; A99-N102 HydrophobicContact CB-CB 4.26Å; A99-N102 WeakPolarHBondContact O-CA 3.3Å; A99-N102 WeakPolarHBondContact O-CB 3.21Å; A99-N102 PolarHBondContact O-N 2.79Å; A99-I103 PolarHBondContact O-N 2.7Å
100	L	86.5	Confident	77.8	Confident	2 Å²	2	27.8 Å²	27.8	1%	0.01	15%	0.152	C	C	.	.	G	3₁₀ helix	trans	-56.8	-36.8	-176.2	-69.8	169.6	0	0	0	112.3	N74 F75 V77 F98 N102 I103 A164 R165	N74-L100 WeakPolarHBondContact O-CD1 3.08Å; F75-L100 WeakPolarHBondContact O-CG 3.14Å; F75-L100 PolarHBondContact O-N 2.97Å; V77-L100 HydrophobicContact CG2-CD2 4.01Å; F98-L100 PolarHBondContact O-N 2.98Å; L100-N102 VanDerWaalsContact C-N 3.27Å; L100-N102 PolarHBondContact O-N 2.77Å; L100-I103 HydrophobicContact CD2-CD1 4.2Å; L100-I103 PolarHBondContact O-N 3.37Å; L100-A164 HydrophobicContact CD1-CB 3.7Å; L100-A164 HydrophobicContact CD2-CB 4.09Å; L100-R165 HydrophobicContact CB-CG 4.46Å; L100-R165 HydrophobicContact CD2-CG 4.06Å
101	V	82.3	Confident	79.1	Confident	42 Å²	42	27.2 Å²	27.2	26%	0.255	16%	0.156	S	C	.	.	G	3₁₀ helix	trans	-67.9	-25.2	177.4	-62.1	0	0	0	0	113.3	A99 P170 P469	A99-V101 HydrophobicContact CB-CG2 4.15Å; A99-V101 PolarHBondContact O-N 3.3Å; A99-V101 VanDerWaalsContact O-N 3.16Å; V101-P170 HydrophobicContact CG1-CB 4.44Å; V101-P469 HydrophobicContact CG2-CB 4.39Å; V101-P469 HydrophobicContact CG2-CG 3.74Å
102	N	87	Confident	79.7	Confident	1 Å²	1	34.9 Å²	34.9	1%	0.005	19%	0.194	C	C	.	.	G	3₁₀ helix	trans	-83.8	-11.4	177.6	-173.2	40.2	0	0	0	112.2	A99 L100 G104 G135 R136 D137 R467	A99-N102 HydrophobicContact CB-CB 4.26Å; A99-N102 WeakPolarHBondContact O-CA 3.3Å; A99-N102 WeakPolarHBondContact O-CB 3.21Å; A99-N102 PolarHBondContact O-N 2.79Å; L100-N102 VanDerWaalsContact C-N 3.27Å; L100-N102 PolarHBondContact O-N 2.77Å; N102-G104 PolarHBondContact O-N 3.11Å; N102-G104 VanDerWaalsContact O-N 3.07Å; N102-G135 CarbonylContact O-C 3.59Å; N102-G135 WeakPolarHBondContact O-CA 3.32Å; N102-R136 WeakPolarHBondContact O-CG 3.43Å; N102-R136 PolarHBondContact O-N 3.47Å; N102-R136 PolarHBondContact OD1-N 2.92Å; N102-D137 PolarHBondContact ND2-OD1 2.94Å; N102-D137 PolarHBondContact ND2-OD2 2.86Å; N102-D137 PolarHBondContact OD1-N 3.27Å; N102-R467 HydrophobicContact CB-CB 4.22Å
103	I	88.9	Confident	80.4	Confident	2 Å²	2	38 Å²	38	1%	0.01	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	106.6	176.9	-58.4	175.6	0	0	0	109.3	V77 F98 A99 L100 L106 I133 I161 R165	V77-I103 HydrophobicContact CG2-CD1 3.87Å; F98-I103 HydrophobicContact CB-CG1 4.29Å; A99-I103 PolarHBondContact O-N 2.7Å; L100-I103 HydrophobicContact CD2-CD1 4.2Å; L100-I103 PolarHBondContact O-N 3.37Å; I103-L106 HydrophobicContact CG2-CB 4.36Å; I103-I133 HydrophobicContact CB-CG2 4.49Å; I103-I133 HydrophobicContact CD1-CG2 4.08Å; I103-I133 HydrophobicContact CG1-CG2 3.87Å; I103-I133 HydrophobicContact CG2-CG2 3.97Å; I103-I161 HydrophobicContact CD1-CG2 4.2Å; I103-R165 PolarHBondContact O-NH2 2.96Å
104	G	85.6	Confident	81.8	Confident	25 Å²	25	44.7 Å²	44.7	26%	0.258	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	-52.1	178.6	0	0	0	0	0	112.4	N102 H134	N102-G104 PolarHBondContact O-N 3.11Å; N102-G104 VanDerWaalsContact O-N 3.07Å; G104-H134 PolarHBondContact N-O 3.41Å
105	R	88.4	Confident	83	Confident	98 Å²	98	47.5 Å²	47.5	37%	0.37	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	134.7	-177.8	-171	-178	179.5	-152.7	-18.2	108.9	E107 L117 H134 D329	R105-E107 WeakPolarHBondContact CD-OE1 3.49Å; R105-E107 WeakPolarHBondContact CG-OE1 3.2Å; R105-E107 VanDerWaalsContact CZ-CD 3.42Å; R105-E107 IonicContact CZ-OE1 2.71Å; R105-E107 IonicContact CZ-OE2 3.37Å; R105-E107 IonicContact NE-OE1 3.24Å; R105-E107 PolarHBondContact NE-OE1 3.05Å; R105-E107 IonicContact NE-OE2 3.69Å; R105-E107 IonicContact NH1-OE1 2.7Å; R105-E107 PolarHBondContact NH1-OE1 3.41Å; R105-E107 IonicContact NH2-OE1 3.13Å; R105-E107 PolarHBondContact NH2-OE1 3.06Å; R105-E107 IonicContact NH2-OE2 3.11Å; R105-E107 PolarHBondContact NH2-OE2 3.3Å; R105-L117 HydrophobicContact CG-CD1 3.46Å; R105-L117 VanDerWaalsContact CG-CD1 3.46Å; R105-H134 HydrophobicContact CB-CB 3.97Å; R105-H134 PolarHBondContact N-O 2.68Å; R105-H134 VanDerWaalsContact N-O 3.16Å; R105-H134 PolarHBondContact O-N 2.81Å; R105-D329 IonicContact NH1-OD2 3.77Å
106	L	91.7	Very high	84.2	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	125.8	176.9	175.3	68.5	0	0	0	108	I103 L118 M132 I133 I161 V162	I103-L106 HydrophobicContact CG2-CB 4.36Å; L106-L118 HydrophobicContact CB-CB 4.3Å; L106-L118 HydrophobicContact CD2-CB 3.89Å; L106-L118 HydrophobicContact CD2-CD1 3.92Å; L106-L118 HydrophobicContact CG-CB 4.02Å; L106-L118 HydrophobicContact CG-CD1 4.05Å; L106-L118 PolarHBondContact O-N 2.95Å; L106-M132 WeakPolarHBondContact CA-O 3.48Å; L106-I133 HydrophobicContact CD1-CG1 3.76Å; L106-I161 HydrophobicContact CD2-CB 4.41Å; L106-I161 HydrophobicContact CD2-CG2 3.8Å; L106-V162 HydrophobicContact CD2-CG2 3.8Å
107	E	91.2	Very high	85	Confident	5 Å²	5	43.5 Å²	43.5	2%	0.023	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	138.7	179.7	-79	159.8	-110.1	0	0	111.3	R105 V115 Q116 L117 I131 M132 H134	R105-E107 WeakPolarHBondContact CD-OE1 3.49Å; R105-E107 WeakPolarHBondContact CG-OE1 3.2Å; R105-E107 VanDerWaalsContact CZ-CD 3.42Å; R105-E107 IonicContact CZ-OE1 2.71Å; R105-E107 IonicContact CZ-OE2 3.37Å; R105-E107 IonicContact NE-OE1 3.24Å; R105-E107 PolarHBondContact NE-OE1 3.05Å; R105-E107 IonicContact NE-OE2 3.69Å; R105-E107 IonicContact NH1-OE1 2.7Å; R105-E107 PolarHBondContact NH1-OE1 3.41Å; R105-E107 IonicContact NH2-OE1 3.13Å; R105-E107 PolarHBondContact NH2-OE1 3.06Å; R105-E107 IonicContact NH2-OE2 3.11Å; R105-E107 PolarHBondContact NH2-OE2 3.3Å; E107-V115 HydrophobicContact CB-CG1 4.15Å; E107-V115 HydrophobicContact CG-CG1 4.01Å; E107-V115 WeakPolarHBondContact OE2-CG1 3.36Å; E107-Q116 WeakPolarHBondContact CA-O 3.32Å; E107-L117 HydrophobicContact CG-CD1 4.28Å; E107-I131 CarbonylContact O-C 3.6Å; E107-I131 VanDerWaalsContact O-CA 3.24Å; E107-I131 WeakPolarHBondContact O-CA 3.36Å; E107-M132 HydrophobicContact CB-CB 4.27Å; E107-M132 HydrophobicContact CB-CE 3.87Å; E107-M132 HydrophobicContact CG-CE 4.48Å; E107-M132 PolarHBondContact N-O 2.77Å; E107-M132 PolarHBondContact O-N 3.44Å; E107-H134 IonicContact OE1-CD2 3.27Å; E107-H134 IonicContact OE1-NE2 3.37Å; E107-H134 PolarHBondContact OE1-NE2 2.85Å
108	A	90.6	Very high	85.5	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	134.4	166.2	0	0	0	0	0	108.6	V115 Q116 L118 L124 F126 P128	A108-V115 CarbonylContact O-C 3.49Å; A108-V115 WeakPolarHBondContact O-CA 3.25Å; A108-Q116 PolarHBondContact N-O 3.14Å; A108-Q116 PolarHBondContact O-N 3.12Å; A108-L118 HydrophobicContact CB-CD1 3.89Å; A108-L118 HydrophobicContact CB-CG 4.36Å; A108-L124 HydrophobicContact CB-CD1 3.68Å; A108-F126 HydrophobicContact CB-CE2 4.11Å; A108-F126 HydrophobicContact CB-CZ 4.22Å; A108-F126 WeakPolarHBondContact O-CZ 3.36Å; A108-P128 HydrophobicContact CB-CB 3.99Å
109	V	88.3	Confident	85.6	Confident	16 Å²	16	50.8 Å²	50.8	10%	0.097	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	136.5	-179.4	-173.6	0	0	0	0	108.9	R114 V115 P128 E129 E130 M132	V109-R114 CarbonylContact C-O 3.48Å; V109-R114 WeakPolarHBondContact CA-O 3.39Å; V109-V115 HydrophobicContact CG1-CG2 4.38Å; V109-V115 HydrophobicContact CG2-CG1 4.41Å; V109-V115 HydrophobicContact CG2-CG2 4.2Å; V109-P128 WeakPolarHBondContact O-CA 3.39Å; V109-E129 PolarHBondContact O-N 3.24Å; V109-E130 HydrophobicContact CB-CB 4.15Å; V109-E130 HydrophobicContact CB-CG 4.46Å; V109-E130 PolarHBondContact N-O 2.92Å; V109-E130 PolarHBondContact O-N 3.1Å; V109-E130 VanDerWaalsContact O-N 3.1Å; V109-M132 HydrophobicContact CG2-CE 3.73Å; V109-M132 HydrophobicContact CG2-SD 4.47Å
110	S	86.6	Confident	85.5	Confident	21 Å²	21	54 Å²	54	15%	0.147	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	128.1	171.1	167.4	0	0	0	0	109.9	R114 E129	S110-R114 PolarHBondContact N-O 3.02Å; S110-R114 WeakPolarHBondContact O-CB 3.46Å; S110-R114 PolarHBondContact O-N 3.19Å; S110-E129 PolarHBondContact OG-OE1 3.49Å
111	G	79.1	Confident	85.3	Confident	36 Å²	36	57 Å²	57	37%	0.371	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.1	-156.6	-174.6	0	0	0	0	0	113.7	S113 E129	G111-S113 VanDerWaalsContact C-N 3.32Å; G111-S113 PolarHBondContact O-N 2.63Å; G111-E129 WeakPolarHBondContact CA-OE2 3.48Å; G111-E129 VanDerWaalsContact N-CD 3.28Å; G111-E129 PolarHBondContact N-OE1 3.32Å; G111-E129 PolarHBondContact N-OE2 2.79Å
112	L	68.6	Low	85.6	Confident	186 Å²	186	56.4 Å²	56.4	97%	0.974	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.6	-5.7	-171.8	-66.1	169.5	0	0	0	115.3
113	S	68.4	Low	85.7	Confident	102 Å²	102	63 Å²	63	71%	0.713	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-159.8	-8.3	-173	57.8	0	0	0	0	117.8	G111 V115	G111-S113 VanDerWaalsContact C-N 3.32Å; G111-S113 PolarHBondContact O-N 2.63Å; S113-V115 PolarHBondContact O-N 3.44Å
114	R	83.4	Confident	85.7	Confident	171 Å²	171	63.7 Å²	63.7	65%	0.645	35%	0.354	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.6	99.4	-179	-64.3	-178.8	175.9	176.1	0.2	109.9	V109 S110 F126	V109-R114 CarbonylContact C-O 3.48Å; V109-R114 WeakPolarHBondContact CA-O 3.39Å; S110-R114 PolarHBondContact N-O 3.02Å; S110-R114 WeakPolarHBondContact O-CB 3.46Å; S110-R114 PolarHBondContact O-N 3.19Å; R114-F126 HydrophobicContact CB-CE1 4.38Å; R114-F126 WeakPolarHBondContact O-CZ 3.36Å
115	V	86.5	Confident	85.7	Confident	79 Å²	79	71 Å²	71	48%	0.479	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	128.8	174.8	-174.4	0	0	0	0	110	E107 A108 V109 S113	E107-V115 HydrophobicContact CB-CG1 4.15Å; E107-V115 HydrophobicContact CG-CG1 4.01Å; E107-V115 WeakPolarHBondContact OE2-CG1 3.36Å; A108-V115 CarbonylContact O-C 3.49Å; A108-V115 WeakPolarHBondContact O-CA 3.25Å; V109-V115 HydrophobicContact CG1-CG2 4.38Å; V109-V115 HydrophobicContact CG2-CG1 4.41Å; V109-V115 HydrophobicContact CG2-CG2 4.2Å; S113-V115 PolarHBondContact O-N 3.44Å
116	Q	90	Very high	85.8	Confident	23 Å²	23	68.3 Å²	68.3	11%	0.107	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	120.7	172.7	-178	-180	-3.2	0	0	110.3	E107 A108 L118 L123 F126	E107-Q116 WeakPolarHBondContact CA-O 3.32Å; A108-Q116 PolarHBondContact N-O 3.14Å; A108-Q116 PolarHBondContact O-N 3.12Å; Q116-L118 HydrophobicContact CG-CD2 3.97Å; Q116-L118 PolarHBondContact O-N 3.38Å; Q116-L123 PolarHBondContact NE2-O 3.02Å; Q116-F126 HydrophobicContact CB-CE1 3.75Å; Q116-F126 HydrophobicContact CB-CZ 3.9Å
117	L	90.7	Very high	85.5	Confident	76 Å²	76	72.1 Å²	72.1	40%	0.398	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	122.9	168.5	178.7	65.3	0	0	0	110.5	R105 E107	R105-L117 HydrophobicContact CG-CD1 3.46Å; R105-L117 VanDerWaalsContact CG-CD1 3.46Å; E107-L117 HydrophobicContact CG-CD1 4.28Å
118	L	89.7	Confident	85.4	Confident	2 Å²	2	72 Å²	72	1%	0.01	39%	0.389	C	S	.	.			trans	-101.6	104.2	-178.1	-61	177.3	0	0	0	111.2	L106 A108 Q116 L124 T158 V162 R165	L106-L118 HydrophobicContact CB-CB 4.3Å; L106-L118 HydrophobicContact CD2-CB 3.89Å; L106-L118 HydrophobicContact CD2-CD1 3.92Å; L106-L118 HydrophobicContact CG-CB 4.02Å; L106-L118 HydrophobicContact CG-CD1 4.05Å; L106-L118 PolarHBondContact O-N 2.95Å; A108-L118 HydrophobicContact CB-CD1 3.89Å; A108-L118 HydrophobicContact CB-CG 4.36Å; Q116-L118 HydrophobicContact CG-CD2 3.97Å; Q116-L118 PolarHBondContact O-N 3.38Å; L118-L124 HydrophobicContact CD1-CD1 4.04Å; L118-L124 HydrophobicContact CD2-CD1 3.88Å; L118-T158 HydrophobicContact CD1-CG2 3.4Å; L118-V162 HydrophobicContact CB-CG2 3.9Å; L118-V162 HydrophobicContact CD1-CG2 4.03Å; L118-V162 HydrophobicContact CG-CG2 4.44Å; L118-R165 PolarHBondContact O-NH1 2.63Å
119	R	87.9	Confident	85.3	Confident	169 Å²	169	76.8 Å²	76.8	64%	0.638	41%	0.411	S	S	*	.			trans	-90.1	157.5	172.5	-63.7	-179.3	-179.5	159.8	0.1	110.6	G121 S122	R119-G121 PolarHBondContact O-N 3.25Å; R119-S122 WeakPolarHBondContact CA-OG 3.41Å; R119-S122 PolarHBondContact N-OG 2.74Å; R119-S122 WeakPolarHBondContact O-CB 3.48Å; R119-S122 PolarHBondContact O-N 3.14Å; R119-S122 PolarHBondContact O-OG 2.63Å
120	P	83.3	Confident	85.3	Confident	77 Å²	77	77.5 Å²	77.5	50%	0.5	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.8	129.5	171.8	-26.7	35.6	0	0	0	111.5	S122 A166	P120-S122 VanDerWaalsContact C-N 3.33Å; P120-S122 PolarHBondContact O-N 2.98Å; P120-A166 HydrophobicContact CB-CB 4.02Å
121	G	82.6	Confident	85.5	Confident	66 Å²	66	76.5 Å²	76.5	68%	0.68	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	81	0.7	-176.3	0	0	0	0	0	116	R119	R119-G121 PolarHBondContact O-N 3.25Å
122	S	88.6	Confident	86	Confident	30 Å²	30	75.6 Å²	75.6	21%	0.21	39%	0.393	C	S	.	.	P	Polyproline II helix	trans	-70	145.1	174	-56.6	0	0	0	0	111.3	R119 P120	R119-S122 WeakPolarHBondContact CA-OG 3.41Å; R119-S122 PolarHBondContact N-OG 2.74Å; R119-S122 WeakPolarHBondContact O-CB 3.48Å; R119-S122 PolarHBondContact O-N 3.14Å; R119-S122 PolarHBondContact O-OG 2.63Å; P120-S122 VanDerWaalsContact C-N 3.33Å; P120-S122 PolarHBondContact O-N 2.98Å
123	L	88.9	Confident	87	Confident	140 Å²	140	66.8 Å²	66.8	73%	0.733	35%	0.347	S	S	*	.	P	Polyproline II helix	trans	-93.5	145.4	165.6	-64.1	174	0	0	0	109.9	Q116 M159	Q116-L123 PolarHBondContact NE2-O 3.02Å; L123-M159 HydrophobicContact CD2-CE 4.38Å
124	L	89	Confident	88	Confident	16 Å²	16	62.1 Å²	62.1	8%	0.084	31%	0.314	C	S	.	.	P	Polyproline II helix	trans	-81.6	125.9	178.7	-171.2	66.2	0	0	0	109.8	A108 L118 F126 P128 F155 T158 M159	A108-L124 HydrophobicContact CB-CD1 3.68Å; L118-L124 HydrophobicContact CD1-CD1 4.04Å; L118-L124 HydrophobicContact CD2-CD1 3.88Å; L124-F126 WeakPolarHBondContact CD2-O 3.32Å; L124-F126 WeakPolarHBondContact CG-O 3.31Å; L124-P128 VanDerWaalsContact CD2-CD 3.48Å; L124-P128 HydrophobicContact CD2-CG 4.15Å; L124-F155 HydrophobicContact CB-CD2 4.38Å; L124-F155 HydrophobicContact CB-CE2 3.82Å; L124-F155 HydrophobicContact CB-CZ 4.38Å; L124-F155 HydrophobicContact CD2-CB 4.49Å; L124-F155 HydrophobicContact CD2-CD2 3.36Å; L124-F155 HydrophobicContact CD2-CE2 3.69Å; L124-F155 HydrophobicContact CD2-CG 4.06Å; L124-F155 HydrophobicContact CG-CD2 4.2Å; L124-F155 HydrophobicContact CG-CE2 4.08Å; L124-T158 HydrophobicContact CD1-CG2 4.08Å; L124-T158 HydrophobicContact CD2-CG2 4.07Å; L124-M159 HydrophobicContact CB-CG 4.21Å; L124-M159 HydrophobicContact CB-SD 3.6Å
125	K	87.1	Confident	88.2	Confident	179 Å²	179	54 Å²	54	78%	0.778	28%	0.284	S	S	*	.	S	Bend	trans	-87	-18.3	-173.3	-66.5	178.4	-179.7	-177.7	0	114.1
126	F	88.8	Confident	88.2	Confident	41 Å²	41	52.9 Å²	52.9	18%	0.18	27%	0.271	C	S	.	.	S	Bend	trans	-153	162.3	-176.8	56.1	-100.9	0	0	0	109.4	A108 R114 Q116 L124 P128	A108-F126 HydrophobicContact CB-CE2 4.11Å; A108-F126 HydrophobicContact CB-CZ 4.22Å; A108-F126 WeakPolarHBondContact O-CZ 3.36Å; R114-F126 HydrophobicContact CB-CE1 4.38Å; R114-F126 WeakPolarHBondContact O-CZ 3.36Å; Q116-F126 HydrophobicContact CB-CE1 3.75Å; Q116-F126 HydrophobicContact CB-CZ 3.9Å; L124-F126 WeakPolarHBondContact CD2-O 3.32Å; L124-F126 WeakPolarHBondContact CG-O 3.31Å; F126-P128 WeakPolarHBondContact O-CD 3.4Å
127	I	86.9	Confident	88.1	Confident	79 Å²	79	51.9 Å²	51.9	41%	0.405	27%	0.266	S	S	.	.			trans	-77.4	121.1	175.1	-58.8	173.5	0	0	0	108.6	E129 E151 A154 F155	I127-E129 PolarHBondContact O-N 3.48Å; I127-E151 HydrophobicContact CD1-CB 3.94Å; I127-E151 HydrophobicContact CG2-CB 3.84Å; I127-E151 HydrophobicContact CG2-CG 4.45Å; I127-E151 VanDerWaalsContact CG2-O 3.29Å; I127-E151 WeakPolarHBondContact CG2-O 3.35Å; I127-A154 HydrophobicContact CG2-CB 4.27Å; I127-F155 HydrophobicContact CG1-CD2 4.37Å
128	P	88.3	Confident	88	Confident	2 Å²	2	48.3 Å²	48.3	1%	0.013	25%	0.248	C	C	.	.			trans	-69.1	130	-179.6	25	-31.5	0	0	0	110.3	A108 V109 L124 F126 E130 I131 A154 T158	A108-P128 HydrophobicContact CB-CB 3.99Å; V109-P128 WeakPolarHBondContact O-CA 3.39Å; L124-P128 VanDerWaalsContact CD2-CD 3.48Å; L124-P128 HydrophobicContact CD2-CG 4.15Å; F126-P128 WeakPolarHBondContact O-CD 3.4Å; P128-E130 VanDerWaalsContact C-N 3.27Å; P128-E130 WeakPolarHBondContact CB-O 3.5Å; P128-I131 HydrophobicContact CB-CG2 3.98Å; P128-I131 HydrophobicContact CG-CG2 4.15Å; P128-A154 HydrophobicContact CG-CB 4.28Å; P128-T158 HydrophobicContact CG-CG2 4.4Å; P128-T158 WeakPolarHBondContact CG-OG1 3.47Å
129	E	88.4	Confident	87.8	Confident	102 Å²	102	49.7 Å²	49.7	48%	0.477	25%	0.252	S	S	.	.	S	Bend	trans	-78	-23.7	162.3	-72.1	162.9	-143.6	0	0	110	V109 S110 G111 I127 F145	V109-E129 PolarHBondContact O-N 3.24Å; S110-E129 PolarHBondContact OG-OE1 3.49Å; G111-E129 WeakPolarHBondContact CA-OE2 3.48Å; G111-E129 VanDerWaalsContact N-CD 3.28Å; G111-E129 PolarHBondContact N-OE1 3.32Å; G111-E129 PolarHBondContact N-OE2 2.79Å; I127-E129 PolarHBondContact O-N 3.48Å; E129-F145 PolarHBondContact O-N 2.97Å
130	E	88.5	Confident	87.6	Confident	30 Å²	30	43.3 Å²	43.3	14%	0.14	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	148.1	179.5	168.4	163.7	-113	0	0	111.4	V109 P128 R142 V143	V109-E130 HydrophobicContact CB-CB 4.15Å; V109-E130 HydrophobicContact CB-CG 4.46Å; V109-E130 PolarHBondContact N-O 2.92Å; V109-E130 PolarHBondContact O-N 3.1Å; V109-E130 VanDerWaalsContact O-N 3.1Å; P128-E130 VanDerWaalsContact C-N 3.27Å; P128-E130 WeakPolarHBondContact CB-O 3.5Å; E130-R142 HydrophobicContact CG-CG 4.35Å; E130-R142 WeakPolarHBondContact OE1-CD 3.39Å; E130-R142 WeakPolarHBondContact OE1-CG 3.13Å; E130-R142 IonicContact OE1-CZ 2.79Å; E130-R142 VanDerWaalsContact OE1-CZ 3.27Å; E130-R142 IonicContact OE1-NE 2.8Å; E130-R142 PolarHBondContact OE1-NE 2.82Å; E130-R142 IonicContact OE1-NH2 2.77Å; E130-R142 PolarHBondContact OE1-NH2 3.41Å; E130-R142 IonicContact OE2-CZ 3.77Å; E130-R142 IonicContact OE2-NE 2.92Å; E130-R142 PolarHBondContact OE2-NE 3.33Å; E130-R142 VanDerWaalsContact OE2-NE 3.14Å; E130-R142 IonicContact OE2-NH2 3.16Å; E130-R142 PolarHBondContact OE2-NH2 2.88Å; E130-V143 CarbonylContact C-O 3.54Å; E130-V143 WeakPolarHBondContact CA-O 3.44Å
131	I	90.8	Very high	87.8	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	146.2	168.1	62.1	169.8	0	0	0	111.3	L70 E107 P128 I133 V143 F145 T158 I161	L70-I131 HydrophobicContact CD2-CD1 3.55Å; E107-I131 CarbonylContact O-C 3.6Å; E107-I131 VanDerWaalsContact O-CA 3.24Å; E107-I131 WeakPolarHBondContact O-CA 3.36Å; P128-I131 HydrophobicContact CB-CG2 3.98Å; P128-I131 HydrophobicContact CG-CG2 4.15Å; I131-I133 HydrophobicContact CD1-CD1 4.29Å; I131-V143 HydrophobicContact CD1-CB 4.43Å; I131-V143 HydrophobicContact CG1-CB 3.86Å; I131-V143 PolarHBondContact N-O 3.47Å; I131-V143 PolarHBondContact O-N 3.08Å; I131-F145 HydrophobicContact CB-CE2 4.4Å; I131-F145 HydrophobicContact CD1-CE2 4.34Å; I131-F145 HydrophobicContact CD1-CZ 4.16Å; I131-F145 HydrophobicContact CG1-CE2 3.91Å; I131-F145 HydrophobicContact CG1-CZ 4.2Å; I131-F145 HydrophobicContact CG2-CE2 3.95Å; I131-T158 HydrophobicContact CG2-CG2 4.24Å; I131-T158 WeakPolarHBondContact CG2-OG1 3.3Å; I131-I161 HydrophobicContact CD1-CD1 4.3Å
132	M	89.4	Confident	87.9	Confident	18 Å²	18	40.7 Å²	40.7	9%	0.089	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	120.8	174.9	-57.7	-176.2	-62.6	0	0	109.4	L106 E107 V109 L140 R142	L106-M132 WeakPolarHBondContact CA-O 3.48Å; E107-M132 HydrophobicContact CB-CB 4.27Å; E107-M132 HydrophobicContact CB-CE 3.87Å; E107-M132 HydrophobicContact CG-CE 4.48Å; E107-M132 PolarHBondContact N-O 2.77Å; E107-M132 PolarHBondContact O-N 3.44Å; V109-M132 HydrophobicContact CG2-CE 3.73Å; V109-M132 HydrophobicContact CG2-SD 4.47Å; M132-L140 HydrophobicContact CB-CD1 4.23Å; M132-R142 HydrophobicContact CG-CG 4.34Å
133	I	90.3	Very high	87.9	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	106.3	179	-54.3	-179.2	0	0	0	107.7	V77 F98 I103 L106 I131 L140 L141 I161	V77-I133 HydrophobicContact CB-CD1 4.37Å; V77-I133 HydrophobicContact CG1-CD1 3.79Å; F98-I133 HydrophobicContact CD1-CG2 4.05Å; F98-I133 HydrophobicContact CE1-CG2 4.49Å; F98-I133 HydrophobicContact CG-CG2 4.24Å; I103-I133 HydrophobicContact CB-CG2 4.49Å; I103-I133 HydrophobicContact CD1-CG2 4.08Å; I103-I133 HydrophobicContact CG1-CG2 3.87Å; I103-I133 HydrophobicContact CG2-CG2 3.97Å; L106-I133 HydrophobicContact CD1-CG1 3.76Å; I131-I133 HydrophobicContact CD1-CD1 4.29Å; I133-L140 WeakPolarHBondContact O-CA 3.28Å; I133-L141 HydrophobicContact CB-CB 4.28Å; I133-L141 HydrophobicContact CD1-CD2 4.29Å; I133-L141 PolarHBondContact N-O 3.37Å; I133-L141 PolarHBondContact O-N 3.28Å; I133-I161 HydrophobicContact CD1-CD1 4.37Å
134	H	88.6	Confident	87.8	Confident	4 Å²	4	33.3 Å²	33.3	2%	0.019	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	116	174.9	-54.7	-108.4	0	0	0	109.2	G104 R105 E107 D329	G104-H134 PolarHBondContact N-O 3.41Å; R105-H134 HydrophobicContact CB-CB 3.97Å; R105-H134 PolarHBondContact N-O 2.68Å; R105-H134 VanDerWaalsContact N-O 3.16Å; R105-H134 PolarHBondContact O-N 2.81Å; E107-H134 IonicContact OE1-CD2 3.27Å; E107-H134 IonicContact OE1-NE2 3.37Å; E107-H134 PolarHBondContact OE1-NE2 2.85Å; H134-D329 IonicContact CE1-OD2 3.18Å; H134-D329 PolarHBondContact CE1-OD2 3.4Å
135	G	88.6	Confident	87.6	Confident	2 Å²	2	33.2 Å²	33.2	2%	0.021	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	153.7	172.4	0	0	0	0	0	111.9	N102 D137 R139	N102-G135 CarbonylContact O-C 3.59Å; N102-G135 WeakPolarHBondContact O-CA 3.32Å; G135-D137 WeakPolarHBondContact CA-OD1 3.38Å; G135-D137 PolarHBondContact O-N 3.42Å; G135-R139 PolarHBondContact N-O 3.28Å
136	R	86.8	Confident	86.9	Confident	55 Å²	55	29 Å²	29	21%	0.208	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-14.3	168.8	-63.7	-177.5	-175.2	-155.8	-1.8	111.2	N102 F138 L422 R467	N102-R136 WeakPolarHBondContact O-CG 3.43Å; N102-R136 PolarHBondContact O-N 3.47Å; N102-R136 PolarHBondContact OD1-N 2.92Å; R136-F138 VanDerWaalsContact C-N 3.35Å; R136-L422 PolarHBondContact NH1-O 2.81Å; R136-R467 PolarHBondContact O-NH1 3.28Å
137	D	86.8	Confident	85.5	Confident	1 Å²	1	32.5 Å²	32.5	1%	0.005	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.6	20.1	179.8	63	-6.7	0	0	0	114.2	N102 G135 R139	N102-D137 PolarHBondContact ND2-OD1 2.94Å; N102-D137 PolarHBondContact ND2-OD2 2.86Å; N102-D137 PolarHBondContact OD1-N 3.27Å; G135-D137 WeakPolarHBondContact CA-OD1 3.38Å; G135-D137 PolarHBondContact O-N 3.42Å; D137-R139 PolarHBondContact O-N 3.46Å; D137-R139 VanDerWaalsContact O-N 3.14Å; D137-R139 PolarHBondContact OD1-N 3.36Å; D137-R139 IonicContact OD1-NE 3.01Å; D137-R139 IonicContact OD2-CZ 3.09Å; D137-R139 VanDerWaalsContact OD2-CZ 3.23Å; D137-R139 IonicContact OD2-NE 3.99Å; D137-R139 PolarHBondContact OD2-NE 2.96Å; D137-R139 IonicContact OD2-NH2 3.23Å; D137-R139 PolarHBondContact OD2-NH2 3.36Å
138	F	88	Confident	84.2	Confident	2 Å²	2	32 Å²	32	1%	0.009	19%	0.187	C	C	.	.	S	Bend	trans	65.4	3.9	-178.3	-58.9	-98.4	0	0	0	115.5	R136 H319 L322 R323 C326 L435 C638 Y639 G642	R136-F138 VanDerWaalsContact C-N 3.35Å; F138-H319 AromaticContact CE2-CE1 3.61Å; F138-H319 AromaticContact CZ-CE1 3.53Å; F138-H319 AromaticContact CZ-ND1 3.88Å; F138-L322 HydrophobicContact CE1-CG 4.26Å; F138-L322 HydrophobicContact CZ-CD2 4.29Å; F138-L322 HydrophobicContact CZ-CG 4.46Å; F138-R323 HydrophobicContact CD1-CB 4.49Å; F138-R323 HydrophobicContact CD1-CG 4.15Å; F138-R323 HydrophobicContact CE1-CB 3.88Å; F138-R323 HydrophobicContact CE1-CG 4.02Å; F138-R323 HydrophobicContact CZ-CB 4.36Å; F138-C326 HydrophobicContact CD1-CB 4.19Å; F138-C326 HydrophobicContact CE1-CB 4.46Å; F138-L435 HydrophobicContact CE2-CD2 4.11Å; F138-C638 WeakPolarHBondContact CB-O 3.46Å; F138-Y639 HydrophobicContact CD1-CD1 4.09Å; F138-Y639 WeakPolarHBondContact CD1-O 3.38Å; F138-Y639 AromaticContact CD2-CD1 3.87Å; F138-Y639 HydrophobicContact CD2-CD1 3.87Å; F138-Y639 HydrophobicContact CD2-CE1 4.4Å; F138-Y639 AromaticContact CE1-CD1 3.67Å; F138-Y639 HydrophobicContact CE1-CD1 3.67Å; F138-Y639 HydrophobicContact CE1-CE1 4.45Å; F138-Y639 HydrophobicContact CE1-CG 4.38Å; F138-Y639 AromaticContact CE2-CD1 3.45Å; F138-Y639 HydrophobicContact CE2-CD1 3.45Å; F138-Y639 VanDerWaalsContact CE2-CD1 3.45Å; F138-Y639 AromaticContact CE2-CE1 3.67Å; F138-Y639 HydrophobicContact CE2-CE1 3.67Å; F138-Y639 HydrophobicContact CG-CD1 4.19Å; F138-Y639 AromaticContact CZ-CD1 3.35Å; F138-Y639 HydrophobicContact CZ-CD1 3.35Å; F138-Y639 AromaticContact CZ-CE1 3.71Å; F138-Y639 HydrophobicContact CZ-CE1 3.71Å; F138-Y639 HydrophobicContact CZ-CG 4.42Å; F138-G642 WeakPolarHBondContact O-CA 3.47Å; F138-G642 PolarHBondContact O-N 3.42Å
139	R	85.7	Confident	83.2	Confident	30 Å²	30	34 Å²	34	11%	0.113	21%	0.207	C	C	.	.			trans	-79.2	148.5	172.6	-65.8	-170.8	-68.5	159.7	-2.6	111.3	E95 D97 F98 G135 D137 R641	E95-R139 PolarHBondContact O-NH1 3.48Å; D97-R139 PolarHBondContact O-NH1 2.95Å; D97-R139 PolarHBondContact O-NH2 3.24Å; F98-R139 HydrophobicContact CE1-CB 3.78Å; F98-R139 HydrophobicContact CZ-CB 3.56Å; G135-R139 PolarHBondContact N-O 3.28Å; D137-R139 PolarHBondContact O-N 3.46Å; D137-R139 VanDerWaalsContact O-N 3.14Å; D137-R139 PolarHBondContact OD1-N 3.36Å; D137-R139 IonicContact OD1-NE 3.01Å; D137-R139 IonicContact OD2-CZ 3.09Å; D137-R139 VanDerWaalsContact OD2-CZ 3.23Å; D137-R139 IonicContact OD2-NE 3.99Å; D137-R139 PolarHBondContact OD2-NE 2.96Å; D137-R139 IonicContact OD2-NH2 3.23Å; D137-R139 PolarHBondContact OD2-NH2 3.36Å; R139-R641 HydrophobicContact CG-CB 4.02Å
140	L	85.3	Confident	82.8	Confident	35 Å²	35	30.6 Å²	30.6	18%	0.183	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	128.4	172.7	175	62.8	0	0	0	109	M132 I133 P328	M132-L140 HydrophobicContact CB-CD1 4.23Å; I133-L140 WeakPolarHBondContact O-CA 3.28Å; L140-P328 HydrophobicContact CD2-CG 3.59Å
141	L	85.9	Confident	82.6	Confident	3 Å²	3	34.3 Å²	34.3	2%	0.016	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	112.4	167	175.8	63.2	0	0	0	108.6	K60 L70 F79 F98 I133 V143	K60-L141 HydrophobicContact CD-CD1 4.3Å; K60-L141 HydrophobicContact CG-CD1 4.23Å; L70-L141 HydrophobicContact CD1-CD2 4.44Å; F79-L141 HydrophobicContact CB-CD1 4.12Å; F79-L141 HydrophobicContact CB-CD2 4Å; F79-L141 HydrophobicContact CG-CD1 4.4Å; F98-L141 HydrophobicContact CD2-CB 4.19Å; F98-L141 HydrophobicContact CD2-CD2 4.08Å; F98-L141 HydrophobicContact CE2-CB 3.51Å; F98-L141 HydrophobicContact CE2-CD2 4.1Å; F98-L141 HydrophobicContact CE2-CG 4.39Å; F98-L141 HydrophobicContact CZ-CB 3.85Å; I133-L141 HydrophobicContact CB-CB 4.28Å; I133-L141 HydrophobicContact CD1-CD2 4.29Å; I133-L141 PolarHBondContact N-O 3.37Å; I133-L141 PolarHBondContact O-N 3.28Å; L141-V143 HydrophobicContact CD1-CG2 3.92Å; L141-V143 HydrophobicContact CD2-CG2 4.22Å; L141-V143 HydrophobicContact CG-CG2 3.73Å
142	R	85.8	Confident	82.3	Confident	85 Å²	85	37.5 Å²	37.5	32%	0.321	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	120.4	176.9	-177.8	173.5	-173.1	-152.5	-8.7	108.4	K60 G61 E130 M132	K60-R142 WeakPolarHBondContact CA-O 3.38Å; G61-R142 PolarHBondContact N-O 3.29Å; E130-R142 HydrophobicContact CG-CG 4.35Å; E130-R142 WeakPolarHBondContact OE1-CD 3.39Å; E130-R142 WeakPolarHBondContact OE1-CG 3.13Å; E130-R142 IonicContact OE1-CZ 2.79Å; E130-R142 VanDerWaalsContact OE1-CZ 3.27Å; E130-R142 IonicContact OE1-NE 2.8Å; E130-R142 PolarHBondContact OE1-NE 2.82Å; E130-R142 IonicContact OE1-NH2 2.77Å; E130-R142 PolarHBondContact OE1-NH2 3.41Å; E130-R142 IonicContact OE2-CZ 3.77Å; E130-R142 IonicContact OE2-NE 2.92Å; E130-R142 PolarHBondContact OE2-NE 3.33Å; E130-R142 VanDerWaalsContact OE2-NE 3.14Å; E130-R142 IonicContact OE2-NH2 3.16Å; E130-R142 PolarHBondContact OE2-NH2 2.88Å; M132-R142 HydrophobicContact CG-CG 4.34Å
143	V	87.9	Confident	82.3	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	114.9	-175.2	-172.9	0	0	0	0	109.6	V58 R59 L70 F79 E130 I131 L141	V58-V143 HydrophobicContact CB-CG1 3.55Å; V58-V143 HydrophobicContact CG1-CG1 3.94Å; V58-V143 HydrophobicContact CG2-CG1 4.05Å; R59-V143 CarbonylContact O-C 3.59Å; R59-V143 WeakPolarHBondContact O-CA 3.48Å; L70-V143 HydrophobicContact CD1-CG2 4.35Å; L70-V143 HydrophobicContact CD2-CG1 4.29Å; F79-V143 HydrophobicContact CD2-CG2 4.38Å; E130-V143 CarbonylContact C-O 3.54Å; E130-V143 WeakPolarHBondContact CA-O 3.44Å; I131-V143 HydrophobicContact CD1-CB 4.43Å; I131-V143 HydrophobicContact CG1-CB 3.86Å; I131-V143 PolarHBondContact N-O 3.47Å; I131-V143 PolarHBondContact O-N 3.08Å; L141-V143 HydrophobicContact CD1-CG2 3.92Å; L141-V143 HydrophobicContact CD2-CG2 4.22Å; L141-V143 HydrophobicContact CG-CG2 3.73Å
144	G	87.6	Confident	82.2	Confident	16 Å²	16	39.6 Å²	39.6	17%	0.165	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	140.6	172.2	0	0	0	0	0	111.9	R59	R59-G144 PolarHBondContact N-O 3.03Å; R59-G144 PolarHBondContact O-N 3.03Å
145	F	84.9	Confident	82.2	Confident	14 Å²	14	43.3 Å²	43.3	6%	0.061	26%	0.256	C	S	.	.			trans	-104.6	106.2	170.5	-56.3	-87.6	0	0	0	107	A55 V58 L70 E129 I131 A154	A55-F145 HydrophobicContact CB-CD1 4.48Å; A55-F145 HydrophobicContact CB-CE1 3.88Å; V58-F145 HydrophobicContact CG1-CD1 3.56Å; V58-F145 HydrophobicContact CG1-CE1 3.55Å; V58-F145 HydrophobicContact CG1-CZ 4.49Å; L70-F145 HydrophobicContact CD2-CZ 4.26Å; E129-F145 PolarHBondContact O-N 2.97Å; I131-F145 HydrophobicContact CB-CE2 4.4Å; I131-F145 HydrophobicContact CD1-CE2 4.34Å; I131-F145 HydrophobicContact CD1-CZ 4.16Å; I131-F145 HydrophobicContact CG1-CE2 3.91Å; I131-F145 HydrophobicContact CG1-CZ 4.2Å; I131-F145 HydrophobicContact CG2-CE2 3.95Å; F145-A154 HydrophobicContact CB-CB 4.11Å; F145-A154 HydrophobicContact CD1-CB 3.54Å; F145-A154 HydrophobicContact CD2-CB 3.8Å; F145-A154 HydrophobicContact CE1-CB 3.83Å; F145-A154 HydrophobicContact CE2-CB 4.08Å; F145-A154 HydrophobicContact CG-CB 3.53Å; F145-A154 HydrophobicContact CZ-CB 4.1Å
146	E	70.6	Confident	82.4	Confident	90 Å²	90	48.8 Å²	48.8	42%	0.421	28%	0.281	S	S	.	.			trans	-62.6	153.6	-178.4	-64.7	-156.2	100.9	0	0	112.8	R59 G148	R59-E146 HydrophobicContact CG-CG 4.18Å; R59-E146 IonicContact CZ-OE1 2.64Å; R59-E146 IonicContact CZ-OE2 3.71Å; R59-E146 IonicContact NE-OE1 2.65Å; R59-E146 PolarHBondContact NE-OE1 3.26Å; R59-E146 VanDerWaalsContact NE-OE1 3.11Å; R59-E146 IonicContact NE-OE2 3.56Å; R59-E146 PolarHBondContact NE-OE2 3.16Å; R59-E146 IonicContact NH1-OE1 3.52Å; R59-E146 PolarHBondContact NH1-OE1 3Å; R59-E146 IonicContact NH2-OE1 3.07Å; R59-E146 PolarHBondContact NH2-OE1 3.47Å; R59-E146 IonicContact NH2-OE2 2.69Å; R59-E146 PolarHBondContact NH2-OE2 3.22Å; E146-G148 PolarHBondContact O-N 3.39Å
147	A	59.6	Low	82.6	Confident	115 Å²	115	46.1 Å²	46.1	95%	0.95	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	101	172.7	0	0	0	0	0	110
148	G	59.5	Low	82.9	Confident	69 Å²	69	46.1 Å²	46.1	71%	0.711	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	179.1	28.9	-175	0	0	0	0	0	115.9	E146	E146-G148 PolarHBondContact O-N 3.39Å
149	G	68.9	Low	83.1	Confident	42 Å²	42	46.9 Å²	46.9	43%	0.433	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.8	13.6	176.7	0	0	0	0	0	115.7	E151 Q153	G149-E151 WeakPolarHBondContact CA-OE2 3.46Å; G149-Q153 PolarHBondContact O-OE1 2.85Å
150	L	79.1	Confident	83.4	Confident	31 Å²	31	45.9 Å²	45.9	16%	0.162	27%	0.273	C	S	.	.			trans	-83.4	4.3	172	-69.3	174.8	0	0	0	113.1	P56 Q153 A154	P56-L150 WeakPolarHBondContact O-CD1 3.06Å; P56-L150 WeakPolarHBondContact O-CD2 3.35Å; L150-Q153 PolarHBondContact O-N 3.26Å; L150-Q153 VanDerWaalsContact O-N 3.14Å; L150-Q153 PolarHBondContact O-OE1 2.88Å; L150-A154 WeakPolarHBondContact O-CB 3.24Å; L150-A154 PolarHBondContact O-N 3.38Å
151	E	83.7	Confident	83.8	Confident	109 Å²	109	44.2 Å²	44.2	51%	0.509	26%	0.264	S	S	.	.	H	α-helix	trans	-57	-43.7	-176.6	-56.2	126.7	145.9	0	0	112.7	I127 G149 Q153 F155	I127-E151 HydrophobicContact CD1-CB 3.94Å; I127-E151 HydrophobicContact CG2-CB 3.84Å; I127-E151 HydrophobicContact CG2-CG 4.45Å; I127-E151 VanDerWaalsContact CG2-O 3.29Å; I127-E151 WeakPolarHBondContact CG2-O 3.35Å; G149-E151 WeakPolarHBondContact CA-OE2 3.46Å; E151-Q153 PolarHBondContact O-N 2.79Å; E151-F155 PolarHBondContact O-N 3.49Å; E151-F155 VanDerWaalsContact O-N 3.14Å
152	P	86.1	Confident	84	Confident	66 Å²	66	44.2 Å²	44.2	43%	0.429	26%	0.264	S	S	.	.	H	α-helix	trans	-64.2	-40.4	176.1	-21.4	34.7	0	0	0	112.7	F155 Q156	P152-F155 PolarHBondContact O-N 3.19Å; P152-Q156 WeakPolarHBondContact O-CB 3.38Å; P152-Q156 WeakPolarHBondContact O-CG 3.4Å; P152-Q156 PolarHBondContact O-N 3.24Å
153	Q	88.4	Confident	84.2	Confident	62 Å²	62	45.1 Å²	45.1	29%	0.29	27%	0.272	S	S	.	.	H	α-helix	trans	-71	-39.2	-179.1	-67.4	79.7	-1.4	0	0	111.3	A55 G149 L150 E151 F155 Q156 V157	A55-Q153 HydrophobicContact CB-CB 4.03Å; G149-Q153 PolarHBondContact O-OE1 2.85Å; L150-Q153 PolarHBondContact O-N 3.26Å; L150-Q153 VanDerWaalsContact O-N 3.14Å; L150-Q153 PolarHBondContact O-OE1 2.88Å; E151-Q153 PolarHBondContact O-N 2.79Å; Q153-F155 VanDerWaalsContact C-N 3.34Å; Q153-F155 PolarHBondContact O-N 2.96Å; Q153-Q156 PolarHBondContact O-N 2.79Å; Q153-V157 WeakPolarHBondContact O-CB 3.46Å; Q153-V157 WeakPolarHBondContact O-CG2 3.43Å; Q153-V157 PolarHBondContact O-N 3.26Å
154	A	87.5	Confident	84.2	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-59	-46.7	174.7	0	0	0	0	0	110.9	I127 P128 F145 L150 T158	I127-A154 HydrophobicContact CG2-CB 4.27Å; P128-A154 HydrophobicContact CG-CB 4.28Å; F145-A154 HydrophobicContact CB-CB 4.11Å; F145-A154 HydrophobicContact CD1-CB 3.54Å; F145-A154 HydrophobicContact CD2-CB 3.8Å; F145-A154 HydrophobicContact CE1-CB 3.83Å; F145-A154 HydrophobicContact CE2-CB 4.08Å; F145-A154 HydrophobicContact CG-CB 3.53Å; F145-A154 HydrophobicContact CZ-CB 4.1Å; L150-A154 WeakPolarHBondContact O-CB 3.24Å; L150-A154 PolarHBondContact O-N 3.38Å; A154-T158 WeakPolarHBondContact O-CB 3.31Å; A154-T158 PolarHBondContact O-N 3.49Å; A154-T158 VanDerWaalsContact O-N 3.1Å; A154-T158 PolarHBondContact O-OG1 2.84Å
155	F	90.5	Very high	84.2	Confident	83 Å²	83	46.2 Å²	46.2	36%	0.364	27%	0.272	S	S	.	.	H	α-helix	trans	-63.1	-48.3	174.8	-172.8	-84.8	0	0	0	111.9	L124 I127 E151 P152 Q153 T158 M159	L124-F155 HydrophobicContact CB-CD2 4.38Å; L124-F155 HydrophobicContact CB-CE2 3.82Å; L124-F155 HydrophobicContact CB-CZ 4.38Å; L124-F155 HydrophobicContact CD2-CB 4.49Å; L124-F155 HydrophobicContact CD2-CD2 3.36Å; L124-F155 HydrophobicContact CD2-CE2 3.69Å; L124-F155 HydrophobicContact CD2-CG 4.06Å; L124-F155 HydrophobicContact CG-CD2 4.2Å; L124-F155 HydrophobicContact CG-CE2 4.08Å; I127-F155 HydrophobicContact CG1-CD2 4.37Å; E151-F155 PolarHBondContact O-N 3.49Å; E151-F155 VanDerWaalsContact O-N 3.14Å; P152-F155 PolarHBondContact O-N 3.19Å; Q153-F155 VanDerWaalsContact C-N 3.34Å; Q153-F155 PolarHBondContact O-N 2.96Å; F155-T158 PolarHBondContact O-N 3.43Å; F155-M159 HydrophobicContact CD1-CG 4.17Å; F155-M159 HydrophobicContact CE1-CG 3.74Å; F155-M159 HydrophobicContact CZ-CG 3.93Å; F155-M159 WeakPolarHBondContact O-CB 3.49Å; F155-M159 PolarHBondContact O-N 2.78Å
156	Q	91.3	Very high	84.1	Confident	116 Å²	116	48.3 Å²	48.3	54%	0.542	29%	0.292	S	S	.	.	H	α-helix	trans	-60.8	-50.1	-178.2	-77.7	174.7	10.1	0	0	112.6	P152 Q153 M159 A160	P152-Q156 WeakPolarHBondContact O-CB 3.38Å; P152-Q156 WeakPolarHBondContact O-CG 3.4Å; P152-Q156 PolarHBondContact O-N 3.24Å; Q153-Q156 PolarHBondContact O-N 2.79Å; Q156-M159 PolarHBondContact O-N 2.86Å; Q156-A160 VanDerWaalsContact O-CB 3.3Å; Q156-A160 WeakPolarHBondContact O-CB 3.41Å; Q156-A160 PolarHBondContact O-N 3.16Å
157	V	92.2	Very high	84.6	Confident	0 Å²	0	51 Å²	51	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-64.7	-44.1	179.6	173.9	0	0	0	0	110.9	A53 A55 L70 C72 Q153 M159 A160 I161	A53-V157 HydrophobicContact CB-CB 4.38Å; A53-V157 HydrophobicContact CB-CG2 3.81Å; A55-V157 HydrophobicContact CB-CG2 3.78Å; L70-V157 HydrophobicContact CD2-CG1 3.65Å; L70-V157 HydrophobicContact CG-CG1 4.08Å; C72-V157 HydrophobicContact CB-CG1 4.39Å; Q153-V157 WeakPolarHBondContact O-CB 3.46Å; Q153-V157 WeakPolarHBondContact O-CG2 3.43Å; Q153-V157 PolarHBondContact O-N 3.26Å; V157-M159 VanDerWaalsContact C-N 3.35Å; V157-M159 PolarHBondContact O-N 3.38Å; V157-A160 WeakPolarHBondContact O-CB 3.39Å; V157-A160 PolarHBondContact O-N 2.86Å; V157-I161 HydrophobicContact CG1-CD1 3.94Å; V157-I161 HydrophobicContact CG1-CG1 4.39Å; V157-I161 VanDerWaalsContact O-CG1 3.27Å; V157-I161 WeakPolarHBondContact O-CG1 3.17Å; V157-I161 PolarHBondContact O-N 3.48Å
158	T	91.9	Very high	85.1	Confident	1 Å²	1	46.8 Å²	46.8	1%	0.006	27%	0.269	C	S	.	.	H	α-helix	trans	-60.4	-45.7	179.2	-58.2	0	0	0	0	111.4	L118 L124 P128 I131 A154 F155 I161 V162	L118-T158 HydrophobicContact CD1-CG2 3.4Å; L124-T158 HydrophobicContact CD1-CG2 4.08Å; L124-T158 HydrophobicContact CD2-CG2 4.07Å; P128-T158 HydrophobicContact CG-CG2 4.4Å; P128-T158 WeakPolarHBondContact CG-OG1 3.47Å; I131-T158 HydrophobicContact CG2-CG2 4.24Å; I131-T158 WeakPolarHBondContact CG2-OG1 3.3Å; A154-T158 WeakPolarHBondContact O-CB 3.31Å; A154-T158 PolarHBondContact O-N 3.49Å; A154-T158 VanDerWaalsContact O-N 3.1Å; A154-T158 PolarHBondContact O-OG1 2.84Å; F155-T158 PolarHBondContact O-N 3.43Å; T158-I161 PolarHBondContact O-N 3.22Å; T158-V162 WeakPolarHBondContact O-CG2 3.48Å; T158-V162 PolarHBondContact O-N 2.89Å; T158-V162 VanDerWaalsContact O-N 3.15Å
159	M	93.2	Very high	85.3	Confident	18 Å²	18	47.1 Å²	47.1	9%	0.089	25%	0.254	C	S	.	.	H	α-helix	trans	-67.5	-37.2	176.3	-78	-54.5	-46.7	0	0	112.8	L123 L124 F155 Q156 V157 I161 V162 Q163	L123-M159 HydrophobicContact CD2-CE 4.38Å; L124-M159 HydrophobicContact CB-CG 4.21Å; L124-M159 HydrophobicContact CB-SD 3.6Å; F155-M159 HydrophobicContact CD1-CG 4.17Å; F155-M159 HydrophobicContact CE1-CG 3.74Å; F155-M159 HydrophobicContact CZ-CG 3.93Å; F155-M159 WeakPolarHBondContact O-CB 3.49Å; F155-M159 PolarHBondContact O-N 2.78Å; Q156-M159 PolarHBondContact O-N 2.86Å; V157-M159 VanDerWaalsContact C-N 3.35Å; V157-M159 PolarHBondContact O-N 3.38Å; M159-I161 VanDerWaalsContact C-N 3.32Å; M159-I161 PolarHBondContact O-N 2.89Å; M159-V162 PolarHBondContact O-N 3.34Å; M159-Q163 HydrophobicContact CE-CG 4.43Å; M159-Q163 WeakPolarHBondContact O-CB 3.49Å; M159-Q163 VanDerWaalsContact O-CG 3.31Å; M159-Q163 WeakPolarHBondContact O-CG 2.98Å; M159-Q163 PolarHBondContact O-N 3.32Å
160	A	92.1	Very high	84.8	Confident	9 Å²	9	46.1 Å²	46.1	7%	0.074	24%	0.24	C	C	.	.	H	α-helix	trans	-60.4	-42.3	174.7	0	0	0	0	0	111.4	L52 A53 C72 Q156 V157 V162 Q163 A164	L52-A160 HydrophobicContact CB-CB 4.29Å; A53-A160 HydrophobicContact CB-CB 3.51Å; C72-A160 HydrophobicContact CB-CB 4.39Å; Q156-A160 VanDerWaalsContact O-CB 3.3Å; Q156-A160 WeakPolarHBondContact O-CB 3.41Å; Q156-A160 PolarHBondContact O-N 3.16Å; V157-A160 WeakPolarHBondContact O-CB 3.39Å; V157-A160 PolarHBondContact O-N 2.86Å; A160-V162 PolarHBondContact O-N 3.04Å; A160-Q163 PolarHBondContact O-N 3.39Å; A160-A164 WeakPolarHBondContact O-CB 3.45Å; A160-A164 PolarHBondContact O-N 3.5Å
161	I	92.2	Very high	83.5	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-61.4	-45.5	175.5	-63.1	166.5	0	0	0	110.6	C72 V77 I103 L106 I131 I133 V157 T158 M159 Q163 A164 R165	C72-I161 HydrophobicContact CB-CG1 3.86Å; C72-I161 VanDerWaalsContact SG-CG1 3.55Å; V77-I161 HydrophobicContact CG1-CD1 4.09Å; V77-I161 HydrophobicContact CG2-CD1 4.01Å; V77-I161 HydrophobicContact CG2-CG1 3.74Å; V77-I161 HydrophobicContact CG2-CG2 4.08Å; I103-I161 HydrophobicContact CD1-CG2 4.2Å; L106-I161 HydrophobicContact CD2-CB 4.41Å; L106-I161 HydrophobicContact CD2-CG2 3.8Å; I131-I161 HydrophobicContact CD1-CD1 4.3Å; I133-I161 HydrophobicContact CD1-CD1 4.37Å; V157-I161 HydrophobicContact CG1-CD1 3.94Å; V157-I161 HydrophobicContact CG1-CG1 4.39Å; V157-I161 VanDerWaalsContact O-CG1 3.27Å; V157-I161 WeakPolarHBondContact O-CG1 3.17Å; V157-I161 PolarHBondContact O-N 3.48Å; T158-I161 PolarHBondContact O-N 3.22Å; M159-I161 VanDerWaalsContact C-N 3.32Å; M159-I161 PolarHBondContact O-N 2.89Å; I161-Q163 PolarHBondContact O-N 3.36Å; I161-A164 PolarHBondContact O-N 3.5Å; I161-R165 HydrophobicContact CG2-CG 4.49Å; I161-R165 WeakPolarHBondContact O-CB 3.37Å; I161-R165 VanDerWaalsContact O-CG 3.25Å; I161-R165 WeakPolarHBondContact O-CG 3.29Å; I161-R165 PolarHBondContact O-N 3.41Å
162	V	91.3	Very high	82	Confident	2 Å²	2	47.7 Å²	47.7	1%	0.012	25%	0.252	C	S	.	.	H	α-helix	trans	-62.9	-43.4	179.4	174.6	0	0	0	0	111.7	L106 L118 T158 M159 A160 A166	L106-V162 HydrophobicContact CD2-CG2 3.8Å; L118-V162 HydrophobicContact CB-CG2 3.9Å; L118-V162 HydrophobicContact CD1-CG2 4.03Å; L118-V162 HydrophobicContact CG-CG2 4.44Å; T158-V162 WeakPolarHBondContact O-CG2 3.48Å; T158-V162 PolarHBondContact O-N 2.89Å; T158-V162 VanDerWaalsContact O-N 3.15Å; M159-V162 PolarHBondContact O-N 3.34Å; A160-V162 PolarHBondContact O-N 3.04Å; V162-A166 PolarHBondContact O-N 2.9Å; V162-A166 VanDerWaalsContact O-N 3.14Å
163	Q	90.4	Very high	80.4	Confident	105 Å²	105	45.1 Å²	45.1	49%	0.491	23%	0.234	S	C	.	.	H	α-helix	trans	-67.9	-45	178.5	-71.5	174.1	-5	0	0	111.7	M159 A160 I161 R165 A166 Q167	M159-Q163 HydrophobicContact CE-CG 4.43Å; M159-Q163 WeakPolarHBondContact O-CB 3.49Å; M159-Q163 VanDerWaalsContact O-CG 3.31Å; M159-Q163 WeakPolarHBondContact O-CG 2.98Å; M159-Q163 PolarHBondContact O-N 3.32Å; A160-Q163 PolarHBondContact O-N 3.39Å; I161-Q163 PolarHBondContact O-N 3.36Å; Q163-R165 VanDerWaalsContact C-N 3.29Å; Q163-R165 PolarHBondContact O-N 2.93Å; Q163-A166 WeakPolarHBondContact O-CB 2.83Å; Q163-A166 PolarHBondContact O-N 2.83Å; Q163-Q167 WeakPolarHBondContact O-CG 3.27Å; Q163-Q167 PolarHBondContact O-N 3.49Å
164	A	87.6	Confident	78.7	Confident	5 Å²	5	42.7 Å²	42.7	4%	0.041	22%	0.223	C	C	.	.	H	α-helix	trans	-60.4	-39.8	177.6	0	0	0	0	0	111.5	L52 L100 A160 I161 A166 Q167 S168	L52-A164 HydrophobicContact CD1-CB 3.64Å; L100-A164 HydrophobicContact CD1-CB 3.7Å; L100-A164 HydrophobicContact CD2-CB 4.09Å; A160-A164 WeakPolarHBondContact O-CB 3.45Å; A160-A164 PolarHBondContact O-N 3.5Å; I161-A164 PolarHBondContact O-N 3.5Å; A164-A166 VanDerWaalsContact C-N 3.34Å; A164-A166 PolarHBondContact O-N 3.3Å; A164-Q167 PolarHBondContact O-N 3.48Å; A164-S168 VanDerWaalsContact O-CB 3.24Å; A164-S168 WeakPolarHBondContact O-CB 3.41Å; A164-S168 PolarHBondContact O-N 3.03Å
165	R	86.6	Confident	76.8	Confident	33 Å²	33	46.2 Å²	46.2	13%	0.125	25%	0.247	C	C	.	.	H	α-helix	trans	-67.9	-28.6	173.7	-71.7	176.6	73.6	-149.3	5.6	113.8	L100 I103 L118 I161 Q163 S168	L100-R165 HydrophobicContact CB-CG 4.46Å; L100-R165 HydrophobicContact CD2-CG 4.06Å; I103-R165 PolarHBondContact O-NH2 2.96Å; L118-R165 PolarHBondContact O-NH1 2.63Å; I161-R165 HydrophobicContact CG2-CG 4.49Å; I161-R165 WeakPolarHBondContact O-CB 3.37Å; I161-R165 VanDerWaalsContact O-CG 3.25Å; I161-R165 WeakPolarHBondContact O-CG 3.29Å; I161-R165 PolarHBondContact O-N 3.41Å; Q163-R165 VanDerWaalsContact C-N 3.29Å; Q163-R165 PolarHBondContact O-N 2.93Å; R165-S168 WeakPolarHBondContact CA-OG 3.44Å; R165-S168 PolarHBondContact O-OG 3.14Å
166	A	84.4	Confident	74.7	Confident	59 Å²	59	43.4 Å²	43.4	49%	0.488	24%	0.242	S	C	.	.	H	α-helix	trans	-76.5	-31.5	175.4	0	0	0	0	0	112.1	P120 V162 Q163 A164	P120-A166 HydrophobicContact CB-CB 4.02Å; V162-A166 PolarHBondContact O-N 2.9Å; V162-A166 VanDerWaalsContact O-N 3.14Å; Q163-A166 WeakPolarHBondContact O-CB 2.83Å; Q163-A166 PolarHBondContact O-N 2.83Å; A164-A166 VanDerWaalsContact C-N 3.34Å; A164-A166 PolarHBondContact O-N 3.3Å
167	Q	79.3	Confident	72.7	Confident	145 Å²	145	38.3 Å²	38.3	68%	0.678	22%	0.219	S	C	*	.	H	α-helix	trans	-92.1	-13.5	179.7	-64.8	173.4	10.4	0	0	113	Q163 A164 N169	Q163-Q167 WeakPolarHBondContact O-CG 3.27Å; Q163-Q167 PolarHBondContact O-N 3.49Å; A164-Q167 PolarHBondContact O-N 3.48Å; Q167-N169 PolarHBondContact O-N 3.4Å
168	S	70.6	Confident	70.5	Confident	28 Å²	28	40.7 Å²	40.7	20%	0.196	23%	0.233	C	C	.	.			trans	-68	94.9	-179.9	62.1	0	0	0	0	110.3	A164 R165	A164-S168 VanDerWaalsContact O-CB 3.24Å; A164-S168 WeakPolarHBondContact O-CB 3.41Å; A164-S168 PolarHBondContact O-N 3.03Å; R165-S168 WeakPolarHBondContact CA-OG 3.44Å; R165-S168 PolarHBondContact O-OG 3.14Å
169	N	64.4	Low	68.3	Low	75 Å²	75	48 Å²	48	40%	0.401	27%	0.272	S	S	.	.			trans	-88.2	116.5	163.2	-172.2	-21.4	0	0	0	108	Q167 A171 Q172 Q173	Q167-N169 PolarHBondContact O-N 3.4Å; N169-A171 PolarHBondContact O-N 2.83Å; N169-A171 WeakPolarHBondContact OD1-CB 3.38Å; N169-A171 PolarHBondContact OD1-N 2.68Å; N169-Q172 HydrophobicContact CB-CB 4.27Å; N169-Q172 HydrophobicContact CB-CG 4.21Å; N169-Q172 PolarHBondContact O-N 2.95Å; N169-Q173 PolarHBondContact O-N 3.49Å
170	P	57.9	Low	66	Low	22 Å²	22	48.8 Å²	48.8	14%	0.143	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-23.3	177.8	16.7	-26.1	0	0	0	112.1	V101 Y174 L419 L475	V101-P170 HydrophobicContact CG1-CB 4.44Å; P170-Y174 WeakPolarHBondContact O-CD2 3.46Å; P170-Y174 WeakPolarHBondContact O-CE2 3Å; P170-L419 HydrophobicContact CB-CD1 4.13Å; P170-L419 HydrophobicContact CG-CD1 4.07Å; P170-L475 HydrophobicContact CB-CD1 4.21Å
171	A	51.3	Low	63.9	Low	35 Å²	35	49.5 Å²	49.5	29%	0.289	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-26.1	175.8	0	0	0	0	0	115.2	N169	N169-A171 PolarHBondContact O-N 2.83Å; N169-A171 WeakPolarHBondContact OD1-CB 3.38Å; N169-A171 PolarHBondContact OD1-N 2.68Å
172	Q	52.4	Low	61.6	Low	138 Å²	138	51 Å²	51	65%	0.645	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88	-24.1	-177.7	-73.3	-178.1	-21.3	0	0	113	N169 Y174	N169-Q172 HydrophobicContact CB-CB 4.27Å; N169-Q172 HydrophobicContact CB-CG 4.21Å; N169-Q172 PolarHBondContact O-N 2.95Å; Q172-Y174 PolarHBondContact O-N 3.14Å
173	Q	53.4	Low	59.2	Low	11 Å²	11	54.3 Å²	54.3	5%	0.051	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-27.1	178	-79.2	179.1	-22.6	0	0	112.8	F75 N169	F75-Q173 HydrophobicContact CD1-CB 4.05Å; F75-Q173 HydrophobicContact CD1-CG 3.89Å; F75-Q173 HydrophobicContact CE1-CB 3.54Å; F75-Q173 HydrophobicContact CE1-CG 3.7Å; F75-Q173 WeakPolarHBondContact CE1-O 3.33Å; F75-Q173 WeakPolarHBondContact CZ-O 3.49Å; N169-Q173 PolarHBondContact O-N 3.49Å
174	Y	52.8	Low	57	Low	11 Å²	11	56.9 Å²	56.9	4%	0.043	34%	0.339	C	S	.	.	H	α-helix	trans	-79	-24.5	-173.4	-74.6	-90.4	0	0	0	115.5	P170 Q172 G176 T178 P469 T471 L472 L475	P170-Y174 WeakPolarHBondContact O-CD2 3.46Å; P170-Y174 WeakPolarHBondContact O-CE2 3Å; Q172-Y174 PolarHBondContact O-N 3.14Å; Y174-G176 PolarHBondContact O-N 3.5Å; Y174-T178 PolarHBondContact O-N 3.48Å; Y174-T178 PolarHBondContact O-OG1 3.03Å; Y174-P469 HydrophobicContact CE1-CB 4.46Å; Y174-P469 VanDerWaalsContact CE1-O 3.24Å; Y174-P469 WeakPolarHBondContact CE1-O 3.37Å; Y174-P469 HydrophobicContact CE2-CB 3.66Å; Y174-P469 VanDerWaalsContact CZ-CB 3.48Å; Y174-P469 VanDerWaalsContact CZ-O 3.22Å; Y174-P469 WeakPolarHBondContact OH-CA 3.4Å; Y174-P469 WeakPolarHBondContact OH-CB 3.44Å; Y174-T471 VanDerWaalsContact CE1-O 3.25Å; Y174-T471 WeakPolarHBondContact CE1-O 3.47Å; Y174-T471 PolarHBondContact OH-O 3.37Å; Y174-L472 HydrophobicContact CD1-CD2 3.64Å; Y174-L472 HydrophobicContact CD1-CG 4.42Å; Y174-L472 HydrophobicContact CE1-CD2 4.24Å; Y174-L472 HydrophobicContact CG-CD2 4.23Å; Y174-L475 HydrophobicContact CD1-CD2 3.5Å; Y174-L475 VanDerWaalsContact CD1-CD2 3.5Å; Y174-L475 HydrophobicContact CD1-CG 4.47Å; Y174-L475 HydrophobicContact CD2-CD1 3.84Å; Y174-L475 HydrophobicContact CD2-CD2 3.08Å; Y174-L475 HydrophobicContact CD2-CG 3.91Å; Y174-L475 HydrophobicContact CE1-CB 3.89Å; Y174-L475 HydrophobicContact CE1-CD1 4.34Å; Y174-L475 HydrophobicContact CE1-CD2 3.47Å; Y174-L475 VanDerWaalsContact CE1-CD2 3.47Å; Y174-L475 HydrophobicContact CE1-CG 3.97Å; Y174-L475 HydrophobicContact CE2-CB 4.12Å; Y174-L475 HydrophobicContact CE2-CD1 2.98Å; Y174-L475 HydrophobicContact CE2-CD2 3.08Å; Y174-L475 HydrophobicContact CE2-CG 3.37Å; Y174-L475 HydrophobicContact CG-CD2 3.25Å; Y174-L475 HydrophobicContact CG-CG 4.39Å; Y174-L475 VanDerWaalsContact OH-CB 3.26Å; Y174-L475 WeakPolarHBondContact OH-CB 3.4Å; Y174-L475 WeakPolarHBondContact OH-CD1 3.44Å; Y174-L475 WeakPolarHBondContact OH-CG 3.48Å
175	S	46.5	Very low	54.9	Low	74 Å²	74	58.7 Å²	58.7	52%	0.517	35%	0.353	S	S	.	.	H	α-helix	trans	-65.6	-29.9	-178.3	-44.2	0	0	0	0	111.8
176	G	46.3	Very low	52.6	Low	25 Å²	25	63.5 Å²	63.5	26%	0.258	39%	0.392	S	S	.	.	H	α-helix	trans	-82.1	-36	-177.6	0	0	0	0	0	114.8	Y174 S180	Y174-G176 PolarHBondContact O-N 3.5Å; G176-S180 PolarHBondContact O-OG 2.89Å
177	I	49.8	Very low	50.6	Low	9 Å²	9	62.8 Å²	62.8	5%	0.046	39%	0.391	C	S	.	.	H	α-helix	trans	-80.6	-35.9	-172.9	-59	172.8	0	0	0	111.8	F75 S180 K181	F75-I177 HydrophobicContact CD1-CD1 4.22Å; F75-I177 HydrophobicContact CE1-CD1 3.93Å; F75-I177 HydrophobicContact CE1-CG1 4.19Å; F75-I177 HydrophobicContact CZ-CG1 4.31Å; I177-S180 PolarHBondContact O-OG 3.1Å; I177-K181 HydrophobicContact CG2-CD 4.1Å
178	T	47	Very low	49	Very low	50 Å²	50	61.6 Å²	61.6	31%	0.307	40%	0.399	S	S	.	.	H	α-helix	trans	-76.4	-37.6	-175.5	-41.6	0	0	0	0	112.5	Y174 S180	Y174-T178 PolarHBondContact O-N 3.48Å; Y174-T178 PolarHBondContact O-OG1 3.03Å; T178-S180 VanDerWaalsContact C-N 3.26Å; T178-S180 PolarHBondContact O-N 2.93Å
179	L	44.2	Very low	48.3	Very low	155 Å²	155	67.1 Å²	67.1	81%	0.812	42%	0.415	S	S	*	.	H	α-helix	trans	-71.1	-19.3	-173.7	-121.8	110.5	0	0	0	114.2
180	S	45.2	Very low	47.8	Very low	33 Å²	33	72 Å²	72	23%	0.231	43%	0.433	C	S	.	.	H	α-helix	trans	-110.8	-34.7	-166.2	51.9	0	0	0	0	113.1	P47 G176 I177 T178 A182 G183	P47-S180 WeakPolarHBondContact CB-OG 3.38Å; G176-S180 PolarHBondContact O-OG 2.89Å; I177-S180 PolarHBondContact O-OG 3.1Å; T178-S180 VanDerWaalsContact C-N 3.26Å; T178-S180 PolarHBondContact O-N 2.93Å; S180-A182 VanDerWaalsContact C-N 3.32Å; S180-G183 PolarHBondContact O-N 3.48Å
181	K	48.3	Very low	48	Very low	25 Å²	25	73 Å²	73	11%	0.109	44%	0.439	C	S	.	.	H	α-helix	trans	-73.6	-23	175.1	-72.7	-178.3	176.6	176.4	0	113.4	L92 I177 G183 Q184 A185 L513	L92-K181 VanDerWaalsContact CD2-NZ 3.31Å; I177-K181 HydrophobicContact CG2-CD 4.1Å; K181-G183 PolarHBondContact O-N 2.84Å; K181-Q184 PolarHBondContact O-N 3.45Å; K181-A185 PolarHBondContact O-N 2.86Å; K181-L513 HydrophobicContact CB-CD1 3.79Å; K181-L513 HydrophobicContact CD-CD1 3.92Å
182	A	43.5	Very low	48.9	Very low	31 Å²	31	74.6 Å²	74.6	26%	0.256	45%	0.447	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-21.6	168.5	0	0	0	0	0	112.8	S180 L511	S180-A182 VanDerWaalsContact C-N 3.32Å; A182-L511 HydrophobicContact CB-CB 3.98Å; A182-L511 HydrophobicContact CB-CD1 3.69Å; A182-L511 HydrophobicContact CB-CG 4.42Å; A182-L511 WeakPolarHBondContact O-CD1 3.44Å
183	G	41.8	Very low	50.3	Low	71 Å²	71	68.1 Å²	68.1	73%	0.732	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.9	-16.2	177.7	0	0	0	0	0	115.2	S180 K181	S180-G183 PolarHBondContact O-N 3.48Å; K181-G183 PolarHBondContact O-N 2.84Å
184	Q	43.2	Very low	51.8	Low	160 Å²	160	68.9 Å²	68.9	75%	0.748	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.5	-27.1	-177.1	-75.6	-177.8	-21.7	0	0	113.4	K181 S186	K181-Q184 PolarHBondContact O-N 3.45Å; Q184-S186 PolarHBondContact O-N 2.65Å
185	A	43.8	Very low	53.5	Low	42 Å²	42	69.2 Å²	69.2	35%	0.347	43%	0.425	S	S	.	.			trans	-88.9	88.2	173.4	0	0	0	0	0	110.1	K181 G187 L511	K181-A185 PolarHBondContact O-N 2.86Å; A185-G187 VanDerWaalsContact C-N 3.27Å; A185-G187 PolarHBondContact O-N 3.02Å; A185-L511 HydrophobicContact CB-CD2 3.85Å
186	S	38.2	Very low	55.5	Low	134 Å²	134	66.1 Å²	66.1	94%	0.937	40%	0.402	S	S	*	.			trans	-69.1	85.1	168.1	-173.7	0	0	0	0	109.4	Q184	Q184-S186 PolarHBondContact O-N 2.65Å
187	G	42.5	Very low	57.4	Low	45 Å²	45	67 Å²	67	46%	0.464	40%	0.399	S	S	.	.	S	Bend	trans	162.1	140.4	174.2	0	0	0	0	0	113.9	A185 R189	A185-G187 VanDerWaalsContact C-N 3.27Å; A185-G187 PolarHBondContact O-N 3.02Å; G187-R189 PolarHBondContact O-N 3.48Å
188	S	46.3	Very low	59.3	Low	120 Å²	120	69.1 Å²	69.1	84%	0.839	41%	0.413	S	S	*	.			trans	-63.1	82.8	164.6	149.9	0	0	0	0	109	K190	S188-K190 PolarHBondContact O-N 3.18Å
189	R	55	Low	61.4	Low	144 Å²	144	68.5 Å²	68.5	54%	0.543	41%	0.413	S	S	.	.			trans	-81.3	107.1	175.7	-161	175.9	-174.5	171.7	0.6	108.4	G187 D519	G187-R189 PolarHBondContact O-N 3.48Å; R189-D519 IonicContact CZ-OD1 2.68Å; R189-D519 IonicContact CZ-OD2 3.36Å; R189-D519 IonicContact NH1-OD1 3.88Å; R189-D519 PolarHBondContact NH1-OD1 2.82Å; R189-D519 IonicContact NH1-OD2 3.83Å; R189-D519 PolarHBondContact NH1-OD2 3.4Å; R189-D519 IonicContact NH2-OD1 3.7Å; R189-D519 PolarHBondContact NH2-OD1 3.29Å; R189-D519 IonicContact NH2-OD2 2.91Å; R189-D519 PolarHBondContact NH2-OD2 3.23Å
190	K	54.9	Low	63.7	Low	178 Å²	178	68.4 Å²	68.4	77%	0.774	41%	0.408	S	S	*	.			trans	-68.6	134	167.8	-73.6	-173.9	177.9	-175.5	0	107.7	S188	S188-K190 PolarHBondContact O-N 3.18Å
191	P	61.7	Low	65.9	Low	42 Å²	42	68.6 Å²	68.6	27%	0.273	41%	0.407	S	S	.	.			trans	-59.8	148.8	176.1	25.2	-32.3	0	0	0	109.3	V193 L195	P191-V193 PolarHBondContact O-N 3.49Å; P191-V193 VanDerWaalsContact O-N 3.11Å; P191-L195 HydrophobicContact CB-CD1 4.43Å; P191-L195 HydrophobicContact CB-CD2 4.22Å; P191-L195 HydrophobicContact CB-CG 4.23Å; P191-L195 HydrophobicContact CG-CD1 3.86Å; P191-L195 HydrophobicContact CG-CD2 4.24Å; P191-L195 HydrophobicContact CG-CG 3.71Å
192	P	69.9	Low	68.1	Low	69 Å²	69	68 Å²	68	45%	0.448	40%	0.404	S	S	.	.	S	Bend	trans	-65.4	-16	-177.1	26.1	-33.9	0	0	0	112.7	F401 W516	P192-F401 WeakPolarHBondContact O-CE2 3.47Å; P192-W516 HydrophobicContact CG-CB 3.69Å; P192-W516 WeakPolarHBondContact CG-O 3.27Å
193	V	82.9	Confident	70.6	Confident	2 Å²	2	69 Å²	69	1%	0.012	40%	0.403	C	S	.	.	S	Bend	trans	-129.4	140.8	-177	171.3	0	0	0	0	109.3	P191 L195 F401 Q404 Q408 W516	P191-V193 PolarHBondContact O-N 3.49Å; P191-V193 VanDerWaalsContact O-N 3.11Å; V193-L195 PolarHBondContact O-N 3.45Å; V193-F401 HydrophobicContact CG2-CD2 4.04Å; V193-F401 HydrophobicContact CG2-CE2 4.1Å; V193-Q404 HydrophobicContact CG2-CB 3.69Å; V193-Q408 HydrophobicContact CG1-CB 4.23Å; V193-W516 HydrophobicContact CB-CG 4.29Å; V193-W516 HydrophobicContact CG2-CG 4.47Å
194	P	84.6	Confident	73	Confident	26 Å²	26	68.9 Å²	68.9	17%	0.169	39%	0.388	C	S	.	.			trans	-60.4	123	175.5	24.4	-33.7	0	0	0	110.8	M196 D201 E205 Q408	P194-M196 HydrophobicContact CB-SD 4.42Å; P194-M196 PolarHBondContact O-N 2.83Å; P194-D201 HydrophobicContact CB-CB 4.14Å; P194-E205 HydrophobicContact CG-CG 4.2Å; P194-Q408 WeakPolarHBondContact O-CG 2.97Å
195	L	87.1	Confident	75.3	Confident	18 Å²	18	61.8 Å²	61.8	9%	0.094	36%	0.355	C	S	.	.			trans	-74.8	-5.7	-177.7	-62.1	-178.1	0	0	0	113.6	P191 V193 E197 Q408 Q512	P191-L195 HydrophobicContact CB-CD1 4.43Å; P191-L195 HydrophobicContact CB-CD2 4.22Å; P191-L195 HydrophobicContact CB-CG 4.23Å; P191-L195 HydrophobicContact CG-CD1 3.86Å; P191-L195 HydrophobicContact CG-CD2 4.24Å; P191-L195 HydrophobicContact CG-CG 3.71Å; V193-L195 PolarHBondContact O-N 3.45Å; L195-E197 VanDerWaalsContact C-N 3.3Å; L195-E197 HydrophobicContact CB-CG 4.06Å; L195-E197 PolarHBondContact O-N 3.09Å; L195-Q408 PolarHBondContact O-NE2 3.28Å; L195-Q512 HydrophobicContact CD1-CG 3.98Å
196	M	90	Very high	77.6	Confident	10 Å²	10	61.4 Å²	61.4	5%	0.049	35%	0.345	C	S	.	.	S	Bend	trans	62.5	35.9	178.9	-55.7	-62.1	-81.3	0	0	112.8	P194 D201 W202 E205 W234 Q408 R409 A413	P194-M196 HydrophobicContact CB-SD 4.42Å; P194-M196 PolarHBondContact O-N 2.83Å; M196-D201 HydrophobicContact SD-CB 4.1Å; M196-W202 HydrophobicContact CB-CZ2 4.08Å; M196-W202 HydrophobicContact CE-CD2 3.4Å; M196-W202 HydrophobicContact CE-CE3 3.48Å; M196-W202 VanDerWaalsContact CE-CE3 3.48Å; M196-W202 HydrophobicContact CE-CG 3.87Å; M196-W202 HydrophobicContact CE-CH2 4.05Å; M196-W202 HydrophobicContact CE-CZ2 3.97Å; M196-W202 HydrophobicContact CE-CZ3 3.81Å; M196-W202 PolarHBondContact O-NE1 2.76Å; M196-E205 HydrophobicContact CE-CB 4.16Å; M196-E205 HydrophobicContact CE-CG 4.03Å; M196-E205 HydrophobicContact SD-CB 4.39Å; M196-E205 HydrophobicContact SD-CG 3.68Å; M196-W234 HydrophobicContact CE-CZ2 4.47Å; M196-Q408 HydrophobicContact CG-CG 4.39Å; M196-R409 HydrophobicContact CE-CG 3.96Å; M196-A413 HydrophobicContact CB-CB 3.72Å; M196-A413 HydrophobicContact CG-CB 4.39Å
197	E	86.1	Confident	80.1	Confident	42 Å²	42	61.4 Å²	61.4	20%	0.196	33%	0.328	C	S	.	.			trans	-102.2	-22.7	-178.5	-62.8	-164.1	163.1	0	0	113.1	L195 D201 Y232 Q512	L195-E197 VanDerWaalsContact C-N 3.3Å; L195-E197 HydrophobicContact CB-CG 4.06Å; L195-E197 PolarHBondContact O-N 3.09Å; E197-D201 PolarHBondContact N-OD2 3Å; E197-Y232 WeakPolarHBondContact O-CE2 3.29Å; E197-Q512 PolarHBondContact OE1-NE2 3.2Å; E197-Q512 PolarHBondContact OE2-NE2 2.86Å; E197-Q512 PolarHBondContact OE2-OE1 2.69Å
198	T	89.2	Confident	82.3	Confident	55 Å²	55	64 Å²	64	34%	0.337	33%	0.326	S	S	.	.	S	Bend	trans	-110.1	152	-179.7	70.2	0	0	0	0	111.3	E200 D201 W202	T198-E200 PolarHBondContact O-N 3Å; T198-D201 PolarHBondContact N-OD2 3.04Å; T198-D201 VanDerWaalsContact N-OD2 3.13Å; T198-D201 WeakPolarHBondContact O-CB 3.24Å; T198-D201 PolarHBondContact O-N 2.7Å; T198-D201 VanDerWaalsContact O-N 3.16Å; T198-D201 PolarHBondContact OG1-N 3.48Å; T198-D201 PolarHBondContact OG1-OD1 2.91Å; T198-D201 PolarHBondContact OG1-OD2 3.26Å; T198-W202 VanDerWaalsContact O-CD1 3.28Å; T198-W202 PolarHBondContact O-N 2.98Å
199	A	91.8	Very high	84.2	Confident	36 Å²	36	59.2 Å²	59.2	30%	0.298	29%	0.291	S	S	.	.	H	α-helix	trans	-59.2	-29.2	176	0	0	0	0	0	112.6	W202 E203 Y232	A199-W202 PolarHBondContact O-N 3.41Å; A199-E203 WeakPolarHBondContact O-CB 3.42Å; A199-E203 PolarHBondContact O-N 2.94Å; A199-Y232 HydrophobicContact CB-CD1 4.05Å; A199-Y232 HydrophobicContact CB-CD2 4.32Å; A199-Y232 HydrophobicContact CB-CE1 3.94Å; A199-Y232 HydrophobicContact CB-CE2 4.21Å; A199-Y232 HydrophobicContact CB-CG 4.24Å; A199-Y232 VanDerWaalsContact N-CE2 3.32Å
200	E	91.7	Very high	85.7	Confident	153 Å²	153	55 Å²	55	72%	0.715	29%	0.287	S	S	*	.	H	α-helix	trans	-66.8	-38.9	177.2	-64.3	179.6	-176.1	0	0	112.6	T198 W202 E203 T204	T198-E200 PolarHBondContact O-N 3Å; E200-W202 VanDerWaalsContact C-N 3.34Å; E200-E203 PolarHBondContact O-N 3.4Å; E200-T204 WeakPolarHBondContact O-CB 3.07Å; E200-T204 PolarHBondContact O-N 2.9Å; E200-T204 PolarHBondContact O-OG1 3.35Å
201	D	92.1	Very high	87.4	Confident	37 Å²	37	46.6 Å²	46.6	20%	0.198	25%	0.25	C	S	.	.	H	α-helix	trans	-59	-48.9	174.2	-62.8	-38.3	0	0	0	110.2	P194 M196 E197 T198 E203 T204 E205	P194-D201 HydrophobicContact CB-CB 4.14Å; M196-D201 HydrophobicContact SD-CB 4.1Å; E197-D201 PolarHBondContact N-OD2 3Å; T198-D201 PolarHBondContact N-OD2 3.04Å; T198-D201 VanDerWaalsContact N-OD2 3.13Å; T198-D201 WeakPolarHBondContact O-CB 3.24Å; T198-D201 PolarHBondContact O-N 2.7Å; T198-D201 VanDerWaalsContact O-N 3.16Å; T198-D201 PolarHBondContact OG1-N 3.48Å; T198-D201 PolarHBondContact OG1-OD1 2.91Å; T198-D201 PolarHBondContact OG1-OD2 3.26Å; D201-E203 VanDerWaalsContact C-N 3.34Å; D201-E203 PolarHBondContact O-N 2.8Å; D201-T204 PolarHBondContact O-N 3.43Å; D201-E205 PolarHBondContact O-N 3.01Å
202	W	94.4	Very high	88.6	Confident	13 Å²	13	54.5 Å²	54.5	5%	0.049	28%	0.275	C	S	.	.	H	α-helix	trans	-64.5	-36.9	179.6	-74.5	85.1	0	0	0	112.5	M196 T198 A199 E200 R206 V216 P230 Y232 F233 W234 A413	M196-W202 HydrophobicContact CB-CZ2 4.08Å; M196-W202 HydrophobicContact CE-CD2 3.4Å; M196-W202 HydrophobicContact CE-CE3 3.48Å; M196-W202 VanDerWaalsContact CE-CE3 3.48Å; M196-W202 HydrophobicContact CE-CG 3.87Å; M196-W202 HydrophobicContact CE-CH2 4.05Å; M196-W202 HydrophobicContact CE-CZ2 3.97Å; M196-W202 HydrophobicContact CE-CZ3 3.81Å; M196-W202 PolarHBondContact O-NE1 2.76Å; T198-W202 VanDerWaalsContact O-CD1 3.28Å; T198-W202 PolarHBondContact O-N 2.98Å; A199-W202 PolarHBondContact O-N 3.41Å; E200-W202 VanDerWaalsContact C-N 3.34Å; W202-R206 WeakPolarHBondContact O-CB 3.24Å; W202-R206 PolarHBondContact O-N 3.19Å; W202-V216 HydrophobicContact CB-CG1 4.09Å; W202-V216 HydrophobicContact CB-CG2 3.92Å; W202-P230 HydrophobicContact CH2-CB 4.32Å; W202-P230 HydrophobicContact CH2-CG 3.94Å; W202-P230 HydrophobicContact CZ2-CB 3.69Å; W202-P230 HydrophobicContact CZ2-CG 3.83Å; W202-Y232 WeakPolarHBondContact CH2-O 3.17Å; W202-Y232 WeakPolarHBondContact CZ2-O 3.49Å; W202-F233 HydrophobicContact CZ3-CB 4.42Å; W202-W234 HydrophobicContact CE3-CD2 4.2Å; W202-W234 AromaticContact CE3-CE2 3.79Å; W202-W234 AromaticContact CE3-CZ2 4Å; W202-W234 HydrophobicContact CE3-CZ2 4Å; W202-W234 AromaticContact CE3-NE1 3.93Å; W202-W234 HydrophobicContact CZ3-CD2 4.48Å; W202-W234 WeakPolarHBondContact O-CZ2 3.48Å; W202-W234 PolarHBondContact O-NE1 2.86Å; W202-A413 HydrophobicContact CZ2-CB 4.05Å
203	E	94.6	Very high	89.6	Confident	51 Å²	51	53.5 Å²	53.5	24%	0.238	28%	0.277	C	S	.	.	H	α-helix	trans	-71.9	-35.9	177.1	-176	56.7	-157.3	0	0	111.8	A199 E200 D201 R206 K207 V216	A199-E203 WeakPolarHBondContact O-CB 3.42Å; A199-E203 PolarHBondContact O-N 2.94Å; E200-E203 PolarHBondContact O-N 3.4Å; D201-E203 VanDerWaalsContact C-N 3.34Å; D201-E203 PolarHBondContact O-N 2.8Å; E203-R206 PolarHBondContact O-N 3.49Å; E203-R206 IonicContact OE1-CZ 2.68Å; E203-R206 IonicContact OE1-NE 3.21Å; E203-R206 PolarHBondContact OE1-NE 3.32Å; E203-R206 IonicContact OE1-NH2 2.89Å; E203-R206 PolarHBondContact OE1-NH2 2.94Å; E203-R206 IonicContact OE2-CZ 3.37Å; E203-R206 IonicContact OE2-NE 3.36Å; E203-R206 PolarHBondContact OE2-NE 2.76Å; E203-R206 IonicContact OE2-NH2 2.99Å; E203-K207 WeakPolarHBondContact O-CG 3.45Å; E203-K207 PolarHBondContact O-N 3.14Å; E203-K207 VanDerWaalsContact OE1-CE 3.23Å; E203-K207 WeakPolarHBondContact OE1-CE 3.24Å; E203-V216 HydrophobicContact CB-CG2 4.14Å; E203-V216 WeakPolarHBondContact OE2-CG2 3.36Å
204	T	92.2	Very high	90.1	Very high	70 Å²	70	53.7 Å²	53.7	43%	0.429	28%	0.277	S	S	.	.	H	α-helix	trans	-64.7	-48.1	175.5	-58.8	0	0	0	0	110.8	E200 D201 R206 K207 K208	E200-T204 WeakPolarHBondContact O-CB 3.07Å; E200-T204 PolarHBondContact O-N 2.9Å; E200-T204 PolarHBondContact O-OG1 3.35Å; D201-T204 PolarHBondContact O-N 3.43Å; T204-R206 VanDerWaalsContact C-N 3.32Å; T204-R206 PolarHBondContact O-N 3.03Å; T204-K207 PolarHBondContact O-N 3.49Å; T204-K208 WeakPolarHBondContact O-CG 3.32Å; T204-K208 PolarHBondContact O-N 2.89Å; T204-K208 VanDerWaalsContact O-N 3.08Å
205	E	91.5	Very high	90.7	Very high	11 Å²	11	55 Å²	55	5%	0.051	28%	0.279	C	S	.	.	H	α-helix	trans	-63.3	-36.7	176.1	-76.3	-59.8	119.1	0	0	112.6	P194 M196 D201 K207 K208 Q209 W234 R409	P194-E205 HydrophobicContact CG-CG 4.2Å; M196-E205 HydrophobicContact CE-CB 4.16Å; M196-E205 HydrophobicContact CE-CG 4.03Å; M196-E205 HydrophobicContact SD-CB 4.39Å; M196-E205 HydrophobicContact SD-CG 3.68Å; D201-E205 PolarHBondContact O-N 3.01Å; E205-K207 PolarHBondContact O-N 3.39Å; E205-K208 PolarHBondContact O-N 3.03Å; E205-K208 WeakPolarHBondContact OE1-CD 3.4Å; E205-K208 WeakPolarHBondContact OE1-CE 3.23Å; E205-K208 IonicContact OE1-NZ 3.35Å; E205-K208 PolarHBondContact OE1-NZ 3.19Å; E205-Q209 PolarHBondContact O-N 2.87Å; E205-W234 HydrophobicContact CB-CH2 3.99Å; E205-W234 HydrophobicContact CB-CZ2 3.74Å; E205-R409 IonicContact OE2-NH1 3.39Å
206	R	93.1	Very high	91.2	Very high	34 Å²	34	55.3 Å²	55.3	13%	0.128	28%	0.282	C	S	.	.	H	α-helix	trans	-62.1	-42.9	174.7	-167.3	-166.7	68.5	71	4.5	112.2	W202 E203 T204 Q209 A210 A211 W214 W234	W202-R206 WeakPolarHBondContact O-CB 3.24Å; W202-R206 PolarHBondContact O-N 3.19Å; E203-R206 PolarHBondContact O-N 3.49Å; E203-R206 IonicContact OE1-CZ 2.68Å; E203-R206 IonicContact OE1-NE 3.21Å; E203-R206 PolarHBondContact OE1-NE 3.32Å; E203-R206 IonicContact OE1-NH2 2.89Å; E203-R206 PolarHBondContact OE1-NH2 2.94Å; E203-R206 IonicContact OE2-CZ 3.37Å; E203-R206 IonicContact OE2-NE 3.36Å; E203-R206 PolarHBondContact OE2-NE 2.76Å; E203-R206 IonicContact OE2-NH2 2.99Å; T204-R206 VanDerWaalsContact C-N 3.32Å; T204-R206 PolarHBondContact O-N 3.03Å; R206-Q209 PolarHBondContact O-N 3.22Å; R206-A210 PolarHBondContact O-N 3.34Å; R206-A211 HydrophobicContact CG-CB 4Å; R206-A211 PolarHBondContact NH1-O 2.99Å; R206-A211 PolarHBondContact O-N 3.41Å; R206-W214 VanDerWaalsContact CD-O 3.25Å; R206-W214 WeakPolarHBondContact CD-O 3.34Å; R206-W234 HydrophobicContact CB-CZ2 4.05Å
207	K	90.8	Very high	91.5	Very high	133 Å²	133	54.9 Å²	54.9	58%	0.578	28%	0.279	S	S	*	.	H	α-helix	trans	-65.7	-39.9	178.7	-75.5	171.9	-177.8	170.9	0	111.5	E203 T204 E205 Q209 A210	E203-K207 WeakPolarHBondContact O-CG 3.45Å; E203-K207 PolarHBondContact O-N 3.14Å; E203-K207 VanDerWaalsContact OE1-CE 3.23Å; E203-K207 WeakPolarHBondContact OE1-CE 3.24Å; T204-K207 PolarHBondContact O-N 3.49Å; E205-K207 PolarHBondContact O-N 3.39Å; K207-Q209 VanDerWaalsContact C-N 3.32Å; K207-Q209 PolarHBondContact O-N 2.78Å; K207-A210 PolarHBondContact O-N 2.95Å
208	K	87.9	Confident	91.9	Very high	100 Å²	100	56.1 Å²	56.1	44%	0.435	29%	0.29	S	S	.	.	H	α-helix	trans	-57.3	-44.8	174.8	-71.3	178.7	-174.4	172	0	111.8	T204 E205 A210	T204-K208 WeakPolarHBondContact O-CG 3.32Å; T204-K208 PolarHBondContact O-N 2.89Å; T204-K208 VanDerWaalsContact O-N 3.08Å; E205-K208 PolarHBondContact O-N 3.03Å; E205-K208 WeakPolarHBondContact OE1-CD 3.4Å; E205-K208 WeakPolarHBondContact OE1-CE 3.23Å; E205-K208 IonicContact OE1-NZ 3.35Å; E205-K208 PolarHBondContact OE1-NZ 3.19Å; K208-A210 PolarHBondContact O-N 2.88Å
209	Q	86	Confident	92.2	Very high	20 Å²	20	53.8 Å²	53.8	9%	0.093	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	4.3	177.8	-62.9	179.1	42.1	0	0	114.3	E205 R206 K207 A211 H262	E205-Q209 PolarHBondContact O-N 2.87Å; R206-Q209 PolarHBondContact O-N 3.22Å; K207-Q209 VanDerWaalsContact C-N 3.32Å; K207-Q209 PolarHBondContact O-N 2.78Å; Q209-A211 HydrophobicContact CB-CB 4.48Å; Q209-A211 PolarHBondContact O-N 2.65Å; Q209-H262 PolarHBondContact O-CD2 2.87Å
210	A	87.8	Confident	92.4	Very high	56 Å²	56	52.1 Å²	52.1	46%	0.463	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.4	26.9	-175.2	0	0	0	0	0	114.8	R206 K207 K208 R212	R206-A210 PolarHBondContact O-N 3.34Å; K207-A210 PolarHBondContact O-N 2.95Å; K208-A210 PolarHBondContact O-N 2.88Å; A210-R212 PolarHBondContact O-N 3.33Å
211	A	89.2	Confident	92.4	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	24%	0.244	C	C	.	.			trans	-77	64	-173.9	0	0	0	0	0	112.3	R206 Q209 G213 W214 L259 H262	R206-A211 HydrophobicContact CG-CB 4Å; R206-A211 PolarHBondContact NH1-O 2.99Å; R206-A211 PolarHBondContact O-N 3.41Å; Q209-A211 HydrophobicContact CB-CB 4.48Å; Q209-A211 PolarHBondContact O-N 2.65Å; A211-G213 VanDerWaalsContact C-N 3.29Å; A211-G213 PolarHBondContact O-N 3.3Å; A211-W214 HydrophobicContact CB-CB 4.41Å; A211-W214 PolarHBondContact O-N 3.41Å; A211-L259 HydrophobicContact CB-CD2 4.01Å; A211-H262 HydrophobicContact CB-CB 3.71Å
212	R	87.6	Confident	92.3	Very high	209 Å²	209	54 Å²	54	79%	0.789	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-26.2	-173.2	-65.4	-178.5	-175.1	-170.4	1.7	114.2	A210 W214 N237	A210-R212 PolarHBondContact O-N 3.33Å; R212-W214 PolarHBondContact O-N 3.49Å; R212-N237 PolarHBondContact O-ND2 2.96Å
213	G	90.3	Very high	92.2	Very high	48 Å²	48	54 Å²	54	50%	0.495	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-4.8	177.6	0	0	0	0	0	114.8	A211 N237	A211-G213 VanDerWaalsContact C-N 3.29Å; A211-G213 PolarHBondContact O-N 3.3Å; G213-N237 VanDerWaalsContact C-CG 3.47Å; G213-N237 VanDerWaalsContact C-ND2 3.33Å; G213-N237 WeakPolarHBondContact O-CB 3.5Å; G213-N237 VanDerWaalsContact O-CG 3.26Å; G213-N237 PolarHBondContact O-N 2.97Å; G213-N237 PolarHBondContact O-ND2 3.37Å
214	W	95.2	Very high	92	Very high	5 Å²	5	57 Å²	57	2%	0.019	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	150.7	-173	-64.6	85.6	0	0	0	111.4	R206 A211 R212 W234 V235 P236 N237 L259 D268 L270 A295	R206-W214 VanDerWaalsContact CD-O 3.25Å; R206-W214 WeakPolarHBondContact CD-O 3.34Å; A211-W214 HydrophobicContact CB-CB 4.41Å; A211-W214 PolarHBondContact O-N 3.41Å; R212-W214 PolarHBondContact O-N 3.49Å; W214-W234 HydrophobicContact CE3-CB 4.25Å; W214-V235 WeakPolarHBondContact CA-O 2.94Å; W214-P236 HydrophobicContact CE3-CG 4.19Å; W214-P236 HydrophobicContact CH2-CG 3.93Å; W214-P236 VanDerWaalsContact CZ3-CD 3.43Å; W214-P236 HydrophobicContact CZ3-CG 3.74Å; W214-N237 WeakPolarHBondContact CA-OD1 3.27Å; W214-N237 PolarHBondContact O-OD1 3.15Å; W214-L259 HydrophobicContact CB-CD2 4.15Å; W214-L259 HydrophobicContact CD2-CB 3.71Å; W214-L259 HydrophobicContact CD2-CD1 4.31Å; W214-L259 HydrophobicContact CD2-CD2 3.72Å; W214-L259 HydrophobicContact CD2-CG 4.13Å; W214-L259 HydrophobicContact CE3-CB 3.45Å; W214-L259 VanDerWaalsContact CE3-CB 3.45Å; W214-L259 HydrophobicContact CE3-CD2 4.25Å; W214-L259 HydrophobicContact CE3-CG 4.35Å; W214-L259 HydrophobicContact CG-CB 4.49Å; W214-L259 HydrophobicContact CG-CD2 3.64Å; W214-L259 HydrophobicContact CH2-CB 3.72Å; W214-L259 HydrophobicContact CH2-CD1 4.34Å; W214-L259 HydrophobicContact CZ2-CB 3.93Å; W214-L259 HydrophobicContact CZ2-CD1 3.78Å; W214-L259 HydrophobicContact CZ2-CG 4.35Å; W214-L259 HydrophobicContact CZ3-CB 3.46Å; W214-L259 VanDerWaalsContact CZ3-CB 3.46Å; W214-D268 HydrophobicContact CZ2-CB 3.9Å; W214-D268 PolarHBondContact NE1-OD1 3.31Å; W214-D268 VanDerWaalsContact NE1-OD1 3.15Å; W214-D268 PolarHBondContact NE1-OD2 2.93Å; W214-L270 HydrophobicContact CH2-CD1 4.22Å; W214-L270 HydrophobicContact CH2-CD2 3.94Å; W214-L270 HydrophobicContact CH2-CG 3.95Å; W214-L270 HydrophobicContact CZ2-CD1 4.22Å; W214-L270 HydrophobicContact CZ2-CG 4.44Å; W214-A295 HydrophobicContact CH2-CB 3.6Å; W214-A295 HydrophobicContact CZ2-CB 3.44Å; W214-A295 VanDerWaalsContact CZ2-CB 3.44Å
215	R	95.8	Very high	91.9	Very high	54 Å²	54	55 Å²	55	20%	0.204	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	153.2	176.2	60.9	178.6	-171	81.4	2.4	110.9	S217 W234 V235 N237 I239 D241	R215-S217 PolarHBondContact O-N 3.45Å; R215-W234 VanDerWaalsContact O-CA 3.31Å; R215-W234 WeakPolarHBondContact O-CA 3.36Å; R215-V235 HydrophobicContact CG-CG2 3.79Å; R215-V235 VanDerWaalsContact CZ-CG2 3.49Å; R215-V235 PolarHBondContact N-O 3.49Å; R215-V235 PolarHBondContact O-N 3.33Å; R215-N237 WeakPolarHBondContact CB-OD1 3.33Å; R215-N237 PolarHBondContact N-OD1 3.45Å; R215-I239 PolarHBondContact NE-O 2.92Å; R215-I239 VanDerWaalsContact NE-O 3.15Å; R215-I239 PolarHBondContact NH2-O 2.94Å; R215-D241 IonicContact CZ-OD1 2.89Å; R215-D241 VanDerWaalsContact CZ-OD1 3.27Å; R215-D241 IonicContact NH1-OD1 3.83Å; R215-D241 PolarHBondContact NH1-OD1 2.87Å; R215-D241 IonicContact NH1-OD2 2.98Å; R215-D241 IonicContact NH2-OD1 3.73Å; R215-D241 PolarHBondContact NH2-OD1 2.93Å
216	V	97.1	Very high	91.9	Very high	25 Å²	25	55 Å²	55	15%	0.152	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	125.7	166	-176.1	0	0	0	0	108.8	W202 E203 Y232	W202-V216 HydrophobicContact CB-CG1 4.09Å; W202-V216 HydrophobicContact CB-CG2 3.92Å; E203-V216 HydrophobicContact CB-CG2 4.14Å; E203-V216 WeakPolarHBondContact OE2-CG2 3.36Å; V216-Y232 HydrophobicContact CG1-CD1 4.37Å; V216-Y232 HydrophobicContact CG1-CG 4.37Å
217	S	96.5	Very high	91.9	Very high	0 Å²	0	56.8 Å²	56.8	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	140	172.3	179.4	0	0	0	0	110.5	R215 V219 Y232 F233 D241	R215-S217 PolarHBondContact O-N 3.45Å; S217-V219 WeakPolarHBondContact OG-CB 3.35Å; S217-V219 WeakPolarHBondContact OG-CG1 3.35Å; S217-V219 PolarHBondContact OG-N 3.03Å; S217-Y232 WeakPolarHBondContact O-CA 3.43Å; S217-F233 PolarHBondContact N-O 3.09Å; S217-D241 WeakPolarHBondContact CB-OD1 3.45Å; S217-D241 VanDerWaalsContact OG-CG 3.31Å; S217-D241 PolarHBondContact OG-OD1 2.94Å
218	T	95.4	Very high	92	Very high	69 Å²	69	50.8 Å²	50.8	42%	0.423	26%	0.259	S	S	.	.			trans	-102.9	7.6	173.7	60.1	0	0	0	0	112	N220 E221 Y232	T218-N220 PolarHBondContact O-N 3.42Å; T218-E221 VanDerWaalsContact O-CB 3.25Å; T218-E221 WeakPolarHBondContact O-CB 3.41Å; T218-E221 PolarHBondContact O-N 3.35Å; T218-Y232 HydrophobicContact CG2-CD1 4.02Å; T218-Y232 HydrophobicContact CG2-CE1 3.89Å
219	V	95.4	Very high	92.3	Very high	6 Å²	6	46 Å²	46	4%	0.036	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-26.9	-174.9	72.6	0	0	0	0	113.6	S217 V225 F233 D241 V244 R245	S217-V219 WeakPolarHBondContact OG-CB 3.35Å; S217-V219 WeakPolarHBondContact OG-CG1 3.35Å; S217-V219 PolarHBondContact OG-N 3.03Å; V219-V225 HydrophobicContact CG1-CG2 4.14Å; V219-V225 HydrophobicContact CG2-CG2 3.86Å; V219-F233 HydrophobicContact CG1-CE1 4.09Å; V219-F233 HydrophobicContact CG1-CE2 4.1Å; V219-F233 HydrophobicContact CG1-CZ 3.37Å; V219-D241 HydrophobicContact CB-CB 3.95Å; V219-D241 HydrophobicContact CG2-CB 4.06Å; V219-D241 WeakPolarHBondContact CG2-O 3.46Å; V219-V244 HydrophobicContact CG1-CG1 3.98Å; V219-R245 HydrophobicContact CG2-CB 4.06Å
220	N	95.4	Very high	92.7	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112.5	17.4	-179	-160.7	53.8	0	0	0	113.2	T218 R222 F223 V225 A226 L229 P230 R231 F233	T218-N220 PolarHBondContact O-N 3.42Å; N220-R222 PolarHBondContact O-N 2.87Å; N220-R222 VanDerWaalsContact O-N 3.15Å; N220-F223 WeakPolarHBondContact O-CA 3.33Å; N220-F223 PolarHBondContact O-N 3.31Å; N220-F223 VanDerWaalsContact OD1-C 3.3Å; N220-F223 VanDerWaalsContact OD1-CA 3.24Å; N220-F223 WeakPolarHBondContact OD1-CA 3.48Å; N220-V225 HydrophobicContact CB-CB 4.28Å; N220-V225 HydrophobicContact CB-CG2 4.35Å; N220-V225 WeakPolarHBondContact OD1-CA 3.43Å; N220-V225 VanDerWaalsContact OD1-CB 3.31Å; N220-V225 WeakPolarHBondContact OD1-CB 3.39Å; N220-V225 PolarHBondContact OD1-N 2.87Å; N220-A226 PolarHBondContact ND2-O 3.16Å; N220-A226 PolarHBondContact OD1-N 3.07Å; N220-A226 PolarHBondContact OD1-O 2.86Å; N220-L229 WeakPolarHBondContact ND2-CB 3.22Å; N220-L229 PolarHBondContact ND2-O 2.77Å; N220-P230 PolarHBondContact ND2-O 2.61Å; N220-R231 CarbonylContact C-O 3.56Å; N220-R231 WeakPolarHBondContact O-CA 3.3Å; N220-F233 HydrophobicContact CB-CE1 3.62Å; N220-F233 HydrophobicContact CB-CZ 4.38Å
221	E	92.7	Very high	92.9	Very high	73 Å²	73	44.1 Å²	44.1	34%	0.341	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.4	-36.1	-179.2	178.2	172.1	-128.6	0	0	112.3	T218 R231 Y232	T218-E221 VanDerWaalsContact O-CB 3.25Å; T218-E221 WeakPolarHBondContact O-CB 3.41Å; T218-E221 PolarHBondContact O-N 3.35Å; E221-R231 PolarHBondContact N-O 3.15Å; E221-R231 VanDerWaalsContact N-O 3.17Å; E221-R231 WeakPolarHBondContact O-CG 3.38Å; E221-R231 PolarHBondContact O-NE 3.23Å; E221-Y232 HydrophobicContact CB-CE1 4.17Å; E221-Y232 HydrophobicContact CG-CE1 4.09Å; E221-Y232 PolarHBondContact OE1-OH 2.94Å
222	R	89.7	Confident	93.2	Very high	157 Å²	157	45.2 Å²	45.2	59%	0.592	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.5	5.2	176.4	-61.2	-178.5	-176.6	-172.3	0.5	114	N220 D224	N220-R222 PolarHBondContact O-N 2.87Å; N220-R222 VanDerWaalsContact O-N 3.15Å; R222-D224 PolarHBondContact O-N 3.49Å
223	F	92.2	Very high	93.7	Very high	14 Å²	14	35.3 Å²	35.3	6%	0.061	19%	0.186	C	C	.	.	S	Bend	trans	63.5	25	-174	-56.8	-89.6	0	0	0	114.8	N220 V225 T227 L229 R231 P479 W480 L489	N220-F223 WeakPolarHBondContact O-CA 3.33Å; N220-F223 PolarHBondContact O-N 3.31Å; N220-F223 VanDerWaalsContact OD1-C 3.3Å; N220-F223 VanDerWaalsContact OD1-CA 3.24Å; N220-F223 WeakPolarHBondContact OD1-CA 3.48Å; F223-V225 PolarHBondContact O-N 3.38Å; F223-T227 HydrophobicContact CB-CG2 4.43Å; F223-L229 VanDerWaalsContact CE1-O 3.29Å; F223-L229 WeakPolarHBondContact CE1-O 3.5Å; F223-R231 HydrophobicContact CD2-CG 4.4Å; F223-R231 HydrophobicContact CE1-CG 4.11Å; F223-R231 HydrophobicContact CE2-CG 3.61Å; F223-R231 HydrophobicContact CZ-CG 3.44Å; F223-R231 VanDerWaalsContact CZ-CG 3.44Å; F223-P479 HydrophobicContact CE1-CB 4.13Å; F223-W480 HydrophobicContact CD1-CB 3.81Å; F223-W480 HydrophobicContact CD1-CG 4.46Å; F223-W480 HydrophobicContact CD2-CB 4.32Å; F223-W480 AromaticContact CD2-CD1 3.44Å; F223-W480 VanDerWaalsContact CD2-CD1 3.44Å; F223-W480 HydrophobicContact CD2-CG 4.27Å; F223-W480 HydrophobicContact CE1-CB 3.81Å; F223-W480 HydrophobicContact CE2-CB 4.28Å; F223-W480 AromaticContact CE2-CD1 3.93Å; F223-W480 HydrophobicContact CE2-CG 4.48Å; F223-W480 HydrophobicContact CG-CB 4.05Å; F223-W480 AromaticContact CG-CD1 3.56Å; F223-W480 HydrophobicContact CG-CG 4.21Å; F223-W480 HydrophobicContact CZ-CB 4.03Å; F223-L489 HydrophobicContact CD2-CD1 4.43Å; F223-L489 HydrophobicContact CE2-CD1 4.36Å
224	D	89.3	Confident	94	Very high	114 Å²	114	33.1 Å²	33.1	61%	0.61	16%	0.163	S	C	*	.	S	Bend	trans	-67.2	-24	180	-62.5	-31.3	0	0	0	113	R222	R222-D224 PolarHBondContact O-N 3.49Å
225	V	91.4	Very high	94.1	Very high	28 Å²	28	32.9 Å²	32.9	17%	0.17	16%	0.162	C	C	.	.	S	Bend	trans	-87.3	-53.3	178.2	-177.1	0	0	0	0	110.4	V219 N220 F223 L229 R245 F248	V219-V225 HydrophobicContact CG1-CG2 4.14Å; V219-V225 HydrophobicContact CG2-CG2 3.86Å; N220-V225 HydrophobicContact CB-CB 4.28Å; N220-V225 HydrophobicContact CB-CG2 4.35Å; N220-V225 WeakPolarHBondContact OD1-CA 3.43Å; N220-V225 VanDerWaalsContact OD1-CB 3.31Å; N220-V225 WeakPolarHBondContact OD1-CB 3.39Å; N220-V225 PolarHBondContact OD1-N 2.87Å; F223-V225 PolarHBondContact O-N 3.38Å; V225-L229 HydrophobicContact CG1-CD1 4.38Å; V225-R245 HydrophobicContact CG2-CG 4.45Å; V225-F248 HydrophobicContact CG1-CB 3.85Å; V225-F248 HydrophobicContact CG1-CD2 3.75Å; V225-F248 HydrophobicContact CG1-CG 4.24Å
226	A	92	Very high	94	Very high	10 Å²	10	30.7 Å²	30.7	8%	0.083	16%	0.155	C	C	.	.			trans	-158.5	135.7	174.2	0	0	0	0	0	111.7	N220 S228 L229 Q253	N220-A226 PolarHBondContact ND2-O 3.16Å; N220-A226 PolarHBondContact OD1-N 3.07Å; N220-A226 PolarHBondContact OD1-O 2.86Å; A226-S228 PolarHBondContact O-N 2.79Å; A226-L229 HydrophobicContact CB-CB 4.2Å; A226-L229 HydrophobicContact CB-CD1 3.97Å; A226-L229 HydrophobicContact CB-CG 3.98Å; A226-L229 PolarHBondContact O-N 2.78Å; A226-Q253 WeakPolarHBondContact CB-O 3.17Å
227	T	92.8	Very high	93.8	Very high	72 Å²	72	33.1 Å²	33.1	44%	0.442	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-23.2	172.6	56.8	0	0	0	0	113	F223 T478 W480	F223-T227 HydrophobicContact CB-CG2 4.43Å; T227-T478 WeakPolarHBondContact O-CB 3.24Å; T227-W480 HydrophobicContact CG2-CB 4.37Å; T227-W480 HydrophobicContact CG2-CD2 4.43Å; T227-W480 HydrophobicContact CG2-CG 4.11Å; T227-W480 WeakPolarHBondContact O-CB 3.43Å
228	S	92.3	Very high	93.5	Very high	6 Å²	6	41.6 Å²	41.6	4%	0.042	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-19.3	178.6	70.1	0	0	0	0	113.5	A226 R255 P479	A226-S228 PolarHBondContact O-N 2.79Å; S228-R255 PolarHBondContact O-NH1 3.07Å; S228-R255 PolarHBondContact OG-NH1 3.42Å; S228-R255 VanDerWaalsContact OG-NH1 3.15Å; S228-P479 WeakPolarHBondContact O-CD 3.32Å
229	L	93.9	Very high	93.3	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	18%	0.182	C	C	.	.	S	Bend	trans	-84.2	155.1	176.7	-77.1	175.1	0	0	0	111.1	N220 F223 V225 A226 F233 F248 G254 R255	N220-L229 WeakPolarHBondContact ND2-CB 3.22Å; N220-L229 PolarHBondContact ND2-O 2.77Å; F223-L229 VanDerWaalsContact CE1-O 3.29Å; F223-L229 WeakPolarHBondContact CE1-O 3.5Å; V225-L229 HydrophobicContact CG1-CD1 4.38Å; A226-L229 HydrophobicContact CB-CB 4.2Å; A226-L229 HydrophobicContact CB-CD1 3.97Å; A226-L229 HydrophobicContact CB-CG 3.98Å; A226-L229 PolarHBondContact O-N 2.78Å; L229-F233 HydrophobicContact CD1-CE1 4.26Å; L229-F248 HydrophobicContact CD1-CD2 3.91Å; L229-F248 HydrophobicContact CD1-CE2 3.84Å; L229-G254 WeakPolarHBondContact CD1-O 3.35Å; L229-R255 HydrophobicContact CD2-CB 4.42Å; L229-R255 HydrophobicContact CD2-CG 4.06Å; L229-R255 HydrophobicContact CG-CG 4.09Å
230	P	94.1	Very high	93.2	Very high	4 Å²	4	43.8 Å²	43.8	3%	0.026	21%	0.207	C	C	.	.			trans	-64.3	161.8	168.3	27.3	-33.4	0	0	0	111.4	W202 N220 Y232 F233 A413	W202-P230 HydrophobicContact CH2-CB 4.32Å; W202-P230 HydrophobicContact CH2-CG 3.94Å; W202-P230 HydrophobicContact CZ2-CB 3.69Å; W202-P230 HydrophobicContact CZ2-CG 3.83Å; N220-P230 PolarHBondContact ND2-O 2.61Å; P230-Y232 WeakPolarHBondContact CB-O 3.25Å; P230-Y232 VanDerWaalsContact CG-O 3.24Å; P230-Y232 WeakPolarHBondContact CG-O 3.34Å; P230-Y232 PolarHBondContact O-N 3.03Å; P230-F233 HydrophobicContact CG-CB 4.31Å; P230-F233 HydrophobicContact CG-CD1 4.38Å; P230-A413 WeakPolarHBondContact CB-O 3.16Å; P230-A413 WeakPolarHBondContact CD-O 3.21Å
231	R	93.3	Very high	93.2	Very high	33 Å²	33	45.7 Å²	45.7	13%	0.125	22%	0.218	C	C	.	.	S	Bend	trans	-59.3	-38.8	174.9	-75.2	-171.8	169.1	157.2	1.6	112.8	N220 E221 F223	N220-R231 CarbonylContact C-O 3.56Å; N220-R231 WeakPolarHBondContact O-CA 3.3Å; E221-R231 PolarHBondContact N-O 3.15Å; E221-R231 VanDerWaalsContact N-O 3.17Å; E221-R231 WeakPolarHBondContact O-CG 3.38Å; E221-R231 PolarHBondContact O-NE 3.23Å; F223-R231 HydrophobicContact CD2-CG 4.4Å; F223-R231 HydrophobicContact CE1-CG 4.11Å; F223-R231 HydrophobicContact CE2-CG 3.61Å; F223-R231 HydrophobicContact CZ-CG 3.44Å; F223-R231 VanDerWaalsContact CZ-CG 3.44Å
232	Y	96	Very high	93.2	Very high	23 Å²	23	45.1 Å²	45.1	9%	0.09	22%	0.222	C	C	.	.			trans	-126	147.3	-178.5	-48.4	-72.7	0	0	0	109	E197 A199 W202 V216 S217 T218 E221 P230	E197-Y232 WeakPolarHBondContact O-CE2 3.29Å; A199-Y232 HydrophobicContact CB-CD1 4.05Å; A199-Y232 HydrophobicContact CB-CD2 4.32Å; A199-Y232 HydrophobicContact CB-CE1 3.94Å; A199-Y232 HydrophobicContact CB-CE2 4.21Å; A199-Y232 HydrophobicContact CB-CG 4.24Å; A199-Y232 VanDerWaalsContact N-CE2 3.32Å; W202-Y232 WeakPolarHBondContact CH2-O 3.17Å; W202-Y232 WeakPolarHBondContact CZ2-O 3.49Å; V216-Y232 HydrophobicContact CG1-CD1 4.37Å; V216-Y232 HydrophobicContact CG1-CG 4.37Å; S217-Y232 WeakPolarHBondContact O-CA 3.43Å; T218-Y232 HydrophobicContact CG2-CD1 4.02Å; T218-Y232 HydrophobicContact CG2-CE1 3.89Å; E221-Y232 HydrophobicContact CB-CE1 4.17Å; E221-Y232 HydrophobicContact CG-CE1 4.09Å; E221-Y232 PolarHBondContact OE1-OH 2.94Å; P230-Y232 WeakPolarHBondContact CB-O 3.25Å; P230-Y232 VanDerWaalsContact CG-O 3.24Å; P230-Y232 WeakPolarHBondContact CG-O 3.34Å; P230-Y232 PolarHBondContact O-N 3.03Å
233	F	96.5	Very high	93.4	Very high	1 Å²	1	40.4 Å²	40.4	0%	0.004	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.4	168.8	174.3	49	-96.5	0	0	0	109.1	W202 S217 V219 N220 L229 P230 V235 V244 F248 R258	W202-F233 HydrophobicContact CZ3-CB 4.42Å; S217-F233 PolarHBondContact N-O 3.09Å; V219-F233 HydrophobicContact CG1-CE1 4.09Å; V219-F233 HydrophobicContact CG1-CE2 4.1Å; V219-F233 HydrophobicContact CG1-CZ 3.37Å; N220-F233 HydrophobicContact CB-CE1 3.62Å; N220-F233 HydrophobicContact CB-CZ 4.38Å; L229-F233 HydrophobicContact CD1-CE1 4.26Å; P230-F233 HydrophobicContact CG-CB 4.31Å; P230-F233 HydrophobicContact CG-CD1 4.38Å; F233-V235 HydrophobicContact CD2-CG1 3.72Å; F233-V235 HydrophobicContact CE2-CG1 3.59Å; F233-V244 HydrophobicContact CE2-CG1 4.12Å; F233-V244 HydrophobicContact CZ-CG1 4.37Å; F233-F248 HydrophobicContact CE1-CE2 4.46Å; F233-F248 AromaticContact CE2-CE2 3.75Å; F233-F248 HydrophobicContact CE2-CE2 3.75Å; F233-F248 AromaticContact CE2-CZ 3.82Å; F233-F248 HydrophobicContact CE2-CZ 3.82Å; F233-F248 HydrophobicContact CZ-CD2 4.4Å; F233-F248 AromaticContact CZ-CE2 3.64Å; F233-F248 HydrophobicContact CZ-CE2 3.64Å; F233-F248 HydrophobicContact CZ-CZ 4.2Å; F233-R258 HydrophobicContact CD2-CB 4.33Å
234	W	97.2	Very high	93.5	Very high	1 Å²	1	39.7 Å²	39.7	0%	0.004	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	132.4	-176.8	-58.4	-44.9	0	0	0	112.5	M196 W202 E205 R206 W214 R215 L259	M196-W234 HydrophobicContact CE-CZ2 4.47Å; W202-W234 HydrophobicContact CE3-CD2 4.2Å; W202-W234 AromaticContact CE3-CE2 3.79Å; W202-W234 AromaticContact CE3-CZ2 4Å; W202-W234 HydrophobicContact CE3-CZ2 4Å; W202-W234 AromaticContact CE3-NE1 3.93Å; W202-W234 HydrophobicContact CZ3-CD2 4.48Å; W202-W234 WeakPolarHBondContact O-CZ2 3.48Å; W202-W234 PolarHBondContact O-NE1 2.86Å; E205-W234 HydrophobicContact CB-CH2 3.99Å; E205-W234 HydrophobicContact CB-CZ2 3.74Å; R206-W234 HydrophobicContact CB-CZ2 4.05Å; W214-W234 HydrophobicContact CE3-CB 4.25Å; R215-W234 VanDerWaalsContact O-CA 3.31Å; R215-W234 WeakPolarHBondContact O-CA 3.36Å; W234-L259 HydrophobicContact CB-CB 3.94Å; W234-L259 HydrophobicContact CB-CD2 4.33Å; W234-L259 HydrophobicContact CD2-CD2 4.41Å; W234-L259 HydrophobicContact CE3-CB 4.29Å; W234-L259 HydrophobicContact CE3-CD2 3.9Å; W234-L259 HydrophobicContact CE3-CG 4.14Å; W234-L259 PolarHBondContact O-N 2.96Å
235	V	96.7	Very high	93.6	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	158.4	174.8	-57.1	0	0	0	0	110	W214 R215 F233 N237 V244 M292	W214-V235 WeakPolarHBondContact CA-O 2.94Å; R215-V235 HydrophobicContact CG-CG2 3.79Å; R215-V235 VanDerWaalsContact CZ-CG2 3.49Å; R215-V235 PolarHBondContact N-O 3.49Å; R215-V235 PolarHBondContact O-N 3.33Å; F233-V235 HydrophobicContact CD2-CG1 3.72Å; F233-V235 HydrophobicContact CE2-CG1 3.59Å; V235-N237 PolarHBondContact O-N 3.45Å; V235-V244 HydrophobicContact CB-CG2 4.2Å; V235-V244 HydrophobicContact CG1-CG1 4.24Å; V235-V244 HydrophobicContact CG1-CG2 3.97Å; V235-V244 HydrophobicContact CG2-CG2 4.25Å; V235-M292 HydrophobicContact CB-CE 4.3Å; V235-M292 HydrophobicContact CG1-CE 4.04Å
236	P	95.3	Very high	93.5	Very high	9 Å²	9	42.7 Å²	42.7	6%	0.058	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.1	139.8	178.6	-24.6	36.1	0	0	0	111.7	W214 R238 I239 A295	W214-P236 HydrophobicContact CE3-CG 4.19Å; W214-P236 HydrophobicContact CH2-CG 3.93Å; W214-P236 VanDerWaalsContact CZ3-CD 3.43Å; W214-P236 HydrophobicContact CZ3-CG 3.74Å; P236-R238 PolarHBondContact O-N 3.1Å; P236-R238 VanDerWaalsContact O-N 3.09Å; P236-I239 HydrophobicContact CB-CD1 3.92Å; P236-I239 HydrophobicContact CB-CG1 4.15Å; P236-I239 HydrophobicContact CG-CD1 3.8Å; P236-I239 PolarHBondContact O-N 3.42Å; P236-I239 VanDerWaalsContact O-N 3.1Å; P236-A295 HydrophobicContact CG-CB 3.99Å
237	N	92.4	Very high	93.5	Very high	76 Å²	76	42.2 Å²	42.2	41%	0.406	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.7	-35.2	-174.2	-80.7	-16.1	0	0	0	114.4	R212 G213 W214 R215 V235 I239	R212-N237 PolarHBondContact O-ND2 2.96Å; G213-N237 VanDerWaalsContact C-CG 3.47Å; G213-N237 VanDerWaalsContact C-ND2 3.33Å; G213-N237 WeakPolarHBondContact O-CB 3.5Å; G213-N237 VanDerWaalsContact O-CG 3.26Å; G213-N237 PolarHBondContact O-N 2.97Å; G213-N237 PolarHBondContact O-ND2 3.37Å; W214-N237 WeakPolarHBondContact CA-OD1 3.27Å; W214-N237 PolarHBondContact O-OD1 3.15Å; R215-N237 WeakPolarHBondContact CB-OD1 3.33Å; R215-N237 PolarHBondContact N-OD1 3.45Å; V235-N237 PolarHBondContact O-N 3.45Å; N237-I239 VanDerWaalsContact C-N 3.31Å
238	R	88.9	Confident	93.5	Very high	177 Å²	177	38.8 Å²	38.8	67%	0.668	18%	0.178	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.3	-15.9	-174	-63.1	-177.2	-179.9	172.8	2.1	113.3	P236	P236-R238 PolarHBondContact O-N 3.1Å; P236-R238 VanDerWaalsContact O-N 3.09Å
239	I	91.1	Very high	93.3	Very high	12 Å²	12	41 Å²	41	6%	0.062	20%	0.202	C	C	.	.	S	Bend	trans	-93.5	132.1	-173.6	-58.6	179.3	0	0	0	108.6	R215 P236 N237 E243 V244 M292	R215-I239 PolarHBondContact NE-O 2.92Å; R215-I239 VanDerWaalsContact NE-O 3.15Å; R215-I239 PolarHBondContact NH2-O 2.94Å; P236-I239 HydrophobicContact CB-CD1 3.92Å; P236-I239 HydrophobicContact CB-CG1 4.15Å; P236-I239 HydrophobicContact CG-CD1 3.8Å; P236-I239 PolarHBondContact O-N 3.42Å; P236-I239 VanDerWaalsContact O-N 3.1Å; N237-I239 VanDerWaalsContact C-N 3.31Å; I239-E243 HydrophobicContact CG2-CB 3.78Å; I239-V244 HydrophobicContact CG2-CG2 3.95Å; I239-M292 HydrophobicContact CB-SD 4.19Å; I239-M292 HydrophobicContact CD1-CB 4.38Å; I239-M292 HydrophobicContact CD1-CG 3.8Å; I239-M292 HydrophobicContact CD1-SD 3.35Å; I239-M292 WeakPolarHBondContact CD1-SD 3.35Å; I239-M292 HydrophobicContact CG1-SD 4.34Å; I239-M292 HydrophobicContact CG2-CG 4.41Å; I239-M292 HydrophobicContact CG2-SD 3.75Å
240	L	93.9	Very high	93	Very high	109 Å²	109	42 Å²	42	57%	0.571	21%	0.207	S	C	*	.			trans	-83.7	153.4	179.8	-59.3	175.6	0	0	0	111.6	S242 E243 V244	L240-S242 PolarHBondContact O-N 3.21Å; L240-S242 VanDerWaalsContact O-N 3.16Å; L240-E243 HydrophobicContact CB-CG 4.21Å; L240-E243 PolarHBondContact N-OE2 3.04Å; L240-E243 WeakPolarHBondContact O-CB 3.42Å; L240-E243 PolarHBondContact O-N 2.75Å; L240-V244 WeakPolarHBondContact O-CG2 3.46Å; L240-V244 PolarHBondContact O-N 3.49Å
241	D	95.4	Very high	92.8	Very high	40 Å²	40	42 Å²	42	21%	0.214	21%	0.206	C	C	.	.	H	α-helix	trans	-61	-26.5	179.4	-75.6	-12.8	0	0	0	113.3	R215 S217 V219 R245	R215-D241 IonicContact CZ-OD1 2.89Å; R215-D241 VanDerWaalsContact CZ-OD1 3.27Å; R215-D241 IonicContact NH1-OD1 3.83Å; R215-D241 PolarHBondContact NH1-OD1 2.87Å; R215-D241 IonicContact NH1-OD2 2.98Å; R215-D241 IonicContact NH2-OD1 3.73Å; R215-D241 PolarHBondContact NH2-OD1 2.93Å; S217-D241 WeakPolarHBondContact CB-OD1 3.45Å; S217-D241 VanDerWaalsContact OG-CG 3.31Å; S217-D241 PolarHBondContact OG-OD1 2.94Å; V219-D241 HydrophobicContact CB-CB 3.95Å; V219-D241 HydrophobicContact CG2-CB 4.06Å; V219-D241 WeakPolarHBondContact CG2-O 3.46Å; D241-R245 WeakPolarHBondContact O-CB 3.45Å; D241-R245 PolarHBondContact O-N 3.27Å
242	S	93.6	Very high	92.5	Very high	62 Å²	62	42 Å²	42	43%	0.434	21%	0.207	S	C	.	.	H	α-helix	trans	-66.2	-36.7	172.2	54.7	0	0	0	0	112.6	L240 R246	L240-S242 PolarHBondContact O-N 3.21Å; L240-S242 VanDerWaalsContact O-N 3.16Å; S242-R246 WeakPolarHBondContact O-CG 3.44Å; S242-R246 PolarHBondContact O-N 2.87Å
243	E	92.8	Very high	92.1	Very high	57 Å²	57	46 Å²	46	27%	0.266	23%	0.227	S	C	.	.	H	α-helix	trans	-74.9	-38.7	176.9	-55.1	-178.9	105.8	0	0	111.1	I239 L240 R245 R246 A247 A288	I239-E243 HydrophobicContact CG2-CB 3.78Å; L240-E243 HydrophobicContact CB-CG 4.21Å; L240-E243 PolarHBondContact N-OE2 3.04Å; L240-E243 WeakPolarHBondContact O-CB 3.42Å; L240-E243 PolarHBondContact O-N 2.75Å; E243-R245 VanDerWaalsContact C-N 3.34Å; E243-R245 PolarHBondContact O-N 3.27Å; E243-R246 PolarHBondContact O-N 2.92Å; E243-A247 WeakPolarHBondContact O-CB 3.32Å; E243-A247 PolarHBondContact O-N 3.07Å; E243-A288 HydrophobicContact CB-CB 4.3Å
244	V	94.5	Very high	91.8	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-57.1	-49.3	172.4	177.4	0	0	0	0	110.2	V219 F233 V235 I239 L240 R246 A247 F248 M292	V219-V244 HydrophobicContact CG1-CG1 3.98Å; F233-V244 HydrophobicContact CE2-CG1 4.12Å; F233-V244 HydrophobicContact CZ-CG1 4.37Å; V235-V244 HydrophobicContact CB-CG2 4.2Å; V235-V244 HydrophobicContact CG1-CG1 4.24Å; V235-V244 HydrophobicContact CG1-CG2 3.97Å; V235-V244 HydrophobicContact CG2-CG2 4.25Å; I239-V244 HydrophobicContact CG2-CG2 3.95Å; L240-V244 WeakPolarHBondContact O-CG2 3.46Å; L240-V244 PolarHBondContact O-N 3.49Å; V244-R246 VanDerWaalsContact C-N 3.35Å; V244-R246 PolarHBondContact O-N 3.43Å; V244-A247 PolarHBondContact O-N 3.24Å; V244-F248 HydrophobicContact CG1-CD1 3.91Å; V244-F248 HydrophobicContact CG1-CD2 4.45Å; V244-F248 HydrophobicContact CG1-CE1 3.83Å; V244-F248 HydrophobicContact CG1-CE2 4.33Å; V244-F248 HydrophobicContact CG1-CG 4.26Å; V244-F248 HydrophobicContact CG1-CZ 4.03Å; V244-F248 WeakPolarHBondContact O-CB 3.47Å; V244-F248 VanDerWaalsContact O-CD1 3.28Å; V244-F248 WeakPolarHBondContact O-CD1 3.45Å; V244-F248 WeakPolarHBondContact O-CG 3.29Å; V244-F248 PolarHBondContact O-N 3.39Å; V244-M292 HydrophobicContact CG1-CE 4.42Å; V244-M292 HydrophobicContact CG2-CE 4.24Å; V244-M292 HydrophobicContact CG2-SD 4.14Å
245	R	92.4	Very high	91.6	Very high	123 Å²	123	46.5 Å²	46.5	46%	0.464	23%	0.233	S	C	.	.	H	α-helix	trans	-59.2	-44	179.4	-173.2	-179.2	-63.4	113	0.2	112.1	V219 V225 D241 E243 G249	V219-R245 HydrophobicContact CG2-CB 4.06Å; V225-R245 HydrophobicContact CG2-CG 4.45Å; D241-R245 WeakPolarHBondContact O-CB 3.45Å; D241-R245 PolarHBondContact O-N 3.27Å; E243-R245 VanDerWaalsContact C-N 3.34Å; E243-R245 PolarHBondContact O-N 3.27Å; R245-G249 PolarHBondContact O-N 3.15Å
246	R	89.2	Confident	91.5	Very high	82 Å²	82	46.5 Å²	46.5	31%	0.309	23%	0.233	S	C	.	.	H	α-helix	trans	-62.9	-51.5	176.4	-72.6	-173.1	-60.4	115.8	-6.1	111.1	S242 E243 V244 F248 G249 H250 E284 D285	S242-R246 WeakPolarHBondContact O-CG 3.44Å; S242-R246 PolarHBondContact O-N 2.87Å; E243-R246 PolarHBondContact O-N 2.92Å; V244-R246 VanDerWaalsContact C-N 3.35Å; V244-R246 PolarHBondContact O-N 3.43Å; R246-F248 VanDerWaalsContact C-N 3.34Å; R246-F248 PolarHBondContact O-N 3.37Å; R246-G249 PolarHBondContact O-N 3.11Å; R246-H250 PolarHBondContact O-CD2 3.14Å; R246-H250 PolarHBondContact O-NE2 3.42Å; R246-E284 VanDerWaalsContact NH1-C 3.33Å; R246-E284 PolarHBondContact NH1-O 2.99Å; R246-E284 VanDerWaalsContact NH1-O 3.15Å; R246-D285 WeakPolarHBondContact CD-OD1 3.29Å; R246-D285 IonicContact CZ-OD1 2.7Å; R246-D285 IonicContact NH1-OD1 3.27Å; R246-D285 PolarHBondContact NH1-OD1 3.2Å
247	A	90.4	Very high	91.4	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-58.2	-44.4	-179.8	0	0	0	0	0	112.3	E243 V244 G249 H250 F251 A288 V289 M292	E243-A247 WeakPolarHBondContact O-CB 3.32Å; E243-A247 PolarHBondContact O-N 3.07Å; V244-A247 PolarHBondContact O-N 3.24Å; A247-G249 VanDerWaalsContact C-N 3.25Å; A247-G249 PolarHBondContact O-N 2.85Å; A247-H250 PolarHBondContact O-N 3.38Å; A247-F251 WeakPolarHBondContact O-CD2 3Å; A247-F251 WeakPolarHBondContact O-CE2 3.32Å; A247-A288 HydrophobicContact CB-CB 4.26Å; A247-V289 HydrophobicContact CB-CG2 3.87Å; A247-M292 HydrophobicContact CB-CG 4.2Å
248	F	92.8	Very high	91.5	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-65.7	-27.1	-176.4	-83.4	34	0	0	0	112.8	V225 L229 F233 V244 R246 H250 F251 G254 G256 P257 M292	V225-F248 HydrophobicContact CG1-CB 3.85Å; V225-F248 HydrophobicContact CG1-CD2 3.75Å; V225-F248 HydrophobicContact CG1-CG 4.24Å; L229-F248 HydrophobicContact CD1-CD2 3.91Å; L229-F248 HydrophobicContact CD1-CE2 3.84Å; F233-F248 HydrophobicContact CE1-CE2 4.46Å; F233-F248 AromaticContact CE2-CE2 3.75Å; F233-F248 HydrophobicContact CE2-CE2 3.75Å; F233-F248 AromaticContact CE2-CZ 3.82Å; F233-F248 HydrophobicContact CE2-CZ 3.82Å; F233-F248 HydrophobicContact CZ-CD2 4.4Å; F233-F248 AromaticContact CZ-CE2 3.64Å; F233-F248 HydrophobicContact CZ-CE2 3.64Å; F233-F248 HydrophobicContact CZ-CZ 4.2Å; V244-F248 HydrophobicContact CG1-CD1 3.91Å; V244-F248 HydrophobicContact CG1-CD2 4.45Å; V244-F248 HydrophobicContact CG1-CE1 3.83Å; V244-F248 HydrophobicContact CG1-CE2 4.33Å; V244-F248 HydrophobicContact CG1-CG 4.26Å; V244-F248 HydrophobicContact CG1-CZ 4.03Å; V244-F248 WeakPolarHBondContact O-CB 3.47Å; V244-F248 VanDerWaalsContact O-CD1 3.28Å; V244-F248 WeakPolarHBondContact O-CD1 3.45Å; V244-F248 WeakPolarHBondContact O-CG 3.29Å; V244-F248 PolarHBondContact O-N 3.39Å; R246-F248 VanDerWaalsContact C-N 3.34Å; R246-F248 PolarHBondContact O-N 3.37Å; F248-H250 PolarHBondContact O-N 3.33Å; F248-H250 VanDerWaalsContact O-N 3.1Å; F248-F251 PolarHBondContact O-N 3.28Å; F248-F251 VanDerWaalsContact O-N 3.1Å; F248-G254 WeakPolarHBondContact CD2-O 3.49Å; F248-G254 WeakPolarHBondContact O-CA 3.35Å; F248-G256 VanDerWaalsContact CD1-CA 3.49Å; F248-G256 VanDerWaalsContact CE1-C 3.48Å; F248-G256 VanDerWaalsContact CE1-CA 3.44Å; F248-P257 WeakPolarHBondContact CE1-O 3.46Å; F248-P257 WeakPolarHBondContact CZ-O 3.04Å; F248-M292 HydrophobicContact CE1-CE 3.58Å; F248-M292 HydrophobicContact CZ-CE 4.25Å
249	G	89.1	Confident	91.9	Very high	53 Å²	53	35 Å²	35	55%	0.546	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-18.2	175.5	0	0	0	0	0	114.4	R245 R246 A247	R245-G249 PolarHBondContact O-N 3.15Å; R246-G249 PolarHBondContact O-N 3.11Å; A247-G249 VanDerWaalsContact C-N 3.25Å; A247-G249 PolarHBondContact O-N 2.85Å
250	H	88.1	Confident	92.2	Very high	21 Å²	21	34.6 Å²	34.6	10%	0.097	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.2	-1.3	179.6	-57.1	-67.7	0	0	0	113.8	R246 A247 F248 Y276 S279 D285 W578	R246-H250 PolarHBondContact O-CD2 3.14Å; R246-H250 PolarHBondContact O-NE2 3.42Å; A247-H250 PolarHBondContact O-N 3.38Å; F248-H250 PolarHBondContact O-N 3.33Å; F248-H250 VanDerWaalsContact O-N 3.1Å; H250-Y276 WeakPolarHBondContact O-CB 3.3Å; H250-Y276 PolarHBondContact O-N 2.75Å; H250-S279 PolarHBondContact ND1-OG 3.15Å; H250-D285 VanDerWaalsContact NE2-CB 3.33Å; H250-D285 WeakPolarHBondContact NE2-CB 3.4Å; H250-D285 IonicContact NE2-OD2 2.98Å; H250-W578 HydrophobicContact CB-CH2 3.89Å; H250-W578 HydrophobicContact CB-CZ2 4.05Å
251	F	89.6	Confident	92.3	Very high	4 Å²	4	29.8 Å²	29.8	2%	0.018	16%	0.156	C	C	.	.	B	Isolated β-bridge	trans	-109	147.2	-180	-64.5	-92.5	0	0	0	111	A247 F248 Q253 G254 P257 C272 G273 F275 V289	A247-F251 WeakPolarHBondContact O-CD2 3Å; A247-F251 WeakPolarHBondContact O-CE2 3.32Å; F248-F251 PolarHBondContact O-N 3.28Å; F248-F251 VanDerWaalsContact O-N 3.1Å; F251-Q253 PolarHBondContact O-N 2.91Å; F251-G254 PolarHBondContact O-N 2.98Å; F251-P257 HydrophobicContact CE1-CG 4.15Å; F251-P257 HydrophobicContact CE2-CG 4.21Å; F251-P257 VanDerWaalsContact CZ-CD 3.45Å; F251-P257 HydrophobicContact CZ-CG 3.68Å; F251-C272 HydrophobicContact CD1-CB 4.2Å; F251-C272 HydrophobicContact CE1-CB 4.15Å; F251-G273 VanDerWaalsContact CD1-O 3.3Å; F251-G273 WeakPolarHBondContact CD1-O 3.43Å; F251-F275 HydrophobicContact CD1-CD1 4.09Å; F251-F275 HydrophobicContact CD1-CE1 4.29Å; F251-F275 AromaticContact CE1-CD1 3.71Å; F251-F275 HydrophobicContact CE1-CD1 3.71Å; F251-F275 AromaticContact CE1-CE1 3.45Å; F251-F275 HydrophobicContact CE1-CE1 3.45Å; F251-F275 VanDerWaalsContact CE1-CE1 3.45Å; F251-F275 HydrophobicContact CE1-CZ 4.14Å; F251-F275 HydrophobicContact CE2-CE1 4.38Å; F251-F275 HydrophobicContact CZ-CD1 4.05Å; F251-F275 AromaticContact CZ-CE1 3.51Å; F251-F275 HydrophobicContact CZ-CE1 3.51Å; F251-F275 HydrophobicContact CZ-CZ 4.33Å; F251-V289 HydrophobicContact CE2-CG1 4.11Å; F251-V289 HydrophobicContact CE2-CG2 4.24Å; F251-V289 HydrophobicContact CZ-CG1 3.88Å
252	H	87.1	Confident	92.2	Very high	31 Å²	31	28.6 Å²	28.6	14%	0.144	15%	0.149	C	C	.	.	G	3₁₀ helix	trans	-54.3	133.8	176.4	-85	85.5	0	0	0	111.1	G254 R255 G274 F275 R376	H252-G254 PolarHBondContact O-N 2.96Å; H252-G254 VanDerWaalsContact O-N 3.13Å; H252-R255 PolarHBondContact O-N 2.62Å; H252-G274 WeakPolarHBondContact CB-O 3.5Å; H252-G274 PolarHBondContact N-O 3.22Å; H252-G274 PolarHBondContact ND1-O 3.27Å; H252-F275 PolarHBondContact CE1-O 3.22Å; H252-F275 PolarHBondContact ND1-O 3.42Å; H252-R376 WeakPolarHBondContact CB-O 2.9Å
253	Q	87.7	Confident	92.1	Very high	107 Å²	107	26.5 Å²	26.5	50%	0.5	13%	0.132	S	C	.	.	G	3₁₀ helix	trans	57.1	20.3	-177	-53.4	-177.2	8.1	0	0	114.4	A226 F251 R255	A226-Q253 WeakPolarHBondContact CB-O 3.17Å; F251-Q253 PolarHBondContact O-N 2.91Å; Q253-R255 HydrophobicContact CB-CG 4.16Å; Q253-R255 PolarHBondContact O-N 3.43Å
254	G	90.4	Very high	91.7	Very high	13 Å²	13	25.4 Å²	25.4	13%	0.134	13%	0.13	C	C	.	.	G	3₁₀ helix	trans	69.7	17.9	-178.3	0	0	0	0	0	113.7	L229 F248 F251 H252 G256	L229-G254 WeakPolarHBondContact CD1-O 3.35Å; F248-G254 WeakPolarHBondContact CD2-O 3.49Å; F248-G254 WeakPolarHBondContact O-CA 3.35Å; F251-G254 PolarHBondContact O-N 2.98Å; H252-G254 PolarHBondContact O-N 2.96Å; H252-G254 VanDerWaalsContact O-N 3.13Å; G254-G256 PolarHBondContact O-N 2.76Å
255	R	93.1	Very high	91	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	14%	0.141	C	C	.	.			trans	-95.2	75.2	-173.9	-61.1	-177.6	71.2	92.1	-4.3	111	S228 L229 H252 Q253 R258 G273 G377 D378 A414	S228-R255 PolarHBondContact O-NH1 3.07Å; S228-R255 PolarHBondContact OG-NH1 3.42Å; S228-R255 VanDerWaalsContact OG-NH1 3.15Å; L229-R255 HydrophobicContact CD2-CB 4.42Å; L229-R255 HydrophobicContact CD2-CG 4.06Å; L229-R255 HydrophobicContact CG-CG 4.09Å; H252-R255 PolarHBondContact O-N 2.62Å; Q253-R255 HydrophobicContact CB-CG 4.16Å; Q253-R255 PolarHBondContact O-N 3.43Å; R255-R258 VanDerWaalsContact NH2-NH2 3.18Å; R255-G273 PolarHBondContact O-N 3.5Å; R255-G377 WeakPolarHBondContact CD-O 3.19Å; R255-G377 PolarHBondContact NE-O 2.99Å; R255-D378 VanDerWaalsContact CZ-O 3.31Å; R255-D378 PolarHBondContact NE-O 3.31Å; R255-D378 VanDerWaalsContact NE-O 3.07Å; R255-D378 IonicContact NE-OD2 2.71Å; R255-D378 PolarHBondContact NH2-O 3.17Å; R255-D378 IonicContact NH2-OD2 3.77Å; R255-A414 PolarHBondContact NH1-O 3.03Å; R255-A414 PolarHBondContact NH2-O 2.87Å
256	G	92.8	Very high	90.7	Very high	0 Å²	0	21 Å²	21	0%	0	12%	0.123	C	C	.	.			trans	-75.7	-178.7	177.7	0	0	0	0	0	114.4	F248 G254 R258	F248-G256 VanDerWaalsContact CD1-CA 3.49Å; F248-G256 VanDerWaalsContact CE1-C 3.48Å; F248-G256 VanDerWaalsContact CE1-CA 3.44Å; G254-G256 PolarHBondContact O-N 2.76Å; G256-R258 PolarHBondContact O-N 3.5Å
257	P	94.2	Very high	90.8	Very high	1 Å²	1	17.1 Å²	17.1	1%	0.006	11%	0.108	C	C	.	.			trans	-61.4	128.9	-178.1	-20.5	33	0	0	0	111.5	F248 F251 L270 R271 C272 M292 L293	F248-P257 WeakPolarHBondContact CE1-O 3.46Å; F248-P257 WeakPolarHBondContact CZ-O 3.04Å; F251-P257 HydrophobicContact CE1-CG 4.15Å; F251-P257 HydrophobicContact CE2-CG 4.21Å; F251-P257 VanDerWaalsContact CZ-CD 3.45Å; F251-P257 HydrophobicContact CZ-CG 3.68Å; P257-L270 HydrophobicContact CB-CD2 4.08Å; P257-R271 WeakPolarHBondContact CA-O 3.36Å; P257-C272 HydrophobicContact CB-CB 4.33Å; P257-C272 HydrophobicContact CG-CB 4.04Å; P257-M292 HydrophobicContact CB-CB 4.46Å; P257-M292 HydrophobicContact CG-CB 4.39Å; P257-M292 WeakPolarHBondContact O-CE 3.17Å; P257-L293 HydrophobicContact CB-CD2 4.06Å; P257-L293 HydrophobicContact CG-CD2 3.38Å; P257-L293 HydrophobicContact CG-CG 3.95Å
258	R	95.5	Very high	91	Very high	13 Å²	13	17.4 Å²	17.4	5%	0.049	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	150.3	174.9	64.7	-171	-178.5	-73.8	-7.6	109.8	F233 R255 G256 S260 L270 R271 D378	F233-R258 HydrophobicContact CD2-CB 4.33Å; R255-R258 VanDerWaalsContact NH2-NH2 3.18Å; G256-R258 PolarHBondContact O-N 3.5Å; R258-S260 PolarHBondContact O-N 3.28Å; R258-L270 CarbonylContact O-C 3.37Å; R258-L270 VanDerWaalsContact O-CA 3.24Å; R258-L270 WeakPolarHBondContact O-CA 3.27Å; R258-R271 PolarHBondContact N-O 3.05Å; R258-R271 VanDerWaalsContact N-O 3.13Å; R258-R271 PolarHBondContact O-N 3.16Å; R258-D378 IonicContact CZ-OD2 3.28Å; R258-D378 IonicContact NH1-OD2 3.31Å; R258-D378 PolarHBondContact NH1-OD2 3.45Å; R258-D378 IonicContact NH2-OD1 3.71Å; R258-D378 IonicContact NH2-OD2 3.7Å; R258-D378 PolarHBondContact NH2-OD2 2.97Å
259	L	97.2	Very high	91.2	Very high	7 Å²	7	17.4 Å²	17.4	4%	0.037	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	133.9	174.9	-179.2	72.9	0	0	0	109.7	A211 W214 W234 W261 H262 D268	A211-L259 HydrophobicContact CB-CD2 4.01Å; W214-L259 HydrophobicContact CB-CD2 4.15Å; W214-L259 HydrophobicContact CD2-CB 3.71Å; W214-L259 HydrophobicContact CD2-CD1 4.31Å; W214-L259 HydrophobicContact CD2-CD2 3.72Å; W214-L259 HydrophobicContact CD2-CG 4.13Å; W214-L259 HydrophobicContact CE3-CB 3.45Å; W214-L259 VanDerWaalsContact CE3-CB 3.45Å; W214-L259 HydrophobicContact CE3-CD2 4.25Å; W214-L259 HydrophobicContact CE3-CG 4.35Å; W214-L259 HydrophobicContact CG-CB 4.49Å; W214-L259 HydrophobicContact CG-CD2 3.64Å; W214-L259 HydrophobicContact CH2-CB 3.72Å; W214-L259 HydrophobicContact CH2-CD1 4.34Å; W214-L259 HydrophobicContact CZ2-CB 3.93Å; W214-L259 HydrophobicContact CZ2-CD1 3.78Å; W214-L259 HydrophobicContact CZ2-CG 4.35Å; W214-L259 HydrophobicContact CZ3-CB 3.46Å; W214-L259 VanDerWaalsContact CZ3-CB 3.46Å; W234-L259 HydrophobicContact CB-CB 3.94Å; W234-L259 HydrophobicContact CB-CD2 4.33Å; W234-L259 HydrophobicContact CD2-CD2 4.41Å; W234-L259 HydrophobicContact CE3-CB 4.29Å; W234-L259 HydrophobicContact CE3-CD2 3.9Å; W234-L259 HydrophobicContact CE3-CG 4.14Å; W234-L259 PolarHBondContact O-N 2.96Å; L259-W261 VanDerWaalsContact CD1-O 3.23Å; L259-W261 WeakPolarHBondContact CD1-O 3.41Å; L259-H262 HydrophobicContact CD2-CB 4.4Å; L259-D268 HydrophobicContact CD1-CB 3.9Å
260	S	95.9	Very high	91.6	Very high	3 Å²	3	14.9 Å²	14.9	2%	0.021	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	-39.3	169.7	-179.1	0	0	0	0	110.8	R258 L269 S386 R409 E410	R258-S260 PolarHBondContact O-N 3.28Å; S260-L269 WeakPolarHBondContact CB-O 3.48Å; S260-L269 PolarHBondContact N-O 2.98Å; S260-S386 PolarHBondContact OG-OG 3.08Å; S260-R409 PolarHBondContact O-NH2 3.45Å; S260-E410 PolarHBondContact OG-OE1 2.87Å; S260-E410 PolarHBondContact OG-OE2 3.03Å
261	W	96	Very high	91.9	Very high	8 Å²	8	14 Å²	14	3%	0.03	8%	0.08	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	137.9	177	-178.2	58.8	0	0	0	113	L259 H263 L269 V364 Q390 A394	L259-W261 VanDerWaalsContact CD1-O 3.23Å; L259-W261 WeakPolarHBondContact CD1-O 3.41Å; W261-H263 HydrophobicContact CE3-CB 4.25Å; W261-H263 HydrophobicContact CH2-CB 3.82Å; W261-H263 AromaticContact CH2-CD2 3.22Å; W261-H263 WeakPolarHBondContact CH2-CD2 3.29Å; W261-H263 AromaticContact CH2-CG 3.78Å; W261-H263 HydrophobicContact CZ2-CB 4.33Å; W261-H263 HydrophobicContact CZ3-CB 3.77Å; W261-H263 AromaticContact CZ3-CD2 3.55Å; W261-L269 HydrophobicContact CB-CB 4.31Å; W261-L269 PolarHBondContact N-O 3.26Å; W261-L269 PolarHBondContact O-N 2.95Å; W261-V364 HydrophobicContact CE3-CG1 4.36Å; W261-V364 HydrophobicContact CZ3-CG1 3.89Å; W261-Q390 HydrophobicContact CB-CG 3.74Å; W261-Q390 HydrophobicContact CD2-CG 3.82Å; W261-Q390 HydrophobicContact CE3-CG 4.17Å; W261-Q390 HydrophobicContact CG-CG 3.61Å; W261-A394 HydrophobicContact CZ2-CB 3.88Å
262	H	94.1	Very high	92.1	Very high	16 Å²	16	13.8 Å²	13.8	7%	0.074	8%	0.079	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	118.1	170.3	-177.9	68.1	0	0	0	109.8	Q209 A211 L259 D268	Q209-H262 PolarHBondContact O-CD2 2.87Å; A211-H262 HydrophobicContact CB-CB 3.71Å; L259-H262 HydrophobicContact CD2-CB 4.4Å; H262-D268 IonicContact CE1-OD1 3.02Å; H262-D268 IonicContact CG-OD1 3.13Å; H262-D268 IonicContact ND1-OD1 3.56Å; H262-D268 PolarHBondContact ND1-OD1 3.28Å
263	H	90.8	Very high	92.2	Very high	18 Å²	18	12.3 Å²	12.3	8%	0.083	7%	0.072	C	C	.	.			trans	-78	135.5	176.7	-178.1	-80.8	0	0	0	109.7	W261 G265 G266 S267 V364 T365	W261-H263 HydrophobicContact CE3-CB 4.25Å; W261-H263 HydrophobicContact CH2-CB 3.82Å; W261-H263 AromaticContact CH2-CD2 3.22Å; W261-H263 WeakPolarHBondContact CH2-CD2 3.29Å; W261-H263 AromaticContact CH2-CG 3.78Å; W261-H263 HydrophobicContact CZ2-CB 4.33Å; W261-H263 HydrophobicContact CZ3-CB 3.77Å; W261-H263 AromaticContact CZ3-CD2 3.55Å; H263-G265 PolarHBondContact CE1-N 3.03Å; H263-G265 VanDerWaalsContact ND1-CA 3.31Å; H263-G265 WeakPolarHBondContact ND1-CA 3.19Å; H263-G265 PolarHBondContact ND1-N 3.32Å; H263-G265 PolarHBondContact O-N 2.95Å; H263-G265 VanDerWaalsContact O-N 3.07Å; H263-G266 WeakPolarHBondContact O-CA 3.19Å; H263-G266 PolarHBondContact O-N 3.23Å; H263-S267 WeakPolarHBondContact CB-O 3.45Å; H263-S267 PolarHBondContact N-O 3.46Å; H263-V364 HydrophobicContact CB-CG1 3.6Å; H263-T365 PolarHBondContact CD2-OG1 3.03Å; H263-T365 PolarHBondContact NE2-OG1 2.84Å
264	P	84.1	Confident	92.1	Very high	34 Å²	34	7.6 Å²	7.6	22%	0.221	5%	0.052	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-26.3	-178.6	-27.4	35.8	0	0	0	115	G266 W544	P264-G266 PolarHBondContact O-N 2.75Å; P264-W544 HydrophobicContact CG-CE3 3.66Å; P264-W544 HydrophobicContact CG-CZ3 3.57Å
265	G	80.3	Confident	91.7	Very high	23 Å²	23	8.3 Å²	8.3	24%	0.237	5%	0.051	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-3.5	170.1	0	0	0	0	0	115.2	H263 V368	H263-G265 PolarHBondContact CE1-N 3.03Å; H263-G265 VanDerWaalsContact ND1-CA 3.31Å; H263-G265 WeakPolarHBondContact ND1-CA 3.19Å; H263-G265 PolarHBondContact ND1-N 3.32Å; H263-G265 PolarHBondContact O-N 2.95Å; H263-G265 VanDerWaalsContact O-N 3.07Å; G265-V368 VanDerWaalsContact O-CG2 3.27Å; G265-V368 WeakPolarHBondContact O-CG2 3.38Å
266	G	86.4	Confident	90.7	Very high	7 Å²	7	13.9 Å²	13.9	7%	0.072	7%	0.073	C	C	.	.	S	Bend	trans	106.6	-12.4	170.8	0	0	0	0	0	115.9	H263 P264 H297	H263-G266 WeakPolarHBondContact O-CA 3.19Å; H263-G266 PolarHBondContact O-N 3.23Å; P264-G266 PolarHBondContact O-N 2.75Å; G266-H297 PolarHBondContact O-CE1 3.35Å
267	S	90.6	Very high	89.3	Confident	1 Å²	1	20 Å²	20	1%	0.007	11%	0.111	C	C	.	.			trans	-75.8	153.7	179.2	-55.9	0	0	0	0	112.9	H263 V364 R367 V368 R369	H263-S267 WeakPolarHBondContact CB-O 3.45Å; H263-S267 PolarHBondContact N-O 3.46Å; S267-V364 WeakPolarHBondContact CB-O 3.04Å; S267-V364 PolarHBondContact OG-O 2.82Å; S267-R367 PolarHBondContact OG-O 2.98Å; S267-V368 WeakPolarHBondContact OG-CA 3.46Å; S267-R369 VanDerWaalsContact CA-O 3.29Å; S267-R369 WeakPolarHBondContact CA-O 3.44Å; S267-R369 WeakPolarHBondContact CB-O 3.36Å; S267-R369 PolarHBondContact OG-N 3Å
268	D	95.3	Very high	87.8	Confident	5 Å²	5	23.7 Å²	23.7	3%	0.027	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	131.1	177.4	-71	-44	0	0	0	111.1	W214 L259 H262 L270 H297 R369 V371	W214-D268 HydrophobicContact CZ2-CB 3.9Å; W214-D268 PolarHBondContact NE1-OD1 3.31Å; W214-D268 VanDerWaalsContact NE1-OD1 3.15Å; W214-D268 PolarHBondContact NE1-OD2 2.93Å; L259-D268 HydrophobicContact CD1-CB 3.9Å; H262-D268 IonicContact CE1-OD1 3.02Å; H262-D268 IonicContact CG-OD1 3.13Å; H262-D268 IonicContact ND1-OD1 3.56Å; H262-D268 PolarHBondContact ND1-OD1 3.28Å; D268-L270 HydrophobicContact CB-CD1 3.61Å; D268-L270 WeakPolarHBondContact O-CD1 3.47Å; D268-H297 IonicContact OD2-CD2 2.78Å; D268-H297 IonicContact OD2-CE1 3.64Å; D268-H297 IonicContact OD2-NE2 3.64Å; D268-H297 PolarHBondContact OD2-NE2 2.9Å; D268-R369 PolarHBondContact N-O 3.12Å; D268-V371 PolarHBondContact O-N 3.27Å
269	L	96.9	Very high	86.5	Confident	0 Å²	0	24 Å²	24	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	114.3	170.7	-177	67	0	0	0	109.3	S260 W261 I360 V364 V371 L373 V389	S260-L269 WeakPolarHBondContact CB-O 3.48Å; S260-L269 PolarHBondContact N-O 2.98Å; W261-L269 HydrophobicContact CB-CB 4.31Å; W261-L269 PolarHBondContact N-O 3.26Å; W261-L269 PolarHBondContact O-N 2.95Å; L269-I360 HydrophobicContact CD1-CG2 4.08Å; L269-V364 HydrophobicContact CD1-CG2 4.21Å; L269-V371 CarbonylContact C-O 3.59Å; L269-V371 WeakPolarHBondContact CA-O 3.39Å; L269-V371 HydrophobicContact CD1-CB 4.3Å; L269-V371 HydrophobicContact CD1-CG1 4.22Å; L269-L373 HydrophobicContact CD1-CD1 4.15Å; L269-L373 HydrophobicContact CD1-CD2 4.11Å; L269-L373 HydrophobicContact CD1-CG 3.91Å; L269-V389 HydrophobicContact CD2-CB 4.13Å; L269-V389 HydrophobicContact CD2-CG1 3.91Å
270	L	96.8	Very high	85.1	Confident	0 Å²	0	28.8 Å²	28.8	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	153.1	-179.1	-69.9	73.6	0	0	0	111	W214 P257 R258 D268 A295 S370 V371 I372 L373	W214-L270 HydrophobicContact CH2-CD1 4.22Å; W214-L270 HydrophobicContact CH2-CD2 3.94Å; W214-L270 HydrophobicContact CH2-CG 3.95Å; W214-L270 HydrophobicContact CZ2-CD1 4.22Å; W214-L270 HydrophobicContact CZ2-CG 4.44Å; P257-L270 HydrophobicContact CB-CD2 4.08Å; R258-L270 CarbonylContact O-C 3.37Å; R258-L270 VanDerWaalsContact O-CA 3.24Å; R258-L270 WeakPolarHBondContact O-CA 3.27Å; D268-L270 HydrophobicContact CB-CD1 3.61Å; D268-L270 WeakPolarHBondContact O-CD1 3.47Å; L270-A295 HydrophobicContact CD2-CB 4.22Å; L270-S370 WeakPolarHBondContact CD1-OG 3.21Å; L270-V371 PolarHBondContact N-O 3.22Å; L270-I372 HydrophobicContact CB-CB 4.41Å; L270-I372 HydrophobicContact CB-CG1 3.89Å; L270-I372 HydrophobicContact CB-CG2 4.45Å; L270-I372 HydrophobicContact CD2-CG1 4.21Å; L270-I372 HydrophobicContact CG-CG1 4.47Å; L270-L373 PolarHBondContact O-N 3.48Å
271	R	95.3	Very high	83.9	Confident	3 Å²	3	28.7 Å²	28.7	1%	0.011	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	136	172.5	-71.4	176.3	58.2	176.6	5.2	110.4	P257 R258 L373 D378 G383 E410	P257-R271 WeakPolarHBondContact CA-O 3.36Å; R258-R271 PolarHBondContact N-O 3.05Å; R258-R271 VanDerWaalsContact N-O 3.13Å; R258-R271 PolarHBondContact O-N 3.16Å; R271-L373 HydrophobicContact CG-CB 4.49Å; R271-L373 HydrophobicContact CG-CD1 4.42Å; R271-D378 IonicContact CZ-OD1 3.79Å; R271-D378 IonicContact NE-OD1 2.79Å; R271-D378 PolarHBondContact NE-OD1 3.1Å; R271-D378 IonicContact NH2-OD1 2.78Å; R271-D378 PolarHBondContact NH2-OD1 3.06Å; R271-G383 VanDerWaalsContact CZ-CA 3.42Å; R271-G383 VanDerWaalsContact NH1-CA 3.33Å; R271-E410 WeakPolarHBondContact CD-OE2 3.25Å; R271-E410 IonicContact CZ-OE2 2.72Å; R271-E410 IonicContact NE-OE2 3.89Å; R271-E410 PolarHBondContact NH1-O 3.49Å; R271-E410 IonicContact NH1-OE2 3.67Å; R271-E410 PolarHBondContact NH1-OE2 3.34Å
272	C	93.2	Very high	83	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	155.5	171.5	62.5	0	0	0	0	112.4	F251 P257 I372 L373 E375 D378 N382	F251-C272 HydrophobicContact CD1-CB 4.2Å; F251-C272 HydrophobicContact CE1-CB 4.15Å; P257-C272 HydrophobicContact CB-CB 4.33Å; P257-C272 HydrophobicContact CG-CB 4.04Å; C272-I372 WeakPolarHBondContact SG-CG2 3.36Å; C272-L373 PolarHBondContact N-O 3.46Å; C272-E375 PolarHBondContact O-N 3.42Å; C272-D378 VanDerWaalsContact C-CB 3.41Å; C272-D378 WeakPolarHBondContact O-CB 3.38Å; C272-N382 PolarHBondContact O-ND2 3.17Å; C272-N382 VanDerWaalsContact O-ND2 3.12Å
273	G	90.4	Very high	82	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	167.7	165.9	0	0	0	0	0	111.4	F251 R255 E375	F251-G273 VanDerWaalsContact CD1-O 3.3Å; F251-G273 WeakPolarHBondContact CD1-O 3.43Å; R255-G273 PolarHBondContact O-N 3.5Å; G273-E375 CarbonylContact C-O 3.6Å; G273-E375 WeakPolarHBondContact CA-O 3.16Å
274	G	84.7	Confident	81.3	Confident	7 Å²	7	44 Å²	44	7%	0.072	24%	0.242	C	C	.	.	P	Polyproline II helix	trans	-70	151.8	171.4	0	0	0	0	0	111.2	H252 Y276 E375 R376	H252-G274 WeakPolarHBondContact CB-O 3.5Å; H252-G274 PolarHBondContact N-O 3.22Å; H252-G274 PolarHBondContact ND1-O 3.27Å; G274-Y276 PolarHBondContact O-N 2.89Å; G274-E375 PolarHBondContact N-O 2.91Å; G274-R376 PolarHBondContact N-O 3.32Å
275	F	82.4	Confident	81.3	Confident	28 Å²	28	43.3 Å²	43.3	12%	0.123	24%	0.237	C	C	.	.	B	Isolated β-bridge	trans	-56.1	138.1	172	-69.1	-61.2	0	0	0	112.1	F251 H252 T277 V289 L293 C576 W578	F251-F275 HydrophobicContact CD1-CD1 4.09Å; F251-F275 HydrophobicContact CD1-CE1 4.29Å; F251-F275 AromaticContact CE1-CD1 3.71Å; F251-F275 HydrophobicContact CE1-CD1 3.71Å; F251-F275 AromaticContact CE1-CE1 3.45Å; F251-F275 HydrophobicContact CE1-CE1 3.45Å; F251-F275 VanDerWaalsContact CE1-CE1 3.45Å; F251-F275 HydrophobicContact CE1-CZ 4.14Å; F251-F275 HydrophobicContact CE2-CE1 4.38Å; F251-F275 HydrophobicContact CZ-CD1 4.05Å; F251-F275 AromaticContact CZ-CE1 3.51Å; F251-F275 HydrophobicContact CZ-CE1 3.51Å; F251-F275 HydrophobicContact CZ-CZ 4.33Å; H252-F275 PolarHBondContact CE1-O 3.22Å; H252-F275 PolarHBondContact ND1-O 3.42Å; F275-T277 PolarHBondContact O-N 2.67Å; F275-V289 HydrophobicContact CE1-CG1 4.11Å; F275-L293 HydrophobicContact CZ-CD1 4.28Å; F275-C576 HydrophobicContact CE1-CB 4.5Å; F275-C576 HydrophobicContact CZ-CB 4.07Å; F275-W578 HydrophobicContact CB-CH2 3.54Å; F275-W578 HydrophobicContact CB-CZ2 4.26Å; F275-W578 HydrophobicContact CB-CZ3 3.82Å; F275-W578 AromaticContact CD1-CH2 3.16Å; F275-W578 HydrophobicContact CD1-CH2 3.16Å; F275-W578 AromaticContact CD1-CZ2 3.08Å; F275-W578 HydrophobicContact CD1-CZ2 3.08Å; F275-W578 HydrophobicContact CD1-CZ3 4.2Å; F275-W578 HydrophobicContact CE1-CH2 4Å; F275-W578 AromaticContact CE1-CZ2 3.41Å; F275-W578 HydrophobicContact CE1-CZ2 3.41Å; F275-W578 VanDerWaalsContact CE1-CZ2 3.41Å; F275-W578 AromaticContact CG-CH2 3.6Å; F275-W578 HydrophobicContact CG-CH2 3.6Å; F275-W578 AromaticContact CG-CZ2 3.81Å; F275-W578 HydrophobicContact CG-CZ2 3.81Å; F275-W578 HydrophobicContact CG-CZ3 4.24Å; F275-W578 HydrophobicContact CZ-CZ2 4.39Å
276	Y	72.7	Confident	81.4	Confident	118 Å²	118	44.5 Å²	44.5	46%	0.463	24%	0.237	S	C	.	.	P	Polyproline II helix	trans	-75.5	119.3	177.5	-173.3	-111.7	0	0	0	109.9	H250 G274 A278 S279	H250-Y276 WeakPolarHBondContact O-CB 3.3Å; H250-Y276 PolarHBondContact O-N 2.75Å; G274-Y276 PolarHBondContact O-N 2.89Å; Y276-A278 HydrophobicContact CD1-CB 4.28Å; Y276-A278 HydrophobicContact CE1-CB 3.82Å; Y276-A278 PolarHBondContact O-N 2.84Å; Y276-S279 VanDerWaalsContact O-CB 3.25Å; Y276-S279 WeakPolarHBondContact O-CB 3.17Å; Y276-S279 PolarHBondContact O-N 2.89Å
277	T	62.7	Low	81.2	Confident	129 Å²	129	50.6 Å²	50.6	79%	0.791	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-21.5	-166.7	50.4	0	0	0	0	115.2	F275	F275-T277 PolarHBondContact O-N 2.67Å
278	A	62.9	Low	81	Confident	78 Å²	78	50.7 Å²	50.7	65%	0.645	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.3	10.1	-179.8	0	0	0	0	0	113.6	Y276	Y276-A278 HydrophobicContact CD1-CB 4.28Å; Y276-A278 HydrophobicContact CE1-CB 3.82Å; Y276-A278 PolarHBondContact O-N 2.84Å
279	S	67.9	Low	80.7	Confident	19 Å²	19	50.4 Å²	50.4	13%	0.133	26%	0.257	C	S	.	.			trans	-79.1	119.5	178.7	159.6	0	0	0	0	110.7	H250 Y276 P281	H250-S279 PolarHBondContact ND1-OG 3.15Å; Y276-S279 VanDerWaalsContact O-CB 3.25Å; Y276-S279 WeakPolarHBondContact O-CB 3.17Å; Y276-S279 PolarHBondContact O-N 2.89Å; S279-P281 VanDerWaalsContact O-CD 3.3Å; S279-P281 WeakPolarHBondContact O-CD 3.47Å
280	D	68.3	Low	80.2	Confident	108 Å²	108	53 Å²	53	58%	0.578	27%	0.269	S	S	*	.			trans	-106.6	85.8	164	-170	0.9	0	0	0	108.5	N282 R579	D280-N282 PolarHBondContact O-N 3.02Å; D280-R579 IonicContact OD1-CZ 3.84Å; D280-R579 VanDerWaalsContact OD1-CZ 3.28Å; D280-R579 IonicContact OD1-NH1 2.92Å; D280-R579 PolarHBondContact OD1-NH1 2.98Å; D280-R579 IonicContact OD1-NH2 3.75Å; D280-R579 PolarHBondContact OD1-NH2 2.85Å; D280-R579 IonicContact OD2-CZ 3.47Å; D280-R579 IonicContact OD2-NH1 2.97Å; D280-R579 PolarHBondContact OD2-NH1 3.28Å; D280-R579 IonicContact OD2-NH2 2.74Å
281	P	70.4	Confident	79.8	Confident	1 Å²	1	55.4 Å²	55.4	1%	0.006	29%	0.286	C	S	.	.			trans	-69.2	133.8	-177.3	29.8	-33.1	0	0	0	109.6	S279 D285 I286 W578	S279-P281 VanDerWaalsContact O-CD 3.3Å; S279-P281 WeakPolarHBondContact O-CD 3.47Å; P281-D285 HydrophobicContact CB-CB 3.98Å; P281-I286 HydrophobicContact CB-CG1 3.73Å; P281-I286 HydrophobicContact CG-CD1 4.07Å; P281-I286 HydrophobicContact CG-CG1 3.53Å; P281-W578 HydrophobicContact CG-CB 4.41Å; P281-W578 HydrophobicContact CG-CD2 3.84Å; P281-W578 HydrophobicContact CG-CG 3.78Å; P281-W578 HydrophobicContact CG-CZ2 4.49Å
282	N	76.5	Confident	79.6	Confident	83 Å²	83	55.3 Å²	55.3	44%	0.444	29%	0.286	S	S	.	.			trans	-68.6	172.5	170.3	67.3	47.2	0	0	0	110.1	D280 E284 D285 I286	D280-N282 PolarHBondContact O-N 3.02Å; N282-E284 PolarHBondContact O-N 3.04Å; N282-E284 VanDerWaalsContact O-N 3.17Å; N282-E284 WeakPolarHBondContact OD1-CA 3.31Å; N282-E284 WeakPolarHBondContact OD1-CB 3.46Å; N282-E284 PolarHBondContact OD1-N 2.56Å; N282-D285 PolarHBondContact ND2-OD2 3.33Å; N282-D285 PolarHBondContact O-N 3.27Å; N282-D285 VanDerWaalsContact O-N 3.16Å; N282-D285 VanDerWaalsContact OD1-CG 3.31Å; N282-D285 PolarHBondContact OD1-N 3.42Å; N282-D285 PolarHBondContact OD1-OD2 2.83Å; N282-I286 WeakPolarHBondContact O-CG1 3.3Å; N282-I286 PolarHBondContact O-N 2.65Å
283	K	73.2	Confident	79.4	Confident	163 Å²	163	55.3 Å²	55.3	71%	0.709	29%	0.286	S	S	*	.	H	α-helix	trans	-59	-30.9	-177.6	-171.8	175.9	179.9	179	0	113.7	R287	K283-R287 WeakPolarHBondContact O-CG 3.4Å; K283-R287 PolarHBondContact O-N 3.01Å
284	E	76.2	Confident	79.3	Confident	116 Å²	116	56.4 Å²	56.4	54%	0.542	29%	0.291	S	S	.	.	H	α-helix	trans	-77.5	-33.9	-180	-59.9	-173.6	167.5	0	0	112.3	R246 N282 A288	R246-E284 VanDerWaalsContact NH1-C 3.33Å; R246-E284 PolarHBondContact NH1-O 2.99Å; R246-E284 VanDerWaalsContact NH1-O 3.15Å; N282-E284 PolarHBondContact O-N 3.04Å; N282-E284 VanDerWaalsContact O-N 3.17Å; N282-E284 WeakPolarHBondContact OD1-CA 3.31Å; N282-E284 WeakPolarHBondContact OD1-CB 3.46Å; N282-E284 PolarHBondContact OD1-N 2.56Å; E284-A288 PolarHBondContact O-N 3.31Å
285	D	83.3	Confident	79.4	Confident	21 Å²	21	56.6 Å²	56.6	11%	0.112	29%	0.292	C	S	.	.	H	α-helix	trans	-73.9	-40.9	177.6	-63.1	-25.8	0	0	0	111.1	R246 H250 P281 N282 R287 A288 V289	R246-D285 WeakPolarHBondContact CD-OD1 3.29Å; R246-D285 IonicContact CZ-OD1 2.7Å; R246-D285 IonicContact NH1-OD1 3.27Å; R246-D285 PolarHBondContact NH1-OD1 3.2Å; H250-D285 VanDerWaalsContact NE2-CB 3.33Å; H250-D285 WeakPolarHBondContact NE2-CB 3.4Å; H250-D285 IonicContact NE2-OD2 2.98Å; P281-D285 HydrophobicContact CB-CB 3.98Å; N282-D285 PolarHBondContact ND2-OD2 3.33Å; N282-D285 PolarHBondContact O-N 3.27Å; N282-D285 VanDerWaalsContact O-N 3.16Å; N282-D285 VanDerWaalsContact OD1-CG 3.31Å; N282-D285 PolarHBondContact OD1-N 3.42Å; N282-D285 PolarHBondContact OD1-OD2 2.83Å; D285-R287 VanDerWaalsContact C-N 3.32Å; D285-R287 PolarHBondContact O-N 3.27Å; D285-A288 PolarHBondContact O-N 3.06Å; D285-A288 VanDerWaalsContact O-N 3.15Å; D285-V289 WeakPolarHBondContact O-CG2 3.44Å; D285-V289 PolarHBondContact O-N 2.74Å
286	I	82.4	Confident	79.4	Confident	47 Å²	47	57.7 Å²	57.7	24%	0.241	31%	0.311	C	S	.	.	H	α-helix	trans	-56.2	-48.2	173.3	-66.1	171.2	0	0	0	110.3	P281 N282 A288 V289 E290	P281-I286 HydrophobicContact CB-CG1 3.73Å; P281-I286 HydrophobicContact CG-CD1 4.07Å; P281-I286 HydrophobicContact CG-CG1 3.53Å; N282-I286 WeakPolarHBondContact O-CG1 3.3Å; N282-I286 PolarHBondContact O-N 2.65Å; I286-A288 VanDerWaalsContact C-N 3.29Å; I286-A288 PolarHBondContact O-N 2.71Å; I286-V289 PolarHBondContact O-N 3.32Å; I286-E290 HydrophobicContact CG2-CG 4.24Å; I286-E290 WeakPolarHBondContact O-CG 3.43Å; I286-E290 PolarHBondContact O-N 3.49Å
287	R	83.6	Confident	80.1	Confident	136 Å²	136	53 Å²	53	51%	0.513	29%	0.293	S	S	.	.	H	α-helix	trans	-60.4	-39	178.8	-75.6	-170.9	-65.2	-175.1	3.1	112.5	K283 D285 S291	K283-R287 WeakPolarHBondContact O-CG 3.4Å; K283-R287 PolarHBondContact O-N 3.01Å; D285-R287 VanDerWaalsContact C-N 3.32Å; D285-R287 PolarHBondContact O-N 3.27Å; R287-S291 VanDerWaalsContact O-CB 3.31Å; R287-S291 WeakPolarHBondContact O-CB 3.3Å; R287-S291 PolarHBondContact O-N 2.8Å; R287-S291 PolarHBondContact O-OG 2.92Å
288	A	86.9	Confident	81	Confident	2 Å²	2	48.7 Å²	48.7	2%	0.017	27%	0.268	C	S	.	.	H	α-helix	trans	-66.1	-43.8	176.3	0	0	0	0	0	111.5	E243 A247 E284 D285 I286 S291 M292	E243-A288 HydrophobicContact CB-CB 4.3Å; A247-A288 HydrophobicContact CB-CB 4.26Å; E284-A288 PolarHBondContact O-N 3.31Å; D285-A288 PolarHBondContact O-N 3.06Å; D285-A288 VanDerWaalsContact O-N 3.15Å; I286-A288 VanDerWaalsContact C-N 3.29Å; I286-A288 PolarHBondContact O-N 2.71Å; A288-S291 PolarHBondContact O-N 2.82Å; A288-M292 WeakPolarHBondContact O-CB 3.46Å; A288-M292 VanDerWaalsContact O-CG 3.27Å; A288-M292 WeakPolarHBondContact O-CG 3.37Å; A288-M292 PolarHBondContact O-N 2.85Å
289	V	88.2	Confident	82	Confident	0 Å²	0	46 Å²	46	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-61.5	-48.3	176.3	173.2	0	0	0	0	111.2	A247 F251 F275 D285 I286 S291 M292 L293	A247-V289 HydrophobicContact CB-CG2 3.87Å; F251-V289 HydrophobicContact CE2-CG1 4.11Å; F251-V289 HydrophobicContact CE2-CG2 4.24Å; F251-V289 HydrophobicContact CZ-CG1 3.88Å; F275-V289 HydrophobicContact CE1-CG1 4.11Å; D285-V289 WeakPolarHBondContact O-CG2 3.44Å; D285-V289 PolarHBondContact O-N 2.74Å; I286-V289 PolarHBondContact O-N 3.32Å; V289-S291 PolarHBondContact O-N 2.81Å; V289-M292 WeakPolarHBondContact O-CB 3.43Å; V289-M292 PolarHBondContact O-N 3.42Å; V289-L293 HydrophobicContact CG1-CD1 3.83Å; V289-L293 HydrophobicContact CG1-CG 4.43Å; V289-L293 WeakPolarHBondContact O-CG 3.47Å; V289-L293 PolarHBondContact O-N 2.82Å
290	E	86.9	Confident	83	Confident	53 Å²	53	45.1 Å²	45.1	25%	0.248	24%	0.237	C	C	.	.	H	α-helix	trans	-61.6	-43.2	178.4	-71.4	-179.6	156.9	0	0	111.9	I286 M292 L293 Q294 L575	I286-E290 HydrophobicContact CG2-CG 4.24Å; I286-E290 WeakPolarHBondContact O-CG 3.43Å; I286-E290 PolarHBondContact O-N 3.49Å; E290-M292 VanDerWaalsContact C-N 3.31Å; E290-M292 PolarHBondContact O-N 3.35Å; E290-L293 PolarHBondContact O-N 3.45Å; E290-Q294 WeakPolarHBondContact O-CB 3.39Å; E290-Q294 WeakPolarHBondContact O-CG 3.47Å; E290-Q294 PolarHBondContact O-N 2.78Å; E290-L575 HydrophobicContact CB-CD1 4.02Å; E290-L575 HydrophobicContact CG-CB 4.17Å; E290-L575 HydrophobicContact CG-CD1 3.96Å
291	S	87.9	Confident	84	Confident	51 Å²	51	40 Å²	40	36%	0.357	21%	0.21	S	C	.	.	H	α-helix	trans	-62.5	-39	176.9	-58.8	0	0	0	0	111.8	R287 A288 V289 A295	R287-S291 VanDerWaalsContact O-CB 3.31Å; R287-S291 WeakPolarHBondContact O-CB 3.3Å; R287-S291 PolarHBondContact O-N 2.8Å; R287-S291 PolarHBondContact O-OG 2.92Å; A288-S291 PolarHBondContact O-N 2.82Å; V289-S291 PolarHBondContact O-N 2.81Å; S291-A295 PolarHBondContact O-N 3.41Å
292	M	90.5	Very high	84.9	Confident	1 Å²	1	40.4 Å²	40.4	1%	0.005	21%	0.211	C	C	.	.	H	α-helix	trans	-66.1	-42.5	175.9	-76.7	-66.5	-72.7	0	0	112.3	V235 I239 V244 A247 F248 P257 A288 V289 E290	V235-M292 HydrophobicContact CB-CE 4.3Å; V235-M292 HydrophobicContact CG1-CE 4.04Å; I239-M292 HydrophobicContact CB-SD 4.19Å; I239-M292 HydrophobicContact CD1-CB 4.38Å; I239-M292 HydrophobicContact CD1-CG 3.8Å; I239-M292 HydrophobicContact CD1-SD 3.35Å; I239-M292 WeakPolarHBondContact CD1-SD 3.35Å; I239-M292 HydrophobicContact CG1-SD 4.34Å; I239-M292 HydrophobicContact CG2-CG 4.41Å; I239-M292 HydrophobicContact CG2-SD 3.75Å; V244-M292 HydrophobicContact CG1-CE 4.42Å; V244-M292 HydrophobicContact CG2-CE 4.24Å; V244-M292 HydrophobicContact CG2-SD 4.14Å; A247-M292 HydrophobicContact CB-CG 4.2Å; F248-M292 HydrophobicContact CE1-CE 3.58Å; F248-M292 HydrophobicContact CZ-CE 4.25Å; P257-M292 HydrophobicContact CB-CB 4.46Å; P257-M292 HydrophobicContact CG-CB 4.39Å; P257-M292 WeakPolarHBondContact O-CE 3.17Å; A288-M292 WeakPolarHBondContact O-CB 3.46Å; A288-M292 VanDerWaalsContact O-CG 3.27Å; A288-M292 WeakPolarHBondContact O-CG 3.37Å; A288-M292 PolarHBondContact O-N 2.85Å; V289-M292 WeakPolarHBondContact O-CB 3.43Å; V289-M292 PolarHBondContact O-N 3.42Å; E290-M292 VanDerWaalsContact C-N 3.31Å; E290-M292 PolarHBondContact O-N 3.35Å
293	L	89.4	Confident	85.6	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-69.2	-41.1	178.1	-67.6	166.7	0	0	0	111.5	P257 F275 V289 E290 A295 S370 I372 L575	P257-L293 HydrophobicContact CB-CD2 4.06Å; P257-L293 HydrophobicContact CG-CD2 3.38Å; P257-L293 HydrophobicContact CG-CG 3.95Å; F275-L293 HydrophobicContact CZ-CD1 4.28Å; V289-L293 HydrophobicContact CG1-CD1 3.83Å; V289-L293 HydrophobicContact CG1-CG 4.43Å; V289-L293 WeakPolarHBondContact O-CG 3.47Å; V289-L293 PolarHBondContact O-N 2.82Å; E290-L293 PolarHBondContact O-N 3.45Å; L293-A295 VanDerWaalsContact C-N 3.32Å; L293-A295 PolarHBondContact O-N 3.13Å; L293-S370 WeakPolarHBondContact O-CB 3.17Å; L293-S370 PolarHBondContact O-OG 3Å; L293-I372 HydrophobicContact CB-CD1 3.93Å; L293-I372 HydrophobicContact CD2-CD1 3.77Å; L293-I372 HydrophobicContact CD2-CG1 4.34Å; L293-I372 HydrophobicContact CD2-CG2 4.15Å; L293-I372 HydrophobicContact CG-CD1 4.44Å; L293-I372 WeakPolarHBondContact O-CD1 3.44Å; L293-L575 HydrophobicContact CB-CD2 4.3Å; L293-L575 HydrophobicContact CD1-CB 4.45Å; L293-L575 HydrophobicContact CD1-CD2 4.39Å
294	Q	88.1	Confident	86	Confident	23 Å²	23	29.7 Å²	29.7	11%	0.107	16%	0.162	C	C	.	.	H	α-helix	trans	-64	-38.6	176.8	-74.1	163.3	20	0	0	112	E290 G296 H297 V300 P558 L575	E290-Q294 WeakPolarHBondContact O-CB 3.39Å; E290-Q294 WeakPolarHBondContact O-CG 3.47Å; E290-Q294 PolarHBondContact O-N 2.78Å; Q294-G296 PolarHBondContact O-N 3.25Å; Q294-H297 VanDerWaalsContact O-CB 3.31Å; Q294-H297 WeakPolarHBondContact O-CB 3.5Å; Q294-H297 PolarHBondContact O-CD2 3.16Å; Q294-H297 PolarHBondContact O-N 3.41Å; Q294-V300 HydrophobicContact CB-CG2 4.44Å; Q294-V300 HydrophobicContact CG-CG2 3.98Å; Q294-P558 HydrophobicContact CG-CB 4.31Å; Q294-P558 VanDerWaalsContact NE2-CD 3.31Å; Q294-L575 HydrophobicContact CG-CD1 4.06Å
295	A	86.3	Confident	86.4	Confident	12 Å²	12	24.1 Å²	24.1	10%	0.099	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.5	28.8	-176.1	0	0	0	0	0	114.2	W214 P236 L270 S291 L293	W214-A295 HydrophobicContact CH2-CB 3.6Å; W214-A295 HydrophobicContact CZ2-CB 3.44Å; W214-A295 VanDerWaalsContact CZ2-CB 3.44Å; P236-A295 HydrophobicContact CG-CB 3.99Å; L270-A295 HydrophobicContact CD2-CB 4.22Å; S291-A295 PolarHBondContact O-N 3.41Å; L293-A295 VanDerWaalsContact C-N 3.32Å; L293-A295 PolarHBondContact O-N 3.13Å
296	G	83.8	Confident	86.1	Confident	50 Å²	50	28.2 Å²	28.2	52%	0.515	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	84.9	3.6	-176.7	0	0	0	0	0	115.1	Q294	Q294-G296 PolarHBondContact O-N 3.25Å
297	H	86.4	Confident	85.6	Confident	19 Å²	19	29.1 Å²	29.1	9%	0.088	16%	0.161	C	C	.	.			trans	-91.5	147	172.8	-60.6	-72	0	0	0	111.6	G266 D268 Q294 V368	G266-H297 PolarHBondContact O-CE1 3.35Å; D268-H297 IonicContact OD2-CD2 2.78Å; D268-H297 IonicContact OD2-CE1 3.64Å; D268-H297 IonicContact OD2-NE2 3.64Å; D268-H297 PolarHBondContact OD2-NE2 2.9Å; Q294-H297 VanDerWaalsContact O-CB 3.31Å; Q294-H297 WeakPolarHBondContact O-CB 3.5Å; Q294-H297 PolarHBondContact O-CD2 3.16Å; Q294-H297 PolarHBondContact O-N 3.41Å; H297-V368 WeakPolarHBondContact ND1-CG1 3.26Å
298	S	81.3	Confident	85.3	Confident	40 Å²	40	25 Å²	25	28%	0.28	15%	0.148	S	C	.	.	S	Bend	trans	-82.9	-31.8	176.7	63.7	0	0	0	0	112.3	P558 S559 S560	S298-P558 CarbonylContact O-C 3.18Å; S298-P558 VanDerWaalsContact O-CA 3.23Å; S298-P558 WeakPolarHBondContact O-CA 3.34Å; S298-P558 WeakPolarHBondContact O-CB 3.21Å; S298-S559 WeakPolarHBondContact CB-OG 3.39Å; S298-S559 PolarHBondContact O-N 3.19Å; S298-S559 PolarHBondContact O-OG 3Å; S298-S559 VanDerWaalsContact O-OG 3.11Å; S298-S559 PolarHBondContact OG-OG 2.72Å; S298-S560 PolarHBondContact O-N 3.31Å
299	D	84.4	Confident	85.4	Confident	22 Å²	22	25.6 Å²	25.6	12%	0.118	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	131.2	177.6	-66.4	-25.4	0	0	0	110.8	R369 S370 S559 S560	D299-R369 HydrophobicContact CB-CB 4.1Å; D299-R369 WeakPolarHBondContact O-CB 3.43Å; D299-S370 PolarHBondContact O-N 2.86Å; D299-S559 PolarHBondContact OD1-OG 3.24Å; D299-S560 WeakPolarHBondContact CA-O 3.47Å; D299-S560 VanDerWaalsContact CG-OG 3.24Å; D299-S560 PolarHBondContact OD1-OG 3.41Å
300	V	88.6	Confident	85.7	Confident	0 Å²	0	26 Å²	26	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	133.2	-177.4	-173.8	0	0	0	0	110.5	Q294 S370 I372 P558 S560 V561 W562 L575	Q294-V300 HydrophobicContact CB-CG2 4.44Å; Q294-V300 HydrophobicContact CG-CG2 3.98Å; V300-S370 CarbonylContact C-O 3.6Å; V300-S370 WeakPolarHBondContact CA-O 3.45Å; V300-I372 HydrophobicContact CG1-CD1 3.33Å; V300-P558 HydrophobicContact CG2-CB 4.44Å; V300-S560 PolarHBondContact N-O 3.28Å; V300-V561 CarbonylContact O-C 3.6Å; V300-V561 WeakPolarHBondContact O-CA 3.38Å; V300-W562 PolarHBondContact O-N 3.2Å; V300-L575 HydrophobicContact CB-CD2 3.98Å; V300-L575 HydrophobicContact CG1-CD2 3.67Å; V300-L575 HydrophobicContact CG2-CD2 4.27Å
301	V	89	Confident	85.9	Confident	0 Å²	0	26 Å²	26	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	115	175.9	-173.5	0	0	0	0	109.5	V303 L363 S370 V371 I372 W562 F564 L569	V301-V303 HydrophobicContact CG1-CG2 4.37Å; V301-L363 HydrophobicContact CG1-CD1 4.19Å; V301-S370 PolarHBondContact N-O 2.72Å; V301-V371 WeakPolarHBondContact O-CA 3.48Å; V301-I372 PolarHBondContact O-N 3.37Å; V301-W562 CarbonylContact C-O 3.56Å; V301-W562 WeakPolarHBondContact CA-O 3.37Å; V301-W562 HydrophobicContact CG1-CB 4.49Å; V301-W562 HydrophobicContact CG2-CB 4.35Å; V301-F564 HydrophobicContact CG1-CB 3.93Å; V301-L569 HydrophobicContact CG1-CD2 3.96Å
302	L	90.4	Very high	86.2	Confident	9 Å²	9	25.8 Å²	25.8	5%	0.047	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	122.6	170.8	-62	178.4	0	0	0	108.9	I372 W562 L563 F564 L572	L302-I372 HydrophobicContact CD2-CB 3.99Å; L302-I372 HydrophobicContact CD2-CD1 3.59Å; L302-I372 HydrophobicContact CD2-CG1 4.44Å; L302-I372 HydrophobicContact CD2-CG2 4.23Å; L302-W562 PolarHBondContact N-O 3.06Å; L302-L563 HydrophobicContact CB-CD1 4.31Å; L302-L563 CarbonylContact O-C 3.6Å; L302-L563 WeakPolarHBondContact O-CA 3.28Å; L302-F564 PolarHBondContact O-N 2.71Å; L302-L572 HydrophobicContact CD1-CD1 3.95Å
303	V	90.2	Very high	86.3	Confident	1 Å²	1	29.1 Å²	29.1	1%	0.006	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	112.2	177.8	-179.6	0	0	0	0	108.5	V301 K356 I360 V371 I372 L373 Q374 F564	V301-V303 HydrophobicContact CG1-CG2 4.37Å; V303-K356 VanDerWaalsContact CG1-CE 3.48Å; V303-I360 HydrophobicContact CG1-CD1 4.05Å; V303-I360 HydrophobicContact CG1-CG1 4.12Å; V303-I360 HydrophobicContact CG2-CG1 4.35Å; V303-V371 HydrophobicContact CG2-CG1 3.79Å; V303-I372 PolarHBondContact N-O 2.99Å; V303-L373 HydrophobicContact CB-CD2 3.95Å; V303-L373 HydrophobicContact CG1-CD2 4.14Å; V303-L373 HydrophobicContact CG2-CD2 4.24Å; V303-Q374 PolarHBondContact O-N 3.01Å; V303-F564 HydrophobicContact CG1-CD1 4.09Å; V303-F564 HydrophobicContact CG2-CB 4.23Å; V303-F564 HydrophobicContact CG2-CD1 4.29Å
304	D	82.4	Confident	86.6	Confident	20 Å²	20	32 Å²	32	11%	0.107	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	122.3	172.3	-174.3	4.5	0	0	0	109.7	M306 L563 F564 L585	D304-M306 WeakPolarHBondContact OD1-CB 3.5Å; D304-M306 PolarHBondContact OD1-N 3.48Å; D304-L563 HydrophobicContact CB-CD1 4.28Å; D304-F564 PolarHBondContact N-O 3.38Å; D304-L585 VanDerWaalsContact OD2-CD2 3.27Å; D304-L585 WeakPolarHBondContact OD2-CD2 3.37Å
305	T	83.7	Confident	86.9	Confident	0 Å²	0	31 Å²	31	0%	0	19%	0.192	C	C	.	.			trans	-93.1	-13.6	177.9	68.5	0	0	0	0	112.9	L309 Q374 E375 N382 L385	T305-L309 WeakPolarHBondContact O-CB 3.34Å; T305-Q374 PolarHBondContact N-O 3.37Å; T305-Q374 PolarHBondContact OG1-O 3.23Å; T305-Q374 VanDerWaalsContact OG1-O 3.1Å; T305-E375 WeakPolarHBondContact OG1-CB 3.37Å; T305-N382 WeakPolarHBondContact CG2-OD1 3.39Å; T305-L385 HydrophobicContact CG2-CD1 3.57Å
306	M	76.6	Confident	87.4	Confident	106 Å²	106	31.5 Å²	31.5	52%	0.522	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.6	-23.4	-167.4	-61.5	-63.3	-58.4	0	0	114	D304 E375 R376	D304-M306 WeakPolarHBondContact OD1-CB 3.5Å; D304-M306 PolarHBondContact OD1-N 3.48Å; M306-E375 HydrophobicContact SD-CG 4.21Å; M306-R376 HydrophobicContact SD-CB 4.4Å
307	D	72.6	Confident	87.9	Confident	66 Å²	66	33 Å²	33	35%	0.353	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.3	-28.2	-171.8	-165.5	28.7	0	0	0	113.5	R566	D307-R566 IonicContact OD1-CZ 3.56Å; D307-R566 IonicContact OD1-NE 3.49Å; D307-R566 IonicContact OD1-NH2 3.48Å; D307-R566 PolarHBondContact OD1-NH2 3.37Å; D307-R566 WeakPolarHBondContact OD2-CG 3.14Å; D307-R566 IonicContact OD2-CZ 2.63Å; D307-R566 VanDerWaalsContact OD2-CZ 3.23Å; D307-R566 IonicContact OD2-NE 3.48Å; D307-R566 PolarHBondContact OD2-NE 3.21Å; D307-R566 IonicContact OD2-NH2 3.59Å; D307-R566 PolarHBondContact OD2-NH2 3.48Å; D307-R566 VanDerWaalsContact OD2-NH2 3.13Å
308	E	77.3	Confident	88.4	Confident	50 Å²	50	32.3 Å²	32.3	23%	0.234	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.3	-27.1	-177.4	-71.3	178.8	-123.9	0	0	114.4	K356 R566 G567	E308-K356 IonicContact OE1-NZ 2.67Å; E308-K356 PolarHBondContact OE1-NZ 3.5Å; E308-K356 IonicContact OE2-NZ 2.69Å; E308-R566 HydrophobicContact CG-CG 4.35Å; E308-R566 WeakPolarHBondContact OE1-CA 3.21Å; E308-R566 PolarHBondContact OE1-N 3.01Å; E308-G567 PolarHBondContact OE1-N 3.08Å
309	L	90	Very high	89	Confident	14 Å²	14	30.5 Å²	30.5	7%	0.073	17%	0.173	C	C	.	.	S	Bend	trans	-96.4	154.4	-175.8	-64.1	-178.2	0	0	0	111.6	T305 A352 K356 L381 L385	T305-L309 WeakPolarHBondContact O-CB 3.34Å; L309-A352 HydrophobicContact CD2-CB 4.14Å; L309-K356 HydrophobicContact CD2-CB 4.32Å; L309-L381 HydrophobicContact CB-CD1 3.8Å; L309-L381 HydrophobicContact CD1-CB 4.16Å; L309-L381 HydrophobicContact CD1-CD1 4.1Å; L309-L385 HydrophobicContact CD1-CD1 3.77Å; L309-L385 HydrophobicContact CD1-CD2 4.19Å; L309-L385 HydrophobicContact CD1-CG 4.04Å
310	P	93	Very high	89.3	Confident	8 Å²	8	32.7 Å²	32.7	5%	0.052	18%	0.184	C	C	.	.	P	Polyproline II helix	trans	-63.9	146.5	179	28.7	-38.8	0	0	0	112.2	D314 V315 Y349	P310-D314 HydrophobicContact CB-CB 3.95Å; P310-V315 HydrophobicContact CB-CG2 3.85Å; P310-V315 HydrophobicContact CG-CG2 3.61Å; P310-Y349 HydrophobicContact CB-CD1 3.7Å; P310-Y349 HydrophobicContact CB-CD2 3.82Å; P310-Y349 HydrophobicContact CB-CE1 3.75Å; P310-Y349 HydrophobicContact CB-CE2 3.84Å; P310-Y349 HydrophobicContact CB-CG 3.76Å; P310-Y349 HydrophobicContact CG-CD1 3.87Å; P310-Y349 HydrophobicContact CG-CD2 3.99Å; P310-Y349 HydrophobicContact CG-CE1 4.43Å; P310-Y349 HydrophobicContact CG-CG 3.65Å
311	S	92.7	Very high	89.6	Confident	55 Å²	55	38.6 Å²	38.6	39%	0.385	21%	0.206	S	C	.	.	P	Polyproline II helix	trans	-68.6	161.8	168.5	75.9	0	0	0	0	111.1	A313 D314 V315	S311-A313 PolarHBondContact O-N 3.46Å; S311-D314 WeakPolarHBondContact CB-OD2 3.49Å; S311-D314 PolarHBondContact N-OD2 3.01Å; S311-D314 VanDerWaalsContact N-OD2 3.15Å; S311-D314 WeakPolarHBondContact O-CB 3.35Å; S311-D314 PolarHBondContact O-N 2.83Å; S311-D314 PolarHBondContact OG-N 3.38Å; S311-D314 PolarHBondContact OG-OD2 2.97Å; S311-V315 WeakPolarHBondContact O-CG2 3.3Å; S311-V315 PolarHBondContact O-N 3.04Å
312	L	93.3	Very high	89.8	Confident	46 Å²	46	38.6 Å²	38.6	24%	0.241	21%	0.206	C	C	.	.	H	α-helix	trans	-56	-38.8	175.8	-63.7	176.2	0	0	0	112.4	D314 V315 Q316 D380 A431 V433	L312-D314 VanDerWaalsContact C-N 3.35Å; L312-V315 PolarHBondContact O-N 3.14Å; L312-Q316 PolarHBondContact O-N 2.91Å; L312-D380 HydrophobicContact CD2-CB 3.95Å; L312-A431 HydrophobicContact CB-CB 3.99Å; L312-A431 HydrophobicContact CD2-CB 4.07Å; L312-A431 WeakPolarHBondContact O-CB 3.08Å; L312-V433 HydrophobicContact CD2-CG2 3.59Å
313	A	93.3	Very high	89.8	Confident	71 Å²	71	40.7 Å²	40.7	59%	0.587	21%	0.214	S	C	*	.	H	α-helix	trans	-65.7	-38.4	177	0	0	0	0	0	112	S311 Q316 L317	S311-A313 PolarHBondContact O-N 3.46Å; A313-Q316 PolarHBondContact O-N 3.16Å; A313-L317 WeakPolarHBondContact O-CB 3.36Å; A313-L317 PolarHBondContact O-N 3.21Å
314	D	94.9	Very high	89.7	Confident	61 Å²	61	43.7 Å²	43.7	33%	0.326	24%	0.238	S	C	.	.	H	α-helix	trans	-64.9	-45	176	-66.7	-47.8	0	0	0	111.5	P310 S311 L312 Q316 L317 A318 Y349	P310-D314 HydrophobicContact CB-CB 3.95Å; S311-D314 WeakPolarHBondContact CB-OD2 3.49Å; S311-D314 PolarHBondContact N-OD2 3.01Å; S311-D314 VanDerWaalsContact N-OD2 3.15Å; S311-D314 WeakPolarHBondContact O-CB 3.35Å; S311-D314 PolarHBondContact O-N 2.83Å; S311-D314 PolarHBondContact OG-N 3.38Å; S311-D314 PolarHBondContact OG-OD2 2.97Å; L312-D314 VanDerWaalsContact C-N 3.35Å; D314-Q316 VanDerWaalsContact C-N 3.32Å; D314-Q316 PolarHBondContact O-N 3.46Å; D314-L317 PolarHBondContact O-N 3.17Å; D314-A318 WeakPolarHBondContact O-CB 3.46Å; D314-A318 PolarHBondContact O-N 2.86Å; D314-Y349 HydrophobicContact CB-CE2 4.01Å
315	V	95.7	Very high	90	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-59.5	-44.2	176.6	177.4	0	0	0	0	110.5	P310 S311 L312 A318 H319 W346 P432 L436	P310-V315 HydrophobicContact CB-CG2 3.85Å; P310-V315 HydrophobicContact CG-CG2 3.61Å; S311-V315 WeakPolarHBondContact O-CG2 3.3Å; S311-V315 PolarHBondContact O-N 3.04Å; L312-V315 PolarHBondContact O-N 3.14Å; V315-A318 PolarHBondContact O-N 2.72Å; V315-H319 WeakPolarHBondContact O-CB 3.36Å; V315-H319 PolarHBondContact O-N 3.38Å; V315-W346 HydrophobicContact CG1-CH2 4.45Å; V315-W346 HydrophobicContact CG1-CZ3 3.94Å; V315-P432 HydrophobicContact CG1-CG 4.3Å; V315-L436 HydrophobicContact CG1-CD2 4.37Å; V315-L436 HydrophobicContact CG2-CD2 4.15Å
316	Q	94.8	Very high	90.2	Very high	23 Å²	23	43.2 Å²	43.2	11%	0.107	24%	0.236	C	C	.	.	H	α-helix	trans	-64.6	-45.6	178	-178.9	59.4	4.1	0	0	112.6	L312 A313 D314 A318 H319 L320 E430 A431	L312-Q316 PolarHBondContact O-N 2.91Å; A313-Q316 PolarHBondContact O-N 3.16Å; D314-Q316 VanDerWaalsContact C-N 3.32Å; D314-Q316 PolarHBondContact O-N 3.46Å; Q316-A318 VanDerWaalsContact C-N 3.35Å; Q316-A318 PolarHBondContact O-N 3.43Å; Q316-H319 PolarHBondContact O-N 2.57Å; Q316-L320 HydrophobicContact CG-CD1 4.25Å; Q316-L320 WeakPolarHBondContact O-CG 3.39Å; Q316-L320 PolarHBondContact O-N 3.03Å; Q316-E430 WeakPolarHBondContact CB-O 3.18Å; Q316-E430 VanDerWaalsContact CG-O 3.24Å; Q316-E430 WeakPolarHBondContact CG-O 3.4Å; Q316-E430 PolarHBondContact NE2-OE1 3.15Å; Q316-E430 VanDerWaalsContact NE2-OE1 3.09Å; Q316-A431 HydrophobicContact CB-CB 4.46Å
317	L	94.8	Very high	90.4	Very high	83 Å²	83	38.9 Å²	38.9	44%	0.435	22%	0.215	S	C	.	.	H	α-helix	trans	-62.5	-43.6	178.6	178.5	60.4	0	0	0	111.4	A313 D314 H319 L320 R321	A313-L317 WeakPolarHBondContact O-CB 3.36Å; A313-L317 PolarHBondContact O-N 3.21Å; D314-L317 PolarHBondContact O-N 3.17Å; L317-H319 VanDerWaalsContact C-N 3.34Å; L317-H319 PolarHBondContact O-N 3.01Å; L317-L320 PolarHBondContact O-N 2.9Å; L317-R321 HydrophobicContact CD1-CG 4.48Å; L317-R321 WeakPolarHBondContact O-CG 3.42Å; L317-R321 PolarHBondContact O-N 3.14Å
318	A	96.6	Very high	90.1	Very high	3 Å²	3	38.2 Å²	38.2	3%	0.025	21%	0.214	C	C	.	.	H	α-helix	trans	-60.2	-44.8	175.8	0	0	0	0	0	111.5	D314 V315 Q316 L320 R321 L322 T344 W346 Y349	D314-A318 WeakPolarHBondContact O-CB 3.46Å; D314-A318 PolarHBondContact O-N 2.86Å; V315-A318 PolarHBondContact O-N 2.72Å; Q316-A318 VanDerWaalsContact C-N 3.35Å; Q316-A318 PolarHBondContact O-N 3.43Å; A318-L320 PolarHBondContact O-N 2.77Å; A318-R321 PolarHBondContact O-N 3.29Å; A318-L322 WeakPolarHBondContact O-CB 3.37Å; A318-L322 PolarHBondContact O-N 2.96Å; A318-T344 VanDerWaalsContact CA-O 3.28Å; A318-T344 WeakPolarHBondContact CA-O 3.48Å; A318-T344 WeakPolarHBondContact CB-O 3.48Å; A318-W346 HydrophobicContact CB-CE3 4.07Å; A318-Y349 HydrophobicContact CB-CD2 3.96Å; A318-Y349 HydrophobicContact CB-CE2 3.67Å
319	H	94.1	Very high	89.5	Confident	2 Å²	2	39.5 Å²	39.5	1%	0.009	22%	0.223	C	C	.	.	H	α-helix	trans	-61.8	-43.9	176.4	178.1	72.2	0	0	0	113	F138 V315 Q316 L317 R321 L322 R323 W346 P432	F138-H319 AromaticContact CE2-CE1 3.61Å; F138-H319 AromaticContact CZ-CE1 3.53Å; F138-H319 AromaticContact CZ-ND1 3.88Å; V315-H319 WeakPolarHBondContact O-CB 3.36Å; V315-H319 PolarHBondContact O-N 3.38Å; Q316-H319 PolarHBondContact O-N 2.57Å; L317-H319 VanDerWaalsContact C-N 3.34Å; L317-H319 PolarHBondContact O-N 3.01Å; H319-R321 VanDerWaalsContact C-N 3.35Å; H319-R321 PolarHBondContact O-N 3.05Å; H319-L322 PolarHBondContact O-N 2.97Å; H319-R323 WeakPolarHBondContact O-CB 3.41Å; H319-R323 PolarHBondContact O-N 2.95Å; H319-W346 HydrophobicContact CB-CE3 4.29Å; H319-W346 HydrophobicContact CB-CZ3 3.89Å; H319-P432 HydrophobicContact CB-CG 3.56Å; H319-P432 VanDerWaalsContact CG-CG 3.49Å
320	L	91.9	Very high	88.6	Confident	68 Å²	68	40 Å²	40	36%	0.356	23%	0.228	S	C	.	.	H	α-helix	trans	-63.3	-41.1	178.4	-71.6	175	0	0	0	111.8	Q316 L317 A318 R323 A324	Q316-L320 HydrophobicContact CG-CD1 4.25Å; Q316-L320 WeakPolarHBondContact O-CG 3.39Å; Q316-L320 PolarHBondContact O-N 3.03Å; L317-L320 PolarHBondContact O-N 2.9Å; A318-L320 PolarHBondContact O-N 2.77Å; L320-R323 PolarHBondContact O-N 3.27Å; L320-A324 WeakPolarHBondContact O-CB 3.45Å; L320-A324 PolarHBondContact O-N 3.25Å
321	R	93.5	Very high	87.3	Confident	125 Å²	125	45.6 Å²	45.6	47%	0.472	27%	0.267	S	S	.	.	H	α-helix	trans	-64	-45.5	174.5	-72	177.6	177.2	-177.3	1.8	111.6	L317 A318 H319 R323 A324 L325 G343 T344	L317-R321 HydrophobicContact CD1-CG 4.48Å; L317-R321 WeakPolarHBondContact O-CG 3.42Å; L317-R321 PolarHBondContact O-N 3.14Å; A318-R321 PolarHBondContact O-N 3.29Å; H319-R321 VanDerWaalsContact C-N 3.35Å; H319-R321 PolarHBondContact O-N 3.05Å; R321-R323 PolarHBondContact O-N 3.28Å; R321-A324 PolarHBondContact O-N 3.41Å; R321-L325 PolarHBondContact O-N 2.8Å; R321-G343 PolarHBondContact NH1-O 2.79Å; R321-T344 HydrophobicContact CB-CG2 4.05Å
322	L	93.9	Very high	86.6	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-59	-47.2	176.5	176.2	63.7	0	0	0	111.4	F138 A318 H319 A324 L325 C326 L341 T344 W346 F634 Y639	F138-L322 HydrophobicContact CE1-CG 4.26Å; F138-L322 HydrophobicContact CZ-CD2 4.29Å; F138-L322 HydrophobicContact CZ-CG 4.46Å; A318-L322 WeakPolarHBondContact O-CB 3.37Å; A318-L322 PolarHBondContact O-N 2.96Å; H319-L322 PolarHBondContact O-N 2.97Å; L322-A324 VanDerWaalsContact C-N 3.34Å; L322-A324 PolarHBondContact O-N 3.47Å; L322-L325 PolarHBondContact O-N 3.43Å; L322-C326 WeakPolarHBondContact O-CB 3.11Å; L322-C326 PolarHBondContact O-N 2.91Å; L322-C326 PolarHBondContact O-SG 3.36Å; L322-L341 HydrophobicContact CD1-CD1 3.78Å; L322-T344 HydrophobicContact CB-CG2 4.31Å; L322-W346 HydrophobicContact CD2-CB 4.19Å; L322-W346 HydrophobicContact CD2-CD2 4.01Å; L322-W346 HydrophobicContact CD2-CG 3.66Å; L322-F634 HydrophobicContact CD1-CE2 3.78Å; L322-F634 HydrophobicContact CD1-CZ 4.26Å; L322-Y639 HydrophobicContact CD2-CD1 3.98Å; L322-Y639 HydrophobicContact CD2-CD2 4.11Å; L322-Y639 HydrophobicContact CD2-CE1 3.91Å; L322-Y639 HydrophobicContact CD2-CE2 4Å; L322-Y639 HydrophobicContact CD2-CG 4.1Å
323	R	89.8	Confident	85.9	Confident	52 Å²	52	45.8 Å²	45.8	20%	0.196	27%	0.272	C	S	.	.	H	α-helix	trans	-61.7	-42.2	178.1	-166	179.1	72.2	-168.3	1	112.2	F138 H319 L320 R321 L325 C326 L327	F138-R323 HydrophobicContact CD1-CB 4.49Å; F138-R323 HydrophobicContact CD1-CG 4.15Å; F138-R323 HydrophobicContact CE1-CB 3.88Å; F138-R323 HydrophobicContact CE1-CG 4.02Å; F138-R323 HydrophobicContact CZ-CB 4.36Å; H319-R323 WeakPolarHBondContact O-CB 3.41Å; H319-R323 PolarHBondContact O-N 2.95Å; L320-R323 PolarHBondContact O-N 3.27Å; R321-R323 PolarHBondContact O-N 3.28Å; R323-L325 VanDerWaalsContact C-N 3.29Å; R323-L325 PolarHBondContact O-N 3.13Å; R323-C326 PolarHBondContact O-N 3.3Å; R323-L327 HydrophobicContact CG-CD1 4.2Å; R323-L327 HydrophobicContact CG-CG 4.48Å; R323-L327 VanDerWaalsContact O-CG 3.3Å; R323-L327 WeakPolarHBondContact O-CG 3.43Å; R323-L327 PolarHBondContact O-N 3.4Å
324	A	88.2	Confident	85.3	Confident	64 Å²	64	51.3 Å²	51.3	53%	0.529	29%	0.286	S	S	.	.	H	α-helix	trans	-61.8	-38.5	176.4	0	0	0	0	0	112.3	L320 R321 L322	L320-A324 WeakPolarHBondContact O-CB 3.45Å; L320-A324 PolarHBondContact O-N 3.25Å; R321-A324 PolarHBondContact O-N 3.41Å; L322-A324 VanDerWaalsContact C-N 3.34Å; L322-A324 PolarHBondContact O-N 3.47Å
325	L	90.4	Very high	84.7	Confident	9 Å²	9	54.7 Å²	54.7	5%	0.047	30%	0.304	C	S	.	.	H	α-helix	trans	-68.8	-37.7	178.3	-178.4	63.6	0	0	0	112.9	R321 L322 R323 S330 V332 A340 L341 T344	R321-L325 PolarHBondContact O-N 2.8Å; L322-L325 PolarHBondContact O-N 3.43Å; R323-L325 VanDerWaalsContact C-N 3.29Å; R323-L325 PolarHBondContact O-N 3.13Å; L325-S330 VanDerWaalsContact O-CB 3.28Å; L325-S330 WeakPolarHBondContact O-CB 3.43Å; L325-S330 PolarHBondContact O-OG 3.04Å; L325-V332 HydrophobicContact CD1-CB 4.23Å; L325-V332 HydrophobicContact CD1-CG1 4.43Å; L325-V332 HydrophobicContact CD1-CG2 3.96Å; L325-A340 HydrophobicContact CD1-CB 3.73Å; L325-A340 HydrophobicContact CD2-CB 4.22Å; L325-L341 VanDerWaalsContact CD2-CA 3.48Å; L325-L341 HydrophobicContact CD2-CB 3.86Å; L325-L341 HydrophobicContact CD2-CD1 4.18Å; L325-T344 HydrophobicContact CD2-CG2 4.19Å
326	C	87.1	Confident	84.4	Confident	2 Å²	2	60.9 Å²	60.9	1%	0.014	33%	0.331	C	S	.	.	H	α-helix	trans	-83	-22.3	-173.2	-67.1	0	0	0	0	114.4	F138 L322 R323 Y639 L640 R643	F138-C326 HydrophobicContact CD1-CB 4.19Å; F138-C326 HydrophobicContact CE1-CB 4.46Å; L322-C326 WeakPolarHBondContact O-CB 3.11Å; L322-C326 PolarHBondContact O-N 2.91Å; L322-C326 PolarHBondContact O-SG 3.36Å; R323-C326 PolarHBondContact O-N 3.3Å; C326-Y639 VanDerWaalsContact CB-O 3.25Å; C326-Y639 WeakPolarHBondContact CB-O 3.36Å; C326-L640 HydrophobicContact CB-CD2 3.93Å; C326-R643 PolarHBondContact O-NE 2.8Å
327	L	79.9	Confident	84.1	Confident	14 Å²	14	62.2 Å²	62.2	7%	0.073	34%	0.335	C	S	.	.	S	Bend	trans	-70.6	150.3	178	-72.6	171.9	0	0	0	111.5	R323 D329 S330 R643	R323-L327 HydrophobicContact CG-CD1 4.2Å; R323-L327 HydrophobicContact CG-CG 4.48Å; R323-L327 VanDerWaalsContact O-CG 3.3Å; R323-L327 WeakPolarHBondContact O-CG 3.43Å; R323-L327 PolarHBondContact O-N 3.4Å; L327-D329 PolarHBondContact O-N 3Å; L327-D329 VanDerWaalsContact O-N 3.14Å; L327-S330 WeakPolarHBondContact O-CB 3.47Å; L327-S330 PolarHBondContact O-N 3.03Å; L327-S330 VanDerWaalsContact O-N 3.12Å; L327-R643 PolarHBondContact O-NH2 3.22Å
328	P	67	Low	83.9	Confident	53 Å²	53	64.4 Å²	64.4	34%	0.344	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-28.2	-176.9	-27.4	37	0	0	0	114.6	L140 S330 G642 R643	L140-P328 HydrophobicContact CD2-CG 3.59Å; P328-S330 PolarHBondContact O-N 3.14Å; P328-S330 VanDerWaalsContact O-N 3.1Å; P328-G642 WeakPolarHBondContact CG-O 3.35Å; P328-R643 HydrophobicContact CG-CG 4.03Å
329	D	65.6	Low	83.7	Confident	77 Å²	77	68.1 Å²	68.1	41%	0.412	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-0.4	178.9	-49.1	-29.1	0	0	0	114.4	R105 H134 L327 S331	R105-D329 IonicContact NH1-OD2 3.77Å; H134-D329 IonicContact CE1-OD2 3.18Å; H134-D329 PolarHBondContact CE1-OD2 3.4Å; L327-D329 PolarHBondContact O-N 3Å; L327-D329 VanDerWaalsContact O-N 3.14Å; D329-S331 PolarHBondContact O-N 2.69Å; D329-S331 VanDerWaalsContact O-N 3.09Å
330	S	70.4	Confident	83.6	Confident	25 Å²	25	69.6 Å²	69.6	18%	0.175	39%	0.385	C	S	.	.			trans	-63.3	113.3	178	-178.6	0	0	0	0	110	L325 L327 P328 V332	L325-S330 VanDerWaalsContact O-CB 3.28Å; L325-S330 WeakPolarHBondContact O-CB 3.43Å; L325-S330 PolarHBondContact O-OG 3.04Å; L327-S330 WeakPolarHBondContact O-CB 3.47Å; L327-S330 PolarHBondContact O-N 3.03Å; L327-S330 VanDerWaalsContact O-N 3.12Å; P328-S330 PolarHBondContact O-N 3.14Å; P328-S330 VanDerWaalsContact O-N 3.1Å; S330-V332 PolarHBondContact O-N 2.94Å; S330-V332 WeakPolarHBondContact OG-CG2 3.48Å
331	S	66.1	Low	83.6	Confident	125 Å²	125	66.9 Å²	66.9	87%	0.874	37%	0.371	S	S	*	.			trans	-77.4	8	176.5	59	0	0	0	0	113.6	D329 A333	D329-S331 PolarHBondContact O-N 2.69Å; D329-S331 VanDerWaalsContact O-N 3.09Å; S331-A333 PolarHBondContact O-N 2.96Å
332	V	78.3	Confident	83.6	Confident	55 Å²	55	67.5 Å²	67.5	33%	0.333	38%	0.379	S	S	.	.			trans	-74.2	122.8	-178.7	-178.6	0	0	0	0	109.2	L325 S330 K336 A340	L325-V332 HydrophobicContact CD1-CB 4.23Å; L325-V332 HydrophobicContact CD1-CG1 4.43Å; L325-V332 HydrophobicContact CD1-CG2 3.96Å; S330-V332 PolarHBondContact O-N 2.94Å; S330-V332 WeakPolarHBondContact OG-CG2 3.48Å; V332-K336 HydrophobicContact CG1-CB 4.21Å; V332-A340 HydrophobicContact CG1-CB 3.93Å; V332-A340 HydrophobicContact CG2-CB 4.45Å
333	A	78.2	Confident	83.6	Confident	49 Å²	49	69.4 Å²	69.4	41%	0.405	40%	0.399	S	S	.	.			trans	-61.1	143.7	174.1	0	0	0	0	0	111.2	S331 D335 K336 W337	S331-A333 PolarHBondContact O-N 2.96Å; A333-D335 VanDerWaalsContact C-N 3.26Å; A333-D335 WeakPolarHBondContact CB-OD1 3.38Å; A333-D335 PolarHBondContact O-N 2.96Å; A333-K336 PolarHBondContact O-N 3.4Å; A333-W337 PolarHBondContact O-N 3.42Å
334	E	79.3	Confident	83.9	Confident	188 Å²	188	67.1 Å²	67.1	88%	0.879	39%	0.391	S	S	*	.	G	3₁₀ helix	trans	-57.2	-37.2	-172.5	-67.4	-172.7	161.1	0	0	113.2	K336 W337	E334-K336 PolarHBondContact O-N 3.32Å; E334-W337 WeakPolarHBondContact O-CB 3.5Å; E334-W337 PolarHBondContact O-N 2.86Å
335	D	84.2	Confident	84.3	Confident	131 Å²	131	70 Å²	70	70%	0.701	39%	0.388	S	S	*	.	G	3₁₀ helix	trans	-62.8	-23.4	177.9	64.1	-51.7	0	0	0	113.3	A333	A333-D335 VanDerWaalsContact C-N 3.26Å; A333-D335 WeakPolarHBondContact CB-OD1 3.38Å; A333-D335 PolarHBondContact O-N 2.96Å
336	K	89.3	Confident	84.6	Confident	130 Å²	130	69.6 Å²	69.6	57%	0.565	39%	0.386	S	S	*	.	G	3₁₀ helix	trans	-104.4	-1.1	-179.7	-64.9	178.3	-174.6	174.6	0	113.4	V332 A333 E334 L338 S339 A340	V332-K336 HydrophobicContact CG1-CB 4.21Å; A333-K336 PolarHBondContact O-N 3.4Å; E334-K336 PolarHBondContact O-N 3.32Å; K336-L338 PolarHBondContact O-N 2.93Å; K336-S339 PolarHBondContact O-N 3.32Å; K336-A340 PolarHBondContact O-N 3.37Å
337	W	88.6	Confident	85	Confident	51 Å²	51	71.2 Å²	71.2	19%	0.193	39%	0.394	C	S	.	.	H	α-helix	trans	-60.9	-42	-172.8	-172.8	89.5	0	0	0	112.7	A333 E334 S339 A340 L341 F634	A333-W337 PolarHBondContact O-N 3.42Å; E334-W337 WeakPolarHBondContact O-CB 3.5Å; E334-W337 PolarHBondContact O-N 2.86Å; W337-S339 PolarHBondContact O-N 2.96Å; W337-A340 PolarHBondContact O-N 3.45Å; W337-L341 HydrophobicContact CH2-CD2 3.77Å; W337-L341 HydrophobicContact CZ3-CB 4.4Å; W337-L341 HydrophobicContact CZ3-CD2 3.68Å; W337-L341 WeakPolarHBondContact O-CB 3.18Å; W337-L341 PolarHBondContact O-N 3.38Å; W337-F634 AromaticContact CH2-CD1 3.82Å; W337-F634 HydrophobicContact CH2-CD1 3.82Å; W337-F634 AromaticContact CH2-CE1 3.67Å; W337-F634 HydrophobicContact CH2-CE1 3.67Å; W337-F634 HydrophobicContact CH2-CE2 4.42Å; W337-F634 HydrophobicContact CH2-CG 4.27Å; W337-F634 AromaticContact CH2-CZ 3.99Å; W337-F634 HydrophobicContact CH2-CZ 3.99Å; W337-F634 HydrophobicContact CZ2-CE1 4.03Å; W337-F634 HydrophobicContact CZ2-CZ 4.14Å
338	L	89.7	Confident	85.7	Confident	130 Å²	130	73.3 Å²	73.3	68%	0.681	41%	0.405	S	S	*	.	H	α-helix	trans	-65.3	-39.3	178.4	-65.9	173.9	0	0	0	112.5	K336 L341 E342	K336-L338 PolarHBondContact O-N 2.93Å; L338-L341 WeakPolarHBondContact O-CB 3.34Å; L338-L341 PolarHBondContact O-N 3.01Å; L338-E342 PolarHBondContact O-N 2.94Å
339	S	91.6	Very high	87.1	Confident	81 Å²	81	71.6 Å²	71.6	57%	0.566	39%	0.392	S	S	*	.	H	α-helix	trans	-68.1	-38.9	175.2	-178.6	0	0	0	0	111.5	K336 W337 L341 E342 G343	K336-S339 PolarHBondContact O-N 3.32Å; W337-S339 PolarHBondContact O-N 2.96Å; S339-L341 VanDerWaalsContact C-N 3.31Å; S339-L341 PolarHBondContact O-N 3.28Å; S339-E342 PolarHBondContact O-N 2.92Å; S339-G343 PolarHBondContact O-N 3.37Å
340	A	92.9	Very high	88.5	Confident	33 Å²	33	68 Å²	68	27%	0.273	37%	0.373	S	S	.	.	H	α-helix	trans	-64.2	-37.2	173.4	0	0	0	0	0	111.9	L325 V332 K336 W337 G343 T344	L325-A340 HydrophobicContact CD1-CB 3.73Å; L325-A340 HydrophobicContact CD2-CB 4.22Å; V332-A340 HydrophobicContact CG1-CB 3.93Å; V332-A340 HydrophobicContact CG2-CB 4.45Å; K336-A340 PolarHBondContact O-N 3.37Å; W337-A340 PolarHBondContact O-N 3.45Å; A340-G343 PolarHBondContact O-N 3.37Å; A340-T344 WeakPolarHBondContact O-CG2 3.46Å; A340-T344 PolarHBondContact O-N 3.11Å
341	L	92.5	Very high	89.7	Confident	11 Å²	11	70.6 Å²	70.6	6%	0.058	38%	0.379	C	S	.	.	H	α-helix	trans	-63.1	-46.6	174.3	179.3	65	0	0	0	111.3	L322 L325 W337 L338 S339 G343 T344 L347 F634	L322-L341 HydrophobicContact CD1-CD1 3.78Å; L325-L341 VanDerWaalsContact CD2-CA 3.48Å; L325-L341 HydrophobicContact CD2-CB 3.86Å; L325-L341 HydrophobicContact CD2-CD1 4.18Å; W337-L341 HydrophobicContact CH2-CD2 3.77Å; W337-L341 HydrophobicContact CZ3-CB 4.4Å; W337-L341 HydrophobicContact CZ3-CD2 3.68Å; W337-L341 WeakPolarHBondContact O-CB 3.18Å; W337-L341 PolarHBondContact O-N 3.38Å; L338-L341 WeakPolarHBondContact O-CB 3.34Å; L338-L341 PolarHBondContact O-N 3.01Å; S339-L341 VanDerWaalsContact C-N 3.31Å; S339-L341 PolarHBondContact O-N 3.28Å; L341-G343 VanDerWaalsContact C-N 3.28Å; L341-G343 PolarHBondContact O-N 3.36Å; L341-T344 WeakPolarHBondContact O-CB 3.4Å; L341-T344 WeakPolarHBondContact O-CG2 3.46Å; L341-T344 PolarHBondContact O-N 2.86Å; L341-T344 PolarHBondContact O-OG1 2.95Å; L341-L347 HydrophobicContact CD2-CD1 3.98Å; L341-L347 HydrophobicContact CG-CD1 4.3Å; L341-F634 HydrophobicContact CD1-CD2 3.9Å; L341-F634 HydrophobicContact CD1-CE2 3.65Å; L341-F634 HydrophobicContact CD1-CZ 4.48Å; L341-F634 HydrophobicContact CD2-CD2 3.86Å; L341-F634 HydrophobicContact CD2-CE2 4.34Å; L341-F634 HydrophobicContact CD2-CG 4.24Å
342	E	92.6	Very high	90.9	Very high	137 Å²	137	66 Å²	66	64%	0.64	35%	0.348	S	S	*	.	H	α-helix	trans	-58.7	-41.7	173.9	-171.6	176.9	-163.9	0	0	111.2	L338 S339 T344 R345	L338-E342 PolarHBondContact O-N 2.94Å; S339-E342 PolarHBondContact O-N 2.92Å; E342-T344 PolarHBondContact O-N 3.24Å; E342-R345 PolarHBondContact O-N 2.66Å
343	G	94.3	Very high	91.8	Very high	41 Å²	41	63.3 Å²	63.3	42%	0.423	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-15	175	0	0	0	0	0	115.5	R321 S339 A340 L341	R321-G343 PolarHBondContact NH1-O 2.79Å; S339-G343 PolarHBondContact O-N 3.37Å; A340-G343 PolarHBondContact O-N 3.37Å; L341-G343 VanDerWaalsContact C-N 3.28Å; L341-G343 PolarHBondContact O-N 3.36Å
344	T	95.9	Very high	92.6	Very high	4 Å²	4	61 Å²	61	3%	0.025	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74	-26.2	172.2	73.5	0	0	0	0	112.7	A318 R321 L322 L325 A340 L341 E342 W346	A318-T344 VanDerWaalsContact CA-O 3.28Å; A318-T344 WeakPolarHBondContact CA-O 3.48Å; A318-T344 WeakPolarHBondContact CB-O 3.48Å; R321-T344 HydrophobicContact CB-CG2 4.05Å; L322-T344 HydrophobicContact CB-CG2 4.31Å; L325-T344 HydrophobicContact CD2-CG2 4.19Å; A340-T344 WeakPolarHBondContact O-CG2 3.46Å; A340-T344 PolarHBondContact O-N 3.11Å; L341-T344 WeakPolarHBondContact O-CB 3.4Å; L341-T344 WeakPolarHBondContact O-CG2 3.46Å; L341-T344 PolarHBondContact O-N 2.86Å; L341-T344 PolarHBondContact O-OG1 2.95Å; E342-T344 PolarHBondContact O-N 3.24Å; T344-W346 PolarHBondContact O-N 2.78Å; T344-W346 PolarHBondContact OG1-N 3.37Å
345	R	95.9	Very high	93.2	Very high	125 Å²	125	56.4 Å²	56.4	47%	0.472	29%	0.288	S	S	.	.			trans	60.9	6.9	-171.1	-51.1	-173.3	71.3	-165.2	1.1	115.6	E342 L347 D348 Y349	E342-R345 PolarHBondContact O-N 2.66Å; R345-L347 PolarHBondContact O-N 2.85Å; R345-D348 WeakPolarHBondContact O-CB 3.39Å; R345-D348 PolarHBondContact O-N 3.38Å; R345-Y349 HydrophobicContact CB-CE1 4.29Å; R345-Y349 HydrophobicContact CB-CE2 4.3Å; R345-Y349 PolarHBondContact NH1-OH 3.07Å; R345-Y349 PolarHBondContact O-N 2.89Å; R345-Y349 VanDerWaalsContact O-N 3.16Å
346	W	96.9	Very high	93.5	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-61.5	-47.7	-179.1	-176.2	-101.9	0	0	0	111.7	V315 A318 H319 L322 T344 D348 Y349 I350 P432 L435 L436 D439 Y639	V315-W346 HydrophobicContact CG1-CH2 4.45Å; V315-W346 HydrophobicContact CG1-CZ3 3.94Å; A318-W346 HydrophobicContact CB-CE3 4.07Å; H319-W346 HydrophobicContact CB-CE3 4.29Å; H319-W346 HydrophobicContact CB-CZ3 3.89Å; L322-W346 HydrophobicContact CD2-CB 4.19Å; L322-W346 HydrophobicContact CD2-CD2 4.01Å; L322-W346 HydrophobicContact CD2-CG 3.66Å; T344-W346 PolarHBondContact O-N 2.78Å; T344-W346 PolarHBondContact OG1-N 3.37Å; W346-D348 VanDerWaalsContact C-N 3.29Å; W346-D348 PolarHBondContact O-N 3.39Å; W346-Y349 PolarHBondContact O-N 2.99Å; W346-I350 PolarHBondContact O-N 3.5Å; W346-P432 HydrophobicContact CH2-CG 4.12Å; W346-P432 HydrophobicContact CZ3-CG 4.23Å; W346-L435 HydrophobicContact CH2-CG 4.4Å; W346-L435 HydrophobicContact CZ2-CD2 4.39Å; W346-L435 HydrophobicContact CZ2-CG 4.08Å; W346-L436 HydrophobicContact CH2-CB 3.84Å; W346-L436 HydrophobicContact CH2-CD1 4.18Å; W346-L436 HydrophobicContact CZ2-CB 4.15Å; W346-L436 HydrophobicContact CZ2-CD1 4.09Å; W346-D439 PolarHBondContact NE1-OD2 3.33Å; W346-Y639 AromaticContact NE1-CE2 3.84Å; W346-Y639 AromaticContact NE1-CZ 3.56Å; W346-Y639 PolarHBondContact NE1-OH 3.33Å
347	L	95.7	Very high	93.8	Very high	35 Å²	35	44 Å²	44	18%	0.183	23%	0.227	C	C	.	.	H	α-helix	trans	-65.6	-31.2	177.9	-59	-174.2	0	0	0	112.7	L341 R345 Y349 I350 R351 I632	L341-L347 HydrophobicContact CD2-CD1 3.98Å; L341-L347 HydrophobicContact CG-CD1 4.3Å; R345-L347 PolarHBondContact O-N 2.85Å; L347-Y349 VanDerWaalsContact C-N 3.32Å; L347-Y349 PolarHBondContact O-N 3.25Å; L347-I350 HydrophobicContact CD2-CD1 3.85Å; L347-I350 PolarHBondContact O-N 3.27Å; L347-R351 WeakPolarHBondContact O-CG 3.38Å; L347-R351 PolarHBondContact O-N 3.21Å; L347-I632 HydrophobicContact CB-CG2 4.24Å; L347-I632 HydrophobicContact CD2-CG2 4.13Å
348	D	94.2	Very high	93.9	Very high	58 Å²	58	41.6 Å²	41.6	31%	0.31	22%	0.218	S	C	.	.	H	α-helix	trans	-65.2	-37.8	174.9	-65	-34.6	0	0	0	111.9	R345 W346 R351 A352	R345-D348 WeakPolarHBondContact O-CB 3.39Å; R345-D348 PolarHBondContact O-N 3.38Å; W346-D348 VanDerWaalsContact C-N 3.29Å; W346-D348 PolarHBondContact O-N 3.39Å; D348-R351 WeakPolarHBondContact O-CB 3.23Å; D348-R351 PolarHBondContact O-N 2.91Å; D348-A352 PolarHBondContact O-N 3.1Å
349	Y	96.1	Very high	93.8	Very high	18 Å²	18	35.5 Å²	35.5	7%	0.071	19%	0.186	C	C	.	.	H	α-helix	trans	-70.4	-37	177.9	-64.4	-18	0	0	0	112.1	P310 D314 A318 R345 W346 L347 A352 C353	P310-Y349 HydrophobicContact CB-CD1 3.7Å; P310-Y349 HydrophobicContact CB-CD2 3.82Å; P310-Y349 HydrophobicContact CB-CE1 3.75Å; P310-Y349 HydrophobicContact CB-CE2 3.84Å; P310-Y349 HydrophobicContact CB-CG 3.76Å; P310-Y349 HydrophobicContact CG-CD1 3.87Å; P310-Y349 HydrophobicContact CG-CD2 3.99Å; P310-Y349 HydrophobicContact CG-CE1 4.43Å; P310-Y349 HydrophobicContact CG-CG 3.65Å; D314-Y349 HydrophobicContact CB-CE2 4.01Å; A318-Y349 HydrophobicContact CB-CD2 3.96Å; A318-Y349 HydrophobicContact CB-CE2 3.67Å; R345-Y349 HydrophobicContact CB-CE1 4.29Å; R345-Y349 HydrophobicContact CB-CE2 4.3Å; R345-Y349 PolarHBondContact NH1-OH 3.07Å; R345-Y349 PolarHBondContact O-N 2.89Å; R345-Y349 VanDerWaalsContact O-N 3.16Å; W346-Y349 PolarHBondContact O-N 2.99Å; L347-Y349 VanDerWaalsContact C-N 3.32Å; L347-Y349 PolarHBondContact O-N 3.25Å; Y349-A352 PolarHBondContact O-N 2.9Å; Y349-C353 WeakPolarHBondContact O-CB 3.04Å; Y349-C353 PolarHBondContact O-N 2.84Å; Y349-C353 PolarHBondContact O-SG 2.78Å; Y349-C353 VanDerWaalsContact O-SG 3.32Å
350	I	96.5	Very high	93.8	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-60	-47.1	170.4	-63.2	165.6	0	0	0	110.4	W346 L347 A352 C353 L354 L436 D439 Q443	W346-I350 PolarHBondContact O-N 3.5Å; L347-I350 HydrophobicContact CD2-CD1 3.85Å; L347-I350 PolarHBondContact O-N 3.27Å; I350-A352 VanDerWaalsContact C-N 3.33Å; I350-A352 PolarHBondContact O-N 3.35Å; I350-C353 PolarHBondContact O-N 3.13Å; I350-L354 HydrophobicContact CG2-CD1 3.85Å; I350-L354 HydrophobicContact CG2-CG 4.36Å; I350-L354 WeakPolarHBondContact O-CG 3.39Å; I350-L354 PolarHBondContact O-N 2.86Å; I350-L436 HydrophobicContact CG1-CD1 3.66Å; I350-D439 HydrophobicContact CD1-CB 3.99Å; I350-D439 WeakPolarHBondContact CD1-OD2 3.37Å; I350-D439 HydrophobicContact CG1-CB 4.43Å; I350-Q443 HydrophobicContact CG2-CG 3.68Å
351	R	94.1	Very high	93.7	Very high	80 Å²	80	30 Å²	30	30%	0.302	15%	0.146	S	C	.	.	H	α-helix	trans	-56.1	-47.1	175.7	-73.4	175.9	62	-175.5	-0.5	111.8	L347 D348 C353 L354 R355 Y627 I632	L347-R351 WeakPolarHBondContact O-CG 3.38Å; L347-R351 PolarHBondContact O-N 3.21Å; D348-R351 WeakPolarHBondContact O-CB 3.23Å; D348-R351 PolarHBondContact O-N 2.91Å; R351-C353 PolarHBondContact O-N 3.34Å; R351-L354 PolarHBondContact O-N 2.86Å; R351-R355 VanDerWaalsContact O-CB 3.24Å; R351-R355 WeakPolarHBondContact O-CB 3.35Å; R351-R355 PolarHBondContact O-N 3.4Å; R351-Y627 WeakPolarHBondContact CD-O 3.35Å; R351-Y627 VanDerWaalsContact CG-O 3.27Å; R351-Y627 WeakPolarHBondContact CG-O 3.24Å; R351-Y627 PolarHBondContact NE-O 2.89Å; R351-I632 HydrophobicContact CG-CB 4.37Å; R351-I632 HydrophobicContact CG-CD1 4.38Å; R351-I632 HydrophobicContact CG-CG1 3.46Å; R351-I632 VanDerWaalsContact CG-CG1 3.46Å
352	A	93.3	Very high	93.4	Very high	28 Å²	28	30.4 Å²	30.4	23%	0.231	15%	0.149	C	C	.	.	H	α-helix	trans	-61.4	-44	179.9	0	0	0	0	0	111.6	L309 D348 Y349 I350 K356	L309-A352 HydrophobicContact CD2-CB 4.14Å; D348-A352 PolarHBondContact O-N 3.1Å; Y349-A352 PolarHBondContact O-N 2.9Å; I350-A352 VanDerWaalsContact C-N 3.33Å; I350-A352 PolarHBondContact O-N 3.35Å; A352-K356 WeakPolarHBondContact O-CB 3.25Å; A352-K356 PolarHBondContact O-N 3.11Å
353	C	95.9	Very high	93.1	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-62	-49.1	176.2	-73.2	0	0	0	0	112.7	Y349 I350 R351 K356 A357 L384 L388	Y349-C353 WeakPolarHBondContact O-CB 3.04Å; Y349-C353 PolarHBondContact O-N 2.84Å; Y349-C353 PolarHBondContact O-SG 2.78Å; Y349-C353 VanDerWaalsContact O-SG 3.32Å; I350-C353 PolarHBondContact O-N 3.13Å; R351-C353 PolarHBondContact O-N 3.34Å; C353-K356 PolarHBondContact O-N 2.88Å; C353-A357 VanDerWaalsContact O-CB 3.32Å; C353-A357 WeakPolarHBondContact O-CB 3.27Å; C353-A357 PolarHBondContact O-N 3.39Å; C353-L384 HydrophobicContact CB-CD2 3.82Å; C353-L388 HydrophobicContact CB-CD1 4.38Å
354	L	94.9	Very high	92.7	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-65.2	-41.5	-180	-72	174	0	0	0	112.3	I350 R351 A357 S358 L388 C440 Q443 L444 P625 I632	I350-L354 HydrophobicContact CG2-CD1 3.85Å; I350-L354 HydrophobicContact CG2-CG 4.36Å; I350-L354 WeakPolarHBondContact O-CG 3.39Å; I350-L354 PolarHBondContact O-N 2.86Å; R351-L354 PolarHBondContact O-N 2.86Å; L354-A357 PolarHBondContact O-N 3.33Å; L354-S358 WeakPolarHBondContact O-CB 3.29Å; L354-S358 PolarHBondContact O-N 3.05Å; L354-S358 PolarHBondContact O-OG 3.37Å; L354-L388 HydrophobicContact CD2-CD1 4.41Å; L354-C440 HydrophobicContact CD2-CB 3.96Å; L354-C440 HydrophobicContact CG-CB 4.31Å; L354-Q443 HydrophobicContact CD1-CB 3.84Å; L354-Q443 HydrophobicContact CD1-CG 4.06Å; L354-L444 HydrophobicContact CD2-CD2 3.82Å; L354-L444 HydrophobicContact CD2-CG 4.07Å; L354-P625 HydrophobicContact CB-CG 4.44Å; L354-P625 HydrophobicContact CD2-CG 4.46Å; L354-I632 HydrophobicContact CD1-CD1 3.74Å
355	R	91.3	Very high	92	Very high	92 Å²	92	23 Å²	23	35%	0.347	10%	0.104	S	C	.	.	H	α-helix	trans	-59.1	-55.2	174.6	-179.8	177.9	178.3	173.6	1.1	110.6	R351 A357 S358 D359 Y627	R351-R355 VanDerWaalsContact O-CB 3.24Å; R351-R355 WeakPolarHBondContact O-CB 3.35Å; R351-R355 PolarHBondContact O-N 3.4Å; R355-A357 VanDerWaalsContact C-N 3.3Å; R355-A357 PolarHBondContact O-N 2.94Å; R355-S358 WeakPolarHBondContact O-CB 3.15Å; R355-S358 PolarHBondContact O-N 3.26Å; R355-D359 VanDerWaalsContact O-CG 3.22Å; R355-D359 PolarHBondContact O-N 3.05Å; R355-Y627 HydrophobicContact CB-CD1 3.99Å; R355-Y627 HydrophobicContact CB-CD2 3.94Å; R355-Y627 HydrophobicContact CB-CE1 4.16Å; R355-Y627 HydrophobicContact CB-CE2 4.13Å; R355-Y627 HydrophobicContact CB-CG 3.87Å; R355-Y627 HydrophobicContact CG-CD1 4.38Å; R355-Y627 HydrophobicContact CG-CD2 4.17Å; R355-Y627 HydrophobicContact CG-CE1 4.04Å; R355-Y627 HydrophobicContact CG-CE2 3.84Å; R355-Y627 HydrophobicContact CG-CG 4.44Å
356	K	92.2	Very high	90.8	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-60.1	-40.4	-178.5	-169	67.3	171.2	-176	0	111.9	V303 E308 L309 A352 C353 S358 D359 I360 L385 F564	V303-K356 VanDerWaalsContact CG1-CE 3.48Å; E308-K356 IonicContact OE1-NZ 2.67Å; E308-K356 PolarHBondContact OE1-NZ 3.5Å; E308-K356 IonicContact OE2-NZ 2.69Å; L309-K356 HydrophobicContact CD2-CB 4.32Å; A352-K356 WeakPolarHBondContact O-CB 3.25Å; A352-K356 PolarHBondContact O-N 3.11Å; C353-K356 PolarHBondContact O-N 2.88Å; K356-S358 VanDerWaalsContact C-N 3.34Å; K356-D359 PolarHBondContact O-N 3.06Å; K356-I360 HydrophobicContact CG-CD1 4Å; K356-I360 VanDerWaalsContact O-CD1 3.3Å; K356-I360 WeakPolarHBondContact O-CD1 3.16Å; K356-I360 WeakPolarHBondContact O-CG1 3.37Å; K356-I360 PolarHBondContact O-N 2.91Å; K356-L385 HydrophobicContact CB-CD2 3.99Å; K356-L385 HydrophobicContact CG-CD1 4.16Å; K356-L385 HydrophobicContact CG-CD2 4.01Å; K356-F564 HydrophobicContact CD-CE1 4.02Å; K356-F564 VanDerWaalsContact NZ-CD1 3.31Å; K356-F564 VanDerWaalsContact NZ-CE1 3.31Å
357	A	94.8	Very high	89.5	Confident	0 Å²	0	22.1 Å²	22.1	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-65	-36	175.6	0	0	0	0	0	112.9	C353 L354 R355 S361 L385 L388 V389 L392	C353-A357 VanDerWaalsContact O-CB 3.32Å; C353-A357 WeakPolarHBondContact O-CB 3.27Å; C353-A357 PolarHBondContact O-N 3.39Å; L354-A357 PolarHBondContact O-N 3.33Å; R355-A357 VanDerWaalsContact C-N 3.3Å; R355-A357 PolarHBondContact O-N 2.94Å; A357-S361 WeakPolarHBondContact O-CB 3.46Å; A357-S361 PolarHBondContact O-N 2.99Å; A357-S361 PolarHBondContact O-OG 3.14Å; A357-L385 HydrophobicContact CB-CD2 4.26Å; A357-L388 HydrophobicContact CB-CB 3.58Å; A357-L388 HydrophobicContact CB-CD1 4.04Å; A357-L388 HydrophobicContact CB-CG 4.49Å; A357-V389 HydrophobicContact CB-CG2 4.38Å; A357-L392 HydrophobicContact CB-CD1 4.01Å
358	S	90.6	Very high	88.9	Confident	0 Å²	0	23.7 Å²	23.7	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-64.3	-47.3	174.6	-56.9	0	0	0	0	110.7	L354 R355 K356 I360 S361 V362 P625	L354-S358 WeakPolarHBondContact O-CB 3.29Å; L354-S358 PolarHBondContact O-N 3.05Å; L354-S358 PolarHBondContact O-OG 3.37Å; R355-S358 WeakPolarHBondContact O-CB 3.15Å; R355-S358 PolarHBondContact O-N 3.26Å; K356-S358 VanDerWaalsContact C-N 3.34Å; S358-I360 VanDerWaalsContact C-N 3.33Å; S358-I360 PolarHBondContact O-N 3.09Å; S358-S361 WeakPolarHBondContact O-CB 3.27Å; S358-S361 PolarHBondContact O-N 3.23Å; S358-S361 VanDerWaalsContact O-N 3.14Å; S358-V362 WeakPolarHBondContact O-CG2 3.37Å; S358-V362 PolarHBondContact O-N 2.84Å; S358-P625 VanDerWaalsContact OG-CD 3.29Å; S358-P625 WeakPolarHBondContact OG-CD 3.47Å; S358-P625 WeakPolarHBondContact OG-CG 3.5Å
359	D	87.7	Confident	88.6	Confident	2 Å²	2	21.2 Å²	21.2	1%	0.011	10%	0.103	C	C	.	.	H	α-helix	trans	-59.6	-45	178.5	-55.6	-13.6	0	0	0	111.1	R355 K356 S361 V362 L363 F564 W607	R355-D359 VanDerWaalsContact O-CG 3.22Å; R355-D359 PolarHBondContact O-N 3.05Å; K356-D359 PolarHBondContact O-N 3.06Å; D359-S361 VanDerWaalsContact C-N 3.35Å; D359-S361 PolarHBondContact O-N 2.74Å; D359-V362 PolarHBondContact O-N 2.97Å; D359-L363 WeakPolarHBondContact O-CG 3.47Å; D359-L363 PolarHBondContact O-N 2.91Å; D359-L363 VanDerWaalsContact O-N 3.08Å; D359-F564 HydrophobicContact CB-CE1 3.72Å; D359-F564 HydrophobicContact CB-CZ 3.58Å; D359-W607 HydrophobicContact CB-CH2 3.86Å; D359-W607 HydrophobicContact CB-CZ2 4.19Å; D359-W607 HydrophobicContact CB-CZ3 4.4Å; D359-W607 WeakPolarHBondContact OD1-CH2 3.39Å; D359-W607 VanDerWaalsContact OD1-CZ2 3.27Å; D359-W607 WeakPolarHBondContact OD1-CZ2 3.46Å; D359-W607 VanDerWaalsContact OD2-CH2 3.3Å; D359-W607 WeakPolarHBondContact OD2-CH2 3.43Å
360	I	91.8	Very high	88.4	Confident	0 Å²	0	20.3 Å²	20.3	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-63.6	-41	176.9	-64.3	158.8	0	0	0	111.1	L269 V303 K356 S358 V362 L363 V364 V371 L373 L385 V389	L269-I360 HydrophobicContact CD1-CG2 4.08Å; V303-I360 HydrophobicContact CG1-CD1 4.05Å; V303-I360 HydrophobicContact CG1-CG1 4.12Å; V303-I360 HydrophobicContact CG2-CG1 4.35Å; K356-I360 HydrophobicContact CG-CD1 4Å; K356-I360 VanDerWaalsContact O-CD1 3.3Å; K356-I360 WeakPolarHBondContact O-CD1 3.16Å; K356-I360 WeakPolarHBondContact O-CG1 3.37Å; K356-I360 PolarHBondContact O-N 2.91Å; S358-I360 VanDerWaalsContact C-N 3.33Å; S358-I360 PolarHBondContact O-N 3.09Å; I360-V362 VanDerWaalsContact C-N 3.32Å; I360-V362 PolarHBondContact O-N 3.35Å; I360-L363 WeakPolarHBondContact O-CB 3.44Å; I360-L363 PolarHBondContact O-N 3.03Å; I360-L363 VanDerWaalsContact O-N 3.14Å; I360-V364 HydrophobicContact CG2-CG2 4.2Å; I360-V364 WeakPolarHBondContact O-CG2 3.24Å; I360-V364 PolarHBondContact O-N 3Å; I360-V371 HydrophobicContact CG2-CG1 4.13Å; I360-L373 HydrophobicContact CD1-CD2 3.71Å; I360-L373 HydrophobicContact CG1-CD2 4.31Å; I360-L373 HydrophobicContact CG2-CD2 4.21Å; I360-L385 HydrophobicContact CD1-CB 4.32Å; I360-L385 HydrophobicContact CD1-CD1 3.9Å; I360-L385 HydrophobicContact CD1-CD2 4.26Å; I360-L385 HydrophobicContact CD1-CG 4.41Å; I360-V389 HydrophobicContact CB-CG2 3.69Å; I360-V389 HydrophobicContact CG2-CG1 4.29Å; I360-V389 HydrophobicContact CG2-CG2 3.48Å; I360-V389 VanDerWaalsContact CG2-CG2 3.48Å
361	S	90.9	Very high	88.3	Confident	0 Å²	0	20.3 Å²	20.3	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-60.2	-43.8	177.8	-54.1	0	0	0	0	111	A357 S358 D359 L363 V364 T365	A357-S361 WeakPolarHBondContact O-CB 3.46Å; A357-S361 PolarHBondContact O-N 2.99Å; A357-S361 PolarHBondContact O-OG 3.14Å; S358-S361 WeakPolarHBondContact O-CB 3.27Å; S358-S361 PolarHBondContact O-N 3.23Å; S358-S361 VanDerWaalsContact O-N 3.14Å; D359-S361 VanDerWaalsContact C-N 3.35Å; D359-S361 PolarHBondContact O-N 2.74Å; S361-L363 VanDerWaalsContact C-N 3.34Å; S361-L363 PolarHBondContact O-N 2.87Å; S361-V364 PolarHBondContact O-N 3.35Å; S361-T365 WeakPolarHBondContact O-CB 3.5Å; S361-T365 PolarHBondContact O-N 3.48Å; S361-T365 PolarHBondContact O-OG1 2.94Å
362	V	85.5	Confident	88.3	Confident	19 Å²	19	16.5 Å²	16.5	12%	0.115	9%	0.085	C	C	.	.	H	α-helix	trans	-59.8	-43.4	174.4	175.7	0	0	0	0	111.4	S358 D359 I360 T365 S366 L618 L624	S358-V362 WeakPolarHBondContact O-CG2 3.37Å; S358-V362 PolarHBondContact O-N 2.84Å; D359-V362 PolarHBondContact O-N 2.97Å; I360-V362 VanDerWaalsContact C-N 3.32Å; I360-V362 PolarHBondContact O-N 3.35Å; V362-T365 PolarHBondContact O-N 2.94Å; V362-S366 VanDerWaalsContact O-CB 3.29Å; V362-S366 WeakPolarHBondContact O-CB 3.43Å; V362-S366 PolarHBondContact O-N 3.49Å; V362-S366 PolarHBondContact O-OG 3.28Å; V362-L618 HydrophobicContact CG1-CD2 4.18Å; V362-L618 HydrophobicContact CG2-CD2 4.09Å; V362-L624 HydrophobicContact CG2-CD2 4.14Å
363	L	85.9	Confident	88.4	Confident	10 Å²	10	15.2 Å²	15.2	5%	0.052	7%	0.074	C	C	.	.	H	α-helix	trans	-62.3	-43.5	178.5	-68.4	170.6	0	0	0	112.7	V301 D359 I360 S361 T365 R369 V371 F564 L569	V301-L363 HydrophobicContact CG1-CD1 4.19Å; D359-L363 WeakPolarHBondContact O-CG 3.47Å; D359-L363 PolarHBondContact O-N 2.91Å; D359-L363 VanDerWaalsContact O-N 3.08Å; I360-L363 WeakPolarHBondContact O-CB 3.44Å; I360-L363 PolarHBondContact O-N 3.03Å; I360-L363 VanDerWaalsContact O-N 3.14Å; S361-L363 VanDerWaalsContact C-N 3.34Å; S361-L363 PolarHBondContact O-N 2.87Å; L363-T365 VanDerWaalsContact C-N 3.35Å; L363-R369 WeakPolarHBondContact O-CD 3.46Å; L363-R369 PolarHBondContact O-NE 3.45Å; L363-R369 VanDerWaalsContact O-NE 3.09Å; L363-V371 HydrophobicContact CB-CG2 4.33Å; L363-F564 HydrophobicContact CD1-CB 4.31Å; L363-F564 HydrophobicContact CD1-CD1 3.92Å; L363-F564 HydrophobicContact CD1-CD2 4.28Å; L363-F564 HydrophobicContact CD1-CE1 4.33Å; L363-F564 HydrophobicContact CD1-CG 3.9Å; L363-L569 HydrophobicContact CD2-CD1 4.11Å; L363-L569 HydrophobicContact CD2-CD2 4.31Å
364	V	87.5	Confident	88.2	Confident	0 Å²	0	16.2 Å²	16.2	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-66.3	-40.6	178.6	173.3	0	0	0	0	110.5	W261 H263 S267 L269 I360 S361 V371 V389	W261-V364 HydrophobicContact CE3-CG1 4.36Å; W261-V364 HydrophobicContact CZ3-CG1 3.89Å; H263-V364 HydrophobicContact CB-CG1 3.6Å; S267-V364 WeakPolarHBondContact CB-O 3.04Å; S267-V364 PolarHBondContact OG-O 2.82Å; L269-V364 HydrophobicContact CD1-CG2 4.21Å; I360-V364 HydrophobicContact CG2-CG2 4.2Å; I360-V364 WeakPolarHBondContact O-CG2 3.24Å; I360-V364 PolarHBondContact O-N 3Å; S361-V364 PolarHBondContact O-N 3.35Å; V364-V371 HydrophobicContact CG2-CB 3.93Å; V364-V371 HydrophobicContact CG2-CG1 4.26Å; V364-V371 HydrophobicContact CG2-CG2 3.77Å; V364-V389 HydrophobicContact CG2-CG1 4.46Å
365	T	80.6	Confident	87.9	Confident	16 Å²	16	16.8 Å²	16.8	10%	0.098	8%	0.081	C	C	.	.	H	α-helix	trans	-87.2	-27.3	-167.9	-65.3	0	0	0	0	114	H263 S361 V362 L363 P619 L622	H263-T365 PolarHBondContact CD2-OG1 3.03Å; H263-T365 PolarHBondContact NE2-OG1 2.84Å; S361-T365 WeakPolarHBondContact O-CB 3.5Å; S361-T365 PolarHBondContact O-N 3.48Å; S361-T365 PolarHBondContact O-OG1 2.94Å; V362-T365 PolarHBondContact O-N 2.94Å; L363-T365 VanDerWaalsContact C-N 3.35Å; T365-P619 HydrophobicContact CG2-CB 4.37Å; T365-P619 HydrophobicContact CG2-CG 2.94Å; T365-L622 HydrophobicContact CG2-CD2 4.44Å
366	S	70.4	Confident	87.7	Confident	30 Å²	30	20.3 Å²	20.3	21%	0.21	10%	0.095	C	C	.	.	H	α-helix	trans	-69.4	-36.5	-173	-62.4	0	0	0	0	114.3	V362	V362-S366 VanDerWaalsContact O-CB 3.29Å; V362-S366 WeakPolarHBondContact O-CB 3.43Å; V362-S366 PolarHBondContact O-N 3.49Å; V362-S366 PolarHBondContact O-OG 3.28Å
367	R	69.7	Low	87.4	Confident	77 Å²	77	21.2 Å²	21.2	29%	0.291	10%	0.104	S	C	.	.	S	Bend	trans	-155.6	154.8	-178.8	-60.1	-175.9	166.8	-156.8	-14.9	110.9	S267 R369 H612 W613	S267-R367 PolarHBondContact OG-O 2.98Å; R367-R369 PolarHBondContact O-N 2.71Å; R367-R369 VanDerWaalsContact O-N 3.15Å; R367-R369 PolarHBondContact O-NE 3.47Å; R367-H612 PolarHBondContact NH2-O 2.86Å; R367-H612 VanDerWaalsContact NH2-O 3.17Å; R367-W613 VanDerWaalsContact CZ-CA 3.48Å; R367-W613 VanDerWaalsContact CZ-O 3.25Å; R367-W613 PolarHBondContact NE-O 3.37Å; R367-W613 VanDerWaalsContact NH1-CD1 3.28Å; R367-W613 PolarHBondContact NH2-O 2.99Å
368	V	82.8	Confident	87.2	Confident	67 Å²	67	21.2 Å²	21.2	41%	0.406	10%	0.104	S	C	.	.	S	Bend	trans	-59.3	107.3	172	-177.4	0	0	0	0	110.6	G265 S267 H297	G265-V368 VanDerWaalsContact O-CG2 3.27Å; G265-V368 WeakPolarHBondContact O-CG2 3.38Å; S267-V368 WeakPolarHBondContact OG-CA 3.46Å; H297-V368 WeakPolarHBondContact ND1-CG1 3.26Å
369	R	87.8	Confident	87.3	Confident	6 Å²	6	22.9 Å²	22.9	2%	0.023	11%	0.11	C	C	.	.			trans	-155.1	167.2	179	71.6	-173.7	81.6	-168.5	9.1	111.9	S267 D268 D299 L363 R367 V371	S267-R369 VanDerWaalsContact CA-O 3.29Å; S267-R369 WeakPolarHBondContact CA-O 3.44Å; S267-R369 WeakPolarHBondContact CB-O 3.36Å; S267-R369 PolarHBondContact OG-N 3Å; D268-R369 PolarHBondContact N-O 3.12Å; D299-R369 HydrophobicContact CB-CB 4.1Å; D299-R369 WeakPolarHBondContact O-CB 3.43Å; L363-R369 WeakPolarHBondContact O-CD 3.46Å; L363-R369 PolarHBondContact O-NE 3.45Å; L363-R369 VanDerWaalsContact O-NE 3.09Å; R367-R369 PolarHBondContact O-N 2.71Å; R367-R369 VanDerWaalsContact O-N 3.15Å; R367-R369 PolarHBondContact O-NE 3.47Å; R369-V371 HydrophobicContact CG-CG2 3.75Å
370	S	92.1	Very high	87.6	Confident	0 Å²	0	23.1 Å²	23.1	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	119.5	167.5	-176.9	0	0	0	0	109.9	L270 L293 D299 V300 V301	L270-S370 WeakPolarHBondContact CD1-OG 3.21Å; L293-S370 WeakPolarHBondContact O-CB 3.17Å; L293-S370 PolarHBondContact O-OG 3Å; D299-S370 PolarHBondContact O-N 2.86Å; V300-S370 CarbonylContact C-O 3.6Å; V300-S370 WeakPolarHBondContact CA-O 3.45Å; V301-S370 PolarHBondContact N-O 2.72Å
371	V	94.7	Very high	87.8	Confident	0 Å²	0	23.4 Å²	23.4	0%	0	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	118.7	174.9	-175.5	0	0	0	0	108.6	D268 L269 L270 V301 V303 I360 L363 V364 R369	D268-V371 PolarHBondContact O-N 3.27Å; L269-V371 CarbonylContact C-O 3.59Å; L269-V371 WeakPolarHBondContact CA-O 3.39Å; L269-V371 HydrophobicContact CD1-CB 4.3Å; L269-V371 HydrophobicContact CD1-CG1 4.22Å; L270-V371 PolarHBondContact N-O 3.22Å; V301-V371 WeakPolarHBondContact O-CA 3.48Å; V303-V371 HydrophobicContact CG2-CG1 3.79Å; I360-V371 HydrophobicContact CG2-CG1 4.13Å; L363-V371 HydrophobicContact CB-CG2 4.33Å; V364-V371 HydrophobicContact CG2-CB 3.93Å; V364-V371 HydrophobicContact CG2-CG1 4.26Å; V364-V371 HydrophobicContact CG2-CG2 3.77Å; R369-V371 HydrophobicContact CG-CG2 3.75Å
372	I	94.8	Very high	88	Confident	0 Å²	0	23.4 Å²	23.4	0%	0	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	119.6	-170.7	-59.2	140.6	0	0	0	109.8	L270 C272 L293 V300 V301 L302 V303	L270-I372 HydrophobicContact CB-CB 4.41Å; L270-I372 HydrophobicContact CB-CG1 3.89Å; L270-I372 HydrophobicContact CB-CG2 4.45Å; L270-I372 HydrophobicContact CD2-CG1 4.21Å; L270-I372 HydrophobicContact CG-CG1 4.47Å; C272-I372 WeakPolarHBondContact SG-CG2 3.36Å; L293-I372 HydrophobicContact CB-CD1 3.93Å; L293-I372 HydrophobicContact CD2-CD1 3.77Å; L293-I372 HydrophobicContact CD2-CG1 4.34Å; L293-I372 HydrophobicContact CD2-CG2 4.15Å; L293-I372 HydrophobicContact CG-CD1 4.44Å; L293-I372 WeakPolarHBondContact O-CD1 3.44Å; V300-I372 HydrophobicContact CG1-CD1 3.33Å; V301-I372 PolarHBondContact O-N 3.37Å; L302-I372 HydrophobicContact CD2-CB 3.99Å; L302-I372 HydrophobicContact CD2-CD1 3.59Å; L302-I372 HydrophobicContact CD2-CG1 4.44Å; L302-I372 HydrophobicContact CD2-CG2 4.23Å; V303-I372 PolarHBondContact N-O 2.99Å
373	L	95.1	Very high	88.5	Confident	0 Å²	0	22.6 Å²	22.6	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	119.3	172.7	-51.5	-175.8	0	0	0	109.5	L269 L270 R271 C272 V303 I360 N382 L385	L269-L373 HydrophobicContact CD1-CD1 4.15Å; L269-L373 HydrophobicContact CD1-CD2 4.11Å; L269-L373 HydrophobicContact CD1-CG 3.91Å; L270-L373 PolarHBondContact O-N 3.48Å; R271-L373 HydrophobicContact CG-CB 4.49Å; R271-L373 HydrophobicContact CG-CD1 4.42Å; C272-L373 PolarHBondContact N-O 3.46Å; V303-L373 HydrophobicContact CB-CD2 3.95Å; V303-L373 HydrophobicContact CG1-CD2 4.14Å; V303-L373 HydrophobicContact CG2-CD2 4.24Å; I360-L373 HydrophobicContact CD1-CD2 3.71Å; I360-L373 HydrophobicContact CG1-CD2 4.31Å; I360-L373 HydrophobicContact CG2-CD2 4.21Å; L373-N382 WeakPolarHBondContact CB-OD1 3.17Å; L373-N382 PolarHBondContact O-ND2 2.95Å; L373-L385 HydrophobicContact CD1-CB 3.95Å
374	Q	90.7	Very high	89	Confident	21 Å²	21	22.1 Å²	22.1	10%	0.098	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	113.1	-179	-171.3	176.2	-28.2	0	0	111.1	V303 T305	V303-Q374 PolarHBondContact O-N 3.01Å; T305-Q374 PolarHBondContact N-O 3.37Å; T305-Q374 PolarHBondContact OG1-O 3.23Å; T305-Q374 VanDerWaalsContact OG1-O 3.1Å
375	E	89.7	Confident	89.5	Confident	12 Å²	12	22.1 Å²	22.1	6%	0.056	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	146	173	173	-177.4	-137.1	0	0	107.7	C272 G273 G274 T305 M306 G377 D378 R379 D380 L381 N382	C272-E375 PolarHBondContact O-N 3.42Å; G273-E375 CarbonylContact C-O 3.6Å; G273-E375 WeakPolarHBondContact CA-O 3.16Å; G274-E375 PolarHBondContact N-O 2.91Å; T305-E375 WeakPolarHBondContact OG1-CB 3.37Å; M306-E375 HydrophobicContact SD-CG 4.21Å; E375-G377 VanDerWaalsContact C-N 3.25Å; E375-G377 PolarHBondContact O-N 3.27Å; E375-G377 VanDerWaalsContact O-N 3.09Å; E375-D378 PolarHBondContact O-N 3.42Å; E375-D378 VanDerWaalsContact OE2-CA 3.26Å; E375-D378 WeakPolarHBondContact OE2-CA 3.43Å; E375-D378 PolarHBondContact OE2-N 3.04Å; E375-R379 PolarHBondContact OE2-N 2.97Å; E375-D380 WeakPolarHBondContact OE1-CB 3.21Å; E375-D380 PolarHBondContact OE2-N 2.88Å; E375-L381 WeakPolarHBondContact OE1-CB 3.19Å; E375-L381 PolarHBondContact OE1-N 2.92Å; E375-L381 PolarHBondContact OE2-N 3.32Å; E375-N382 HydrophobicContact CB-CB 4.23Å; E375-N382 VanDerWaalsContact CB-CG 3.43Å; E375-N382 WeakPolarHBondContact CB-OD1 3.23Å; E375-N382 PolarHBondContact N-ND2 2.68Å; E375-N382 PolarHBondContact N-OD1 2.65Å; E375-N382 PolarHBondContact OE2-N 3.41Å
376	R	86	Confident	90.3	Very high	166 Å²	166	21.3 Å²	21.3	63%	0.626	10%	0.101	S	C	*	.	S	Bend	trans	-47.6	-46.7	-179.1	-174.2	179.7	-176.5	-170.6	1.7	113.4	H252 G274 M306	H252-R376 WeakPolarHBondContact CB-O 2.9Å; G274-R376 PolarHBondContact N-O 3.32Å; M306-R376 HydrophobicContact SD-CB 4.4Å
377	G	85.8	Confident	91.7	Very high	19 Å²	19	19.9 Å²	19.9	20%	0.196	9%	0.091	C	C	.	.	S	Bend	trans	-103.5	-17.2	-178.5	0	0	0	0	0	115.2	R255 E375 R379	R255-G377 WeakPolarHBondContact CD-O 3.19Å; R255-G377 PolarHBondContact NE-O 2.99Å; E375-G377 VanDerWaalsContact C-N 3.25Å; E375-G377 PolarHBondContact O-N 3.27Å; E375-G377 VanDerWaalsContact O-N 3.09Å; G377-R379 VanDerWaalsContact C-N 3.33Å; G377-R379 WeakPolarHBondContact O-CG 3.49Å; G377-R379 PolarHBondContact O-N 3.38Å
378	D	92.3	Very high	93	Very high	0 Å²	0	16.2 Å²	16.2	0%	0	8%	0.077	C	C	.	.	S	Bend	trans	46.9	51	-174.4	176.3	44.6	0	0	0	114.6	R255 R258 R271 C272 E375 N382	R255-D378 VanDerWaalsContact CZ-O 3.31Å; R255-D378 PolarHBondContact NE-O 3.31Å; R255-D378 VanDerWaalsContact NE-O 3.07Å; R255-D378 IonicContact NE-OD2 2.71Å; R255-D378 PolarHBondContact NH2-O 3.17Å; R255-D378 IonicContact NH2-OD2 3.77Å; R258-D378 IonicContact CZ-OD2 3.28Å; R258-D378 IonicContact NH1-OD2 3.31Å; R258-D378 PolarHBondContact NH1-OD2 3.45Å; R258-D378 IonicContact NH2-OD1 3.71Å; R258-D378 IonicContact NH2-OD2 3.7Å; R258-D378 PolarHBondContact NH2-OD2 2.97Å; R271-D378 IonicContact CZ-OD1 3.79Å; R271-D378 IonicContact NE-OD1 2.79Å; R271-D378 PolarHBondContact NE-OD1 3.1Å; R271-D378 IonicContact NH2-OD1 2.78Å; R271-D378 PolarHBondContact NH2-OD1 3.06Å; C272-D378 VanDerWaalsContact C-CB 3.41Å; C272-D378 WeakPolarHBondContact O-CB 3.38Å; E375-D378 PolarHBondContact O-N 3.42Å; E375-D378 VanDerWaalsContact OE2-CA 3.26Å; E375-D378 WeakPolarHBondContact OE2-CA 3.43Å; E375-D378 PolarHBondContact OE2-N 3.04Å; D378-N382 WeakPolarHBondContact OD1-CB 3.23Å; D378-N382 PolarHBondContact OD1-ND2 3.38Å
379	R	91.8	Very high	93.7	Very high	35 Å²	35	13 Å²	13	13%	0.132	6%	0.058	C	C	.	.	S	Bend	trans	-138.3	-9.4	-174.9	-75	-179	81.3	-178.6	0.7	113.1	E375 G377 G415 H416 N477	E375-R379 PolarHBondContact OE2-N 2.97Å; G377-R379 VanDerWaalsContact C-N 3.33Å; G377-R379 WeakPolarHBondContact O-CG 3.49Å; G377-R379 PolarHBondContact O-N 3.38Å; R379-G415 PolarHBondContact NE-O 3.35Å; R379-G415 PolarHBondContact NH2-O 2.79Å; R379-H416 PolarHBondContact O-ND1 3.35Å; R379-N477 PolarHBondContact NH2-O 2.74Å
380	D	94.2	Very high	94.2	Very high	7 Å²	7	13 Å²	13	4%	0.037	6%	0.058	C	C	.	.	S	Bend	trans	-128.3	-91.4	-175	-62.1	-70.2	0	0	0	109.5	L312 E375 N382 G383 L384 H416 R421 V433	L312-D380 HydrophobicContact CD2-CB 3.95Å; E375-D380 WeakPolarHBondContact OE1-CB 3.21Å; E375-D380 PolarHBondContact OE2-N 2.88Å; D380-N382 VanDerWaalsContact C-N 3.33Å; D380-N382 PolarHBondContact O-N 2.74Å; D380-G383 PolarHBondContact O-N 2.99Å; D380-L384 PolarHBondContact O-N 3.37Å; D380-H416 IonicContact OD1-CE1 2.73Å; D380-H416 PolarHBondContact OD1-CE1 3.46Å; D380-H416 IonicContact OD1-ND1 3.73Å; D380-H416 PolarHBondContact OD1-ND1 2.79Å; D380-R421 IonicContact OD1-CZ 3.64Å; D380-R421 IonicContact OD1-NE 3.94Å; D380-R421 PolarHBondContact OD1-NE 3.29Å; D380-R421 IonicContact OD1-NH2 3.28Å; D380-R421 IonicContact OD2-CZ 3.03Å; D380-R421 IonicContact OD2-NE 3.22Å; D380-R421 PolarHBondContact OD2-NE 3.43Å; D380-R421 IonicContact OD2-NH2 3.58Å; D380-R421 PolarHBondContact OD2-NH2 3.11Å; D380-V433 HydrophobicContact CB-CG1 4.22Å; D380-V433 HydrophobicContact CB-CG2 4.28Å
381	L	94.9	Very high	94.4	Very high	7 Å²	7	13 Å²	13	4%	0.037	6%	0.058	C	C	.	.	H	α-helix	trans	-67	-31.1	-169.6	-61.9	175.7	0	0	0	113.3	L309 E375 G383 L384 L385 V433	L309-L381 HydrophobicContact CB-CD1 3.8Å; L309-L381 HydrophobicContact CD1-CB 4.16Å; L309-L381 HydrophobicContact CD1-CD1 4.1Å; E375-L381 WeakPolarHBondContact OE1-CB 3.19Å; E375-L381 PolarHBondContact OE1-N 2.92Å; E375-L381 PolarHBondContact OE2-N 3.32Å; L381-G383 VanDerWaalsContact C-N 3.26Å; L381-G383 PolarHBondContact O-N 3.2Å; L381-L384 WeakPolarHBondContact O-CB 3.43Å; L381-L384 PolarHBondContact O-N 2.93Å; L381-L385 WeakPolarHBondContact O-CG 3.45Å; L381-L385 PolarHBondContact O-N 2.65Å; L381-V433 HydrophobicContact CD2-CG1 4.33Å
382	N	95.3	Very high	94.4	Very high	0 Å²	0	13 Å²	13	0%	0	6%	0.058	C	C	.	.	H	α-helix	trans	-60.3	-37.7	172.8	-89.2	5.5	0	0	0	112.2	C272 T305 L373 E375 D378 D380 S386	C272-N382 PolarHBondContact O-ND2 3.17Å; C272-N382 VanDerWaalsContact O-ND2 3.12Å; T305-N382 WeakPolarHBondContact CG2-OD1 3.39Å; L373-N382 WeakPolarHBondContact CB-OD1 3.17Å; L373-N382 PolarHBondContact O-ND2 2.95Å; E375-N382 HydrophobicContact CB-CB 4.23Å; E375-N382 VanDerWaalsContact CB-CG 3.43Å; E375-N382 WeakPolarHBondContact CB-OD1 3.23Å; E375-N382 PolarHBondContact N-ND2 2.68Å; E375-N382 PolarHBondContact N-OD1 2.65Å; E375-N382 PolarHBondContact OE2-N 3.41Å; D378-N382 WeakPolarHBondContact OD1-CB 3.23Å; D378-N382 PolarHBondContact OD1-ND2 3.38Å; D380-N382 VanDerWaalsContact C-N 3.33Å; D380-N382 PolarHBondContact O-N 2.74Å; N382-S386 VanDerWaalsContact O-CB 3.26Å; N382-S386 WeakPolarHBondContact O-CB 3.29Å; N382-S386 PolarHBondContact O-N 3.31Å
383	G	95.9	Very high	94.2	Very high	1 Å²	1	13.1 Å²	13.1	1%	0.01	6%	0.059	C	C	.	.	H	α-helix	trans	-70.7	-39.3	177	0	0	0	0	0	111.9	R271 D380 L381 S387	R271-G383 VanDerWaalsContact CZ-CA 3.42Å; R271-G383 VanDerWaalsContact NH1-CA 3.33Å; D380-G383 PolarHBondContact O-N 2.99Å; L381-G383 VanDerWaalsContact C-N 3.26Å; L381-G383 PolarHBondContact O-N 3.2Å; G383-S387 VanDerWaalsContact O-CB 3.26Å; G383-S387 WeakPolarHBondContact O-CB 3.36Å; G383-S387 PolarHBondContact O-N 3.4Å; G383-S387 PolarHBondContact O-OG 3.43Å
384	L	97.8	Very high	94	Very high	0 Å²	0	13.2 Å²	13.2	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-59.7	-54.8	172.7	-175.8	156.7	0	0	0	111.4	C353 D380 L381 S387 L388 W411 V433 L436 F437	C353-L384 HydrophobicContact CB-CD2 3.82Å; D380-L384 PolarHBondContact O-N 3.37Å; L381-L384 WeakPolarHBondContact O-CB 3.43Å; L381-L384 PolarHBondContact O-N 2.93Å; L384-S387 PolarHBondContact O-N 3.33Å; L384-L388 HydrophobicContact CD2-CD1 3.55Å; L384-L388 HydrophobicContact CD2-CG 4.29Å; L384-L388 HydrophobicContact CG-CD1 4.44Å; L384-L388 WeakPolarHBondContact O-CG 2.93Å; L384-L388 PolarHBondContact O-N 3.48Å; L384-W411 HydrophobicContact CB-CH2 4.02Å; L384-W411 HydrophobicContact CB-CZ2 4.06Å; L384-V433 HydrophobicContact CD1-CG1 4.25Å; L384-L436 HydrophobicContact CD1-CB 4.34Å; L384-L436 HydrophobicContact CD1-CD2 4.04Å; L384-L436 HydrophobicContact CD1-CG 4.03Å; L384-F437 HydrophobicContact CD1-CB 3.97Å; L384-F437 HydrophobicContact CG-CB 3.97Å; L384-F437 HydrophobicContact CG-CD2 4.39Å
385	L	97.7	Very high	94	Very high	0 Å²	0	13 Å²	13	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-63.3	-45.4	-178.3	-72.4	178.5	0	0	0	111.9	T305 L309 K356 A357 I360 L373 L381 S387 L388 V389	T305-L385 HydrophobicContact CG2-CD1 3.57Å; L309-L385 HydrophobicContact CD1-CD1 3.77Å; L309-L385 HydrophobicContact CD1-CD2 4.19Å; L309-L385 HydrophobicContact CD1-CG 4.04Å; K356-L385 HydrophobicContact CB-CD2 3.99Å; K356-L385 HydrophobicContact CG-CD1 4.16Å; K356-L385 HydrophobicContact CG-CD2 4.01Å; A357-L385 HydrophobicContact CB-CD2 4.26Å; I360-L385 HydrophobicContact CD1-CB 4.32Å; I360-L385 HydrophobicContact CD1-CD1 3.9Å; I360-L385 HydrophobicContact CD1-CD2 4.26Å; I360-L385 HydrophobicContact CD1-CG 4.41Å; L373-L385 HydrophobicContact CD1-CB 3.95Å; L381-L385 WeakPolarHBondContact O-CG 3.45Å; L381-L385 PolarHBondContact O-N 2.65Å; L385-S387 VanDerWaalsContact C-N 3.3Å; L385-S387 PolarHBondContact O-N 2.95Å; L385-L388 PolarHBondContact O-N 2.94Å; L385-V389 WeakPolarHBondContact O-CB 2.94Å; L385-V389 WeakPolarHBondContact O-CG2 3.2Å; L385-V389 PolarHBondContact O-N 2.83Å
386	S	97.7	Very high	94	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-60.2	-42.8	177.7	178.7	0	0	0	0	112.1	S260 N382 V389 Q390	S260-S386 PolarHBondContact OG-OG 3.08Å; N382-S386 VanDerWaalsContact O-CB 3.26Å; N382-S386 WeakPolarHBondContact O-CB 3.29Å; N382-S386 PolarHBondContact O-N 3.31Å; S386-V389 PolarHBondContact O-N 3.32Å; S386-Q390 WeakPolarHBondContact O-CG 3.26Å; S386-Q390 PolarHBondContact O-N 3.1Å; S386-Q390 VanDerWaalsContact O-N 3.1Å; S386-Q390 PolarHBondContact O-NE2 3.09Å; S386-Q390 PolarHBondContact OG-NE2 3.14Å; S386-Q390 VanDerWaalsContact OG-NE2 3.11Å
387	S	98.6	Very high	94.3	Very high	0 Å²	0	10 Å²	10	0%	0	6%	0.055	C	C	.	.	H	α-helix	trans	-63.7	-44.1	178.1	-55.8	0	0	0	0	111.1	G383 L384 L385 Q390 L391 E410 W411	G383-S387 VanDerWaalsContact O-CB 3.26Å; G383-S387 WeakPolarHBondContact O-CB 3.36Å; G383-S387 PolarHBondContact O-N 3.4Å; G383-S387 PolarHBondContact O-OG 3.43Å; L384-S387 PolarHBondContact O-N 3.33Å; L385-S387 VanDerWaalsContact C-N 3.3Å; L385-S387 PolarHBondContact O-N 2.95Å; S387-Q390 PolarHBondContact O-N 3.4Å; S387-L391 WeakPolarHBondContact O-CG 3.46Å; S387-L391 PolarHBondContact O-N 2.88Å; S387-E410 WeakPolarHBondContact OG-CB 3.32Å; S387-W411 PolarHBondContact OG-NE1 2.82Å
388	L	98.4	Very high	94.7	Very high	0 Å²	0	9.2 Å²	9.2	0%	0	5%	0.046	C	C	.	.	H	α-helix	trans	-65.2	-43.7	177.6	-69.7	180	0	0	0	112.3	C353 L354 A357 L384 L385 Q390 L391 L392 F437 C440 V441 L444	C353-L388 HydrophobicContact CB-CD1 4.38Å; L354-L388 HydrophobicContact CD2-CD1 4.41Å; A357-L388 HydrophobicContact CB-CB 3.58Å; A357-L388 HydrophobicContact CB-CD1 4.04Å; A357-L388 HydrophobicContact CB-CG 4.49Å; L384-L388 HydrophobicContact CD2-CD1 3.55Å; L384-L388 HydrophobicContact CD2-CG 4.29Å; L384-L388 HydrophobicContact CG-CD1 4.44Å; L384-L388 WeakPolarHBondContact O-CG 2.93Å; L384-L388 PolarHBondContact O-N 3.48Å; L385-L388 PolarHBondContact O-N 2.94Å; L388-Q390 VanDerWaalsContact C-N 3.25Å; L388-Q390 PolarHBondContact O-N 3.45Å; L388-L391 HydrophobicContact CD2-CD1 4.47Å; L388-L391 PolarHBondContact O-N 3.46Å; L388-L392 WeakPolarHBondContact O-CB 3.35Å; L388-L392 VanDerWaalsContact O-CG 3.28Å; L388-L392 WeakPolarHBondContact O-CG 3.22Å; L388-L392 PolarHBondContact O-N 3.05Å; L388-F437 HydrophobicContact CD2-CD2 4.14Å; L388-F437 HydrophobicContact CD2-CE2 4.11Å; L388-F437 HydrophobicContact CG-CD2 4.28Å; L388-F437 HydrophobicContact CG-CE2 4.43Å; L388-C440 HydrophobicContact CD1-CB 3.88Å; L388-C440 HydrophobicContact CD2-CB 3.79Å; L388-C440 HydrophobicContact CG-CB 4.45Å; L388-V441 HydrophobicContact CD2-CG2 4.19Å; L388-L444 HydrophobicContact CD2-CD1 4.17Å
389	V	97.4	Very high	94.8	Very high	0 Å²	0	10.7 Å²	10.7	0%	0	6%	0.055	C	C	.	.	H	α-helix	trans	-58	-41.5	177.4	169.9	0	0	0	0	111	L269 A357 I360 V364 L385 S386 L392 S393	L269-V389 HydrophobicContact CD2-CB 4.13Å; L269-V389 HydrophobicContact CD2-CG1 3.91Å; A357-V389 HydrophobicContact CB-CG2 4.38Å; I360-V389 HydrophobicContact CB-CG2 3.69Å; I360-V389 HydrophobicContact CG2-CG1 4.29Å; I360-V389 HydrophobicContact CG2-CG2 3.48Å; I360-V389 VanDerWaalsContact CG2-CG2 3.48Å; V364-V389 HydrophobicContact CG2-CG1 4.46Å; L385-V389 WeakPolarHBondContact O-CB 2.94Å; L385-V389 WeakPolarHBondContact O-CG2 3.2Å; L385-V389 PolarHBondContact O-N 2.83Å; S386-V389 PolarHBondContact O-N 3.32Å; V389-L392 PolarHBondContact O-N 3.03Å; V389-S393 WeakPolarHBondContact O-CB 3.49Å; V389-S393 PolarHBondContact O-N 2.84Å; V389-S393 PolarHBondContact O-OG 2.88Å
390	Q	96.7	Very high	94.9	Very high	6 Å²	6	10.1 Å²	10.1	3%	0.028	5%	0.054	C	C	.	.	H	α-helix	trans	-67.4	-35.5	175.5	-71	178.3	66.1	0	0	112.7	W261 S386 S387 L388 A394 L406 R409	W261-Q390 HydrophobicContact CB-CG 3.74Å; W261-Q390 HydrophobicContact CD2-CG 3.82Å; W261-Q390 HydrophobicContact CE3-CG 4.17Å; W261-Q390 HydrophobicContact CG-CG 3.61Å; S386-Q390 WeakPolarHBondContact O-CG 3.26Å; S386-Q390 PolarHBondContact O-N 3.1Å; S386-Q390 VanDerWaalsContact O-N 3.1Å; S386-Q390 PolarHBondContact O-NE2 3.09Å; S386-Q390 PolarHBondContact OG-NE2 3.14Å; S386-Q390 VanDerWaalsContact OG-NE2 3.11Å; S387-Q390 PolarHBondContact O-N 3.4Å; L388-Q390 VanDerWaalsContact C-N 3.25Å; L388-Q390 PolarHBondContact O-N 3.45Å; Q390-A394 WeakPolarHBondContact O-CA 3.49Å; Q390-A394 VanDerWaalsContact O-CB 3.26Å; Q390-A394 WeakPolarHBondContact O-CB 3.26Å; Q390-A394 PolarHBondContact O-N 3.17Å; Q390-L406 HydrophobicContact CB-CD1 4.14Å; Q390-L406 VanDerWaalsContact CD-CD1 3.48Å; Q390-L406 HydrophobicContact CG-CD1 4.45Å; Q390-R409 VanDerWaalsContact CD-NH2 3.34Å
391	L	97	Very high	94.9	Very high	0 Å²	0	14.1 Å²	14.1	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-71.4	-38.2	175.1	-68.8	165.3	0	0	0	112.5	S387 L388 S393 A397 R398 F403 L406 F437 V441 L444 F452	S387-L391 WeakPolarHBondContact O-CG 3.46Å; S387-L391 PolarHBondContact O-N 2.88Å; L388-L391 HydrophobicContact CD2-CD1 4.47Å; L388-L391 PolarHBondContact O-N 3.46Å; L391-S393 VanDerWaalsContact C-N 3.35Å; L391-A397 HydrophobicContact CD2-CB 3.98Å; L391-A397 WeakPolarHBondContact CD2-O 3.42Å; L391-R398 HydrophobicContact CD2-CG 4.43Å; L391-R398 PolarHBondContact O-NE 2.65Å; L391-R398 PolarHBondContact O-NH2 3Å; L391-F403 HydrophobicContact CD1-CD2 4.28Å; L391-F403 HydrophobicContact CD1-CE2 3.88Å; L391-F403 HydrophobicContact CD2-CD2 3.82Å; L391-F403 HydrophobicContact CD2-CE2 4.27Å; L391-L406 HydrophobicContact CD1-CD2 4.23Å; L391-L406 HydrophobicContact CD2-CD2 4.07Å; L391-L406 HydrophobicContact CG-CD2 3.88Å; L391-F437 HydrophobicContact CD1-CE2 4.13Å; L391-F437 HydrophobicContact CD1-CZ 4.26Å; L391-V441 HydrophobicContact CD1-CG1 4.46Å; L391-V441 HydrophobicContact CD1-CG2 3.67Å; L391-L444 HydrophobicContact CB-CD1 4.34Å; L391-F452 HydrophobicContact CD2-CE1 4.26Å
392	L	94.9	Very high	94.8	Very high	0 Å²	0	14.4 Å²	14.4	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-67.3	-40.7	176.2	-68.1	-180	0	0	0	111.2	A357 L388 V389 R398 L444 L622 L623 P625	A357-L392 HydrophobicContact CB-CD1 4.01Å; L388-L392 WeakPolarHBondContact O-CB 3.35Å; L388-L392 VanDerWaalsContact O-CG 3.28Å; L388-L392 WeakPolarHBondContact O-CG 3.22Å; L388-L392 PolarHBondContact O-N 3.05Å; V389-L392 PolarHBondContact O-N 3.03Å; L392-R398 PolarHBondContact O-NH2 3.32Å; L392-L444 HydrophobicContact CD2-CD1 3.85Å; L392-L444 HydrophobicContact CD2-CD2 3.65Å; L392-L444 HydrophobicContact CD2-CG 4.41Å; L392-L444 HydrophobicContact CG-CD1 4.47Å; L392-L622 HydrophobicContact CB-CD1 4.43Å; L392-L623 HydrophobicContact CD2-CB 4.04Å; L392-L623 PolarHBondContact O-N 3.21Å; L392-P625 HydrophobicContact CD2-CG 4.01Å
393	S	91.2	Very high	94.9	Very high	2 Å²	2	14.4 Å²	14.4	1%	0.014	8%	0.076	C	C	.	.	H	α-helix	trans	-87.4	-50.5	-174.6	-51.2	0	0	0	0	111.8	V389 L391 W544	V389-S393 WeakPolarHBondContact O-CB 3.49Å; V389-S393 PolarHBondContact O-N 2.84Å; V389-S393 PolarHBondContact O-OG 2.88Å; L391-S393 VanDerWaalsContact C-N 3.35Å; S393-W544 WeakPolarHBondContact O-CH2 3.26Å; S393-W544 WeakPolarHBondContact O-CZ2 3.5Å
394	A	90	Very high	94.9	Very high	2 Å²	2	15.2 Å²	15.2	2%	0.017	8%	0.079	C	C	.	.			trans	-104.2	116.1	-167.3	0	0	0	0	0	114.5	W261 Q390 E396 A397 W544	W261-A394 HydrophobicContact CZ2-CB 3.88Å; Q390-A394 WeakPolarHBondContact O-CA 3.49Å; Q390-A394 VanDerWaalsContact O-CB 3.26Å; Q390-A394 WeakPolarHBondContact O-CB 3.26Å; Q390-A394 PolarHBondContact O-N 3.17Å; A394-E396 VanDerWaalsContact C-N 3.31Å; A394-E396 HydrophobicContact CB-CG 4.22Å; A394-E396 PolarHBondContact O-N 2.97Å; A394-A397 HydrophobicContact CB-CB 4.36Å; A394-A397 WeakPolarHBondContact O-CB 3.43Å; A394-A397 PolarHBondContact O-N 3.27Å; A394-A397 VanDerWaalsContact O-N 3.11Å; A394-W544 HydrophobicContact CB-CH2 4.12Å; A394-W544 HydrophobicContact CB-CZ3 4.27Å
395	P	90.4	Very high	94.7	Very high	17 Å²	17	15.5 Å²	15.5	11%	0.11	8%	0.082	C	C	.	.	G	3₁₀ helix	trans	-62.2	-34.8	176.3	-26.7	35.1	0	0	0	113.7	A397 R398 C540 W544	P395-A397 PolarHBondContact O-N 3.1Å; P395-R398 WeakPolarHBondContact O-CA 3.46Å; P395-R398 WeakPolarHBondContact O-CB 3.38Å; P395-R398 PolarHBondContact O-N 3.36Å; P395-C540 WeakPolarHBondContact CB-SG 3.49Å; P395-C540 WeakPolarHBondContact CG-SG 3.07Å; P395-W544 HydrophobicContact CG-CZ2 3.84Å
396	E	89.3	Confident	94.7	Very high	105 Å²	105	15.7 Å²	15.7	49%	0.491	8%	0.082	S	C	.	.	G	3₁₀ helix	trans	-59.6	-28	175.7	43.5	-168.7	172.6	0	0	112.3	A394 R398 T399 G402	A394-E396 VanDerWaalsContact C-N 3.31Å; A394-E396 HydrophobicContact CB-CG 4.22Å; A394-E396 PolarHBondContact O-N 2.97Å; E396-R398 VanDerWaalsContact C-N 3.3Å; E396-R398 PolarHBondContact O-N 2.96Å; E396-T399 PolarHBondContact O-OG1 2.68Å; E396-G402 WeakPolarHBondContact O-CA 3.42Å
397	A	93.3	Very high	94.6	Very high	9 Å²	9	15.7 Å²	15.7	7%	0.074	8%	0.082	C	C	.	.	G	3₁₀ helix	trans	-74.1	-16.3	172.7	0	0	0	0	0	114	L391 A394 P395 F403 L406	L391-A397 HydrophobicContact CD2-CB 3.98Å; L391-A397 WeakPolarHBondContact CD2-O 3.42Å; A394-A397 HydrophobicContact CB-CB 4.36Å; A394-A397 WeakPolarHBondContact O-CB 3.43Å; A394-A397 PolarHBondContact O-N 3.27Å; A394-A397 VanDerWaalsContact O-N 3.11Å; P395-A397 PolarHBondContact O-N 3.1Å; A397-F403 WeakPolarHBondContact O-CA 3.43Å; A397-F403 PolarHBondContact O-N 3.4Å; A397-L406 HydrophobicContact CB-CD2 4.45Å
398	R	94.8	Very high	94.5	Very high	2 Å²	2	16 Å²	16	1%	0.008	8%	0.084	C	C	.	.	G	3₁₀ helix	trans	-90	-5.4	-179.8	-50.6	178.1	-160.7	146.5	7.8	113.2	L391 L392 P395 E396 D451 F452 E453 F454 G621	L391-R398 HydrophobicContact CD2-CG 4.43Å; L391-R398 PolarHBondContact O-NE 2.65Å; L391-R398 PolarHBondContact O-NH2 3Å; L392-R398 PolarHBondContact O-NH2 3.32Å; P395-R398 WeakPolarHBondContact O-CA 3.46Å; P395-R398 WeakPolarHBondContact O-CB 3.38Å; P395-R398 PolarHBondContact O-N 3.36Å; E396-R398 VanDerWaalsContact C-N 3.3Å; E396-R398 PolarHBondContact O-N 2.96Å; R398-D451 WeakPolarHBondContact CB-O 3.41Å; R398-D451 WeakPolarHBondContact CD-O 3.47Å; R398-D451 IonicContact NH1-OD1 3.85Å; R398-D451 PolarHBondContact NH1-OD1 3.24Å; R398-F452 HydrophobicContact CB-CD1 3.85Å; R398-F452 HydrophobicContact CB-CE1 4.14Å; R398-F452 HydrophobicContact CB-CG 4.26Å; R398-F452 HydrophobicContact CG-CD1 4.12Å; R398-F452 HydrophobicContact CG-CE1 3.9Å; R398-F452 HydrophobicContact CG-CZ 4.16Å; R398-E453 PolarHBondContact O-N 2.88Å; R398-F454 WeakPolarHBondContact O-CD1 3.31Å; R398-F454 WeakPolarHBondContact O-CE1 3.32Å; R398-G621 PolarHBondContact NH2-O 3.18Å
399	T	94.4	Very high	94.3	Very high	31 Å²	31	16.8 Å²	16.8	19%	0.19	9%	0.087	C	C	.	.	S	Bend	trans	-73.1	157.2	169.7	66.5	0	0	0	0	111	E396 F401 G402 F403 E453	E396-T399 PolarHBondContact O-OG1 2.68Å; T399-F401 VanDerWaalsContact C-N 3.34Å; T399-F401 PolarHBondContact O-N 3.01Å; T399-G402 PolarHBondContact O-N 2.99Å; T399-G402 WeakPolarHBondContact OG1-CA 3.34Å; T399-G402 PolarHBondContact OG1-N 3.36Å; T399-F403 WeakPolarHBondContact O-CB 3.45Å; T399-F403 PolarHBondContact O-N 3.32Å; T399-E453 WeakPolarHBondContact CA-OE2 3.47Å; T399-E453 WeakPolarHBondContact CB-OE2 3.45Å
400	L	93.6	Very high	94.3	Very high	24 Å²	24	17.3 Å²	17.3	13%	0.126	9%	0.089	C	C	.	.	H	α-helix	trans	-56.3	-49.8	174.5	-88.3	166.9	0	0	0	110.7	Q404 E453 F454 F458 F530 Q531	L400-Q404 WeakPolarHBondContact O-CG 3.22Å; L400-Q404 PolarHBondContact O-N 3.37Å; L400-Q404 VanDerWaalsContact O-N 3.16Å; L400-E453 PolarHBondContact N-OE2 2.61Å; L400-F454 HydrophobicContact CD2-CB 3.53Å; L400-F454 HydrophobicContact CG-CB 3.92Å; L400-F458 HydrophobicContact CD2-CB 4.44Å; L400-F458 HydrophobicContact CD2-CD1 4.11Å; L400-F458 HydrophobicContact CD2-CD2 3.78Å; L400-F458 HydrophobicContact CD2-CE1 4.29Å; L400-F458 HydrophobicContact CD2-CE2 4Å; L400-F458 HydrophobicContact CD2-CG 3.84Å; L400-F458 HydrophobicContact CD2-CZ 4.25Å; L400-F530 HydrophobicContact CD2-CB 4.17Å; L400-Q531 HydrophobicContact CD1-CG 3.72Å
401	F	93.1	Very high	94.2	Very high	91 Å²	91	17.1 Å²	17.1	40%	0.399	9%	0.088	S	C	.	.	H	α-helix	trans	-65.1	-43.2	179.1	174	-86.9	0	0	0	112	P192 V193 T399 Q404 S405	P192-F401 WeakPolarHBondContact O-CE2 3.47Å; V193-F401 HydrophobicContact CG2-CD2 4.04Å; V193-F401 HydrophobicContact CG2-CE2 4.1Å; T399-F401 VanDerWaalsContact C-N 3.34Å; T399-F401 PolarHBondContact O-N 3.01Å; F401-Q404 PolarHBondContact O-N 3.4Å; F401-S405 WeakPolarHBondContact CE1-OG 3.42Å; F401-S405 WeakPolarHBondContact O-CB 3.31Å; F401-S405 PolarHBondContact O-N 3.12Å; F401-S405 PolarHBondContact O-OG 2.89Å
402	G	94.2	Very high	94.1	Very high	12 Å²	12	17.3 Å²	17.3	12%	0.124	9%	0.089	C	C	.	.	H	α-helix	trans	-65.4	-41.9	-179.3	0	0	0	0	0	112.7	E396 T399 S405 L406	E396-G402 WeakPolarHBondContact O-CA 3.42Å; T399-G402 PolarHBondContact O-N 2.99Å; T399-G402 WeakPolarHBondContact OG1-CA 3.34Å; T399-G402 PolarHBondContact OG1-N 3.36Å; G402-S405 PolarHBondContact O-N 3.14Å; G402-L406 VanDerWaalsContact O-CB 3.31Å; G402-L406 WeakPolarHBondContact O-CB 3.41Å; G402-L406 PolarHBondContact O-N 2.92Å
403	F	97.1	Very high	94	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-65.3	-42.7	176.2	-170.5	-88.8	0	0	0	112	L391 A397 T399 S405 L406 V407 F437 L438 V441 F454 F458 L459 L462	L391-F403 HydrophobicContact CD1-CD2 4.28Å; L391-F403 HydrophobicContact CD1-CE2 3.88Å; L391-F403 HydrophobicContact CD2-CD2 3.82Å; L391-F403 HydrophobicContact CD2-CE2 4.27Å; A397-F403 WeakPolarHBondContact O-CA 3.43Å; A397-F403 PolarHBondContact O-N 3.4Å; T399-F403 WeakPolarHBondContact O-CB 3.45Å; T399-F403 PolarHBondContact O-N 3.32Å; F403-S405 PolarHBondContact O-N 2.88Å; F403-L406 WeakPolarHBondContact O-CB 3.15Å; F403-L406 PolarHBondContact O-N 2.82Å; F403-V407 HydrophobicContact CD1-CG2 3.94Å; F403-V407 HydrophobicContact CE1-CG2 3.59Å; F403-V407 HydrophobicContact CZ-CG2 4.08Å; F403-V407 WeakPolarHBondContact O-CG2 3.14Å; F403-V407 PolarHBondContact O-N 3.12Å; F403-F437 HydrophobicContact CE2-CE1 4.35Å; F403-F437 AromaticContact CE2-CZ 3.92Å; F403-F437 HydrophobicContact CE2-CZ 3.92Å; F403-F437 AromaticContact CZ-CE1 3.81Å; F403-F437 HydrophobicContact CZ-CE1 3.81Å; F403-F437 AromaticContact CZ-CZ 3.85Å; F403-F437 HydrophobicContact CZ-CZ 3.85Å; F403-L438 HydrophobicContact CZ-CD2 4.26Å; F403-V441 HydrophobicContact CE2-CB 4.42Å; F403-V441 HydrophobicContact CE2-CG1 3.74Å; F403-V441 HydrophobicContact CE2-CG2 3.9Å; F403-V441 HydrophobicContact CZ-CG1 4.18Å; F403-V441 HydrophobicContact CZ-CG2 4.19Å; F403-F454 HydrophobicContact CB-CD1 4.07Å; F403-F454 HydrophobicContact CB-CE1 3.64Å; F403-F454 HydrophobicContact CB-CZ 4.42Å; F403-F454 AromaticContact CD2-CE1 3.58Å; F403-F454 HydrophobicContact CD2-CE1 3.58Å; F403-F454 AromaticContact CD2-CZ 3.53Å; F403-F454 HydrophobicContact CD2-CZ 3.53Å; F403-F454 HydrophobicContact CE2-CE1 4.4Å; F403-F454 AromaticContact CE2-CZ 3.9Å; F403-F454 HydrophobicContact CE2-CZ 3.9Å; F403-F454 HydrophobicContact CG-CD1 4.37Å; F403-F454 AromaticContact CG-CE1 3.7Å; F403-F454 HydrophobicContact CG-CE1 3.7Å; F403-F454 AromaticContact CG-CZ 3.99Å; F403-F454 HydrophobicContact CG-CZ 3.99Å; F403-F458 HydrophobicContact CB-CE1 4.45Å; F403-F458 AromaticContact CD1-CE1 3.42Å; F403-F458 HydrophobicContact CD1-CE1 3.42Å; F403-F458 VanDerWaalsContact CD1-CE1 3.42Å; F403-F458 AromaticContact CD1-CZ 3.9Å; F403-F458 HydrophobicContact CD1-CZ 3.9Å; F403-F458 AromaticContact CE1-CE1 3.91Å; F403-F458 HydrophobicContact CE1-CE1 3.91Å; F403-F458 HydrophobicContact CG-CE1 4.14Å; F403-L459 HydrophobicContact CE1-CD2 4.2Å; F403-L459 HydrophobicContact CZ-CD2 3.99Å; F403-L462 HydrophobicContact CE1-CD2 3.7Å
404	Q	95.6	Very high	94.1	Very high	18 Å²	18	17.8 Å²	17.8	8%	0.084	9%	0.094	C	C	.	.	H	α-helix	trans	-62	-43.8	175.2	-65.8	175.1	36.6	0	0	111.3	V193 L400 F401 L406 V407 Q408 F458 W516	V193-Q404 HydrophobicContact CG2-CB 3.69Å; L400-Q404 WeakPolarHBondContact O-CG 3.22Å; L400-Q404 PolarHBondContact O-N 3.37Å; L400-Q404 VanDerWaalsContact O-N 3.16Å; F401-Q404 PolarHBondContact O-N 3.4Å; Q404-L406 VanDerWaalsContact C-N 3.33Å; Q404-L406 PolarHBondContact O-N 2.79Å; Q404-V407 PolarHBondContact O-N 2.81Å; Q404-Q408 VanDerWaalsContact O-CB 3.32Å; Q404-Q408 WeakPolarHBondContact O-CB 3.26Å; Q404-Q408 PolarHBondContact O-N 2.98Å; Q404-F458 HydrophobicContact CG-CE2 4.13Å; Q404-F458 HydrophobicContact CG-CZ 3.75Å; Q404-W516 HydrophobicContact CB-CD2 4.03Å; Q404-W516 HydrophobicContact CB-CE3 3.66Å; Q404-W516 HydrophobicContact CB-CH2 4.06Å; Q404-W516 HydrophobicContact CB-CZ2 4.39Å; Q404-W516 HydrophobicContact CB-CZ3 3.69Å; Q404-W516 HydrophobicContact CG-CD2 4.27Å; Q404-W516 HydrophobicContact CG-CE3 3.46Å; Q404-W516 VanDerWaalsContact CG-CE3 3.46Å; Q404-W516 HydrophobicContact CG-CH2 4.32Å; Q404-W516 HydrophobicContact CG-CZ3 3.5Å; Q404-W516 VanDerWaalsContact CG-CZ3 3.5Å; Q404-W516 WeakPolarHBondContact O-CZ2 3.37Å
405	S	94	Very high	94.3	Very high	7 Å²	7	17.7 Å²	17.7	5%	0.049	9%	0.093	C	C	.	.	H	α-helix	trans	-61.3	-40.9	175	-57.6	0	0	0	0	112	F401 G402 F403 Q408 R409	F401-S405 WeakPolarHBondContact CE1-OG 3.42Å; F401-S405 WeakPolarHBondContact O-CB 3.31Å; F401-S405 PolarHBondContact O-N 3.12Å; F401-S405 PolarHBondContact O-OG 2.89Å; G402-S405 PolarHBondContact O-N 3.14Å; F403-S405 PolarHBondContact O-N 2.88Å; S405-Q408 PolarHBondContact O-N 2.64Å; S405-R409 WeakPolarHBondContact O-CB 3.14Å; S405-R409 PolarHBondContact O-N 2.84Å
406	L	96.6	Very high	94.5	Very high	3 Å²	3	17.2 Å²	17.2	2%	0.016	9%	0.089	C	C	.	.	H	α-helix	trans	-62	-49.6	176.2	-179.2	67.8	0	0	0	111.4	Q390 L391 A397 G402 F403 Q404 Q408 R409 E410	Q390-L406 HydrophobicContact CB-CD1 4.14Å; Q390-L406 VanDerWaalsContact CD-CD1 3.48Å; Q390-L406 HydrophobicContact CG-CD1 4.45Å; L391-L406 HydrophobicContact CD1-CD2 4.23Å; L391-L406 HydrophobicContact CD2-CD2 4.07Å; L391-L406 HydrophobicContact CG-CD2 3.88Å; A397-L406 HydrophobicContact CB-CD2 4.45Å; G402-L406 VanDerWaalsContact O-CB 3.31Å; G402-L406 WeakPolarHBondContact O-CB 3.41Å; G402-L406 PolarHBondContact O-N 2.92Å; F403-L406 WeakPolarHBondContact O-CB 3.15Å; F403-L406 PolarHBondContact O-N 2.82Å; Q404-L406 VanDerWaalsContact C-N 3.33Å; Q404-L406 PolarHBondContact O-N 2.79Å; L406-Q408 PolarHBondContact O-N 2.79Å; L406-R409 PolarHBondContact O-N 2.88Å; L406-E410 HydrophobicContact CD1-CG 3.72Å; L406-E410 WeakPolarHBondContact O-CB 3.43Å; L406-E410 PolarHBondContact O-N 3.06Å
407	V	97	Very high	94.6	Very high	0 Å²	0	12.4 Å²	12.4	0%	0	7%	0.067	C	C	.	.	H	α-helix	trans	-62.3	-43.9	177.3	171.9	0	0	0	0	110.9	F403 Q404 R409 W411 V412 F434 F437 L462 F474 W516	F403-V407 HydrophobicContact CD1-CG2 3.94Å; F403-V407 HydrophobicContact CE1-CG2 3.59Å; F403-V407 HydrophobicContact CZ-CG2 4.08Å; F403-V407 WeakPolarHBondContact O-CG2 3.14Å; F403-V407 PolarHBondContact O-N 3.12Å; Q404-V407 PolarHBondContact O-N 2.81Å; V407-R409 VanDerWaalsContact C-N 3.3Å; V407-R409 PolarHBondContact O-N 3.21Å; V407-W411 VanDerWaalsContact O-CB 3.31Å; V407-W411 WeakPolarHBondContact O-CB 3.04Å; V407-W411 PolarHBondContact O-N 3.01Å; V407-W411 VanDerWaalsContact O-N 3.13Å; V407-V412 PolarHBondContact O-N 3.03Å; V407-F434 HydrophobicContact CG1-CE2 3.98Å; V407-F434 HydrophobicContact CG1-CZ 3.87Å; V407-F434 HydrophobicContact CG2-CE2 4.49Å; V407-F437 HydrophobicContact CG2-CE1 4.21Å; V407-L462 HydrophobicContact CG2-CD2 4.29Å; V407-F474 HydrophobicContact CG1-CE1 4.47Å; V407-F474 HydrophobicContact CG1-CZ 4.41Å; V407-W516 HydrophobicContact CB-CH2 3.84Å; V407-W516 HydrophobicContact CB-CZ2 4.28Å; V407-W516 HydrophobicContact CG1-CH2 3.77Å; V407-W516 HydrophobicContact CG1-CZ2 4.17Å
408	Q	95.3	Very high	94.5	Very high	8 Å²	8	12 Å²	12	4%	0.037	6%	0.064	C	C	.	.	I	π-helix	trans	-59.4	-41.2	176.7	-174.4	60.4	41.4	0	0	111.5	V193 P194 L195 M196 Q404 S405 L406 V412 A413 W516	V193-Q408 HydrophobicContact CG1-CB 4.23Å; P194-Q408 WeakPolarHBondContact O-CG 2.97Å; L195-Q408 PolarHBondContact O-NE2 3.28Å; M196-Q408 HydrophobicContact CG-CG 4.39Å; Q404-Q408 VanDerWaalsContact O-CB 3.32Å; Q404-Q408 WeakPolarHBondContact O-CB 3.26Å; Q404-Q408 PolarHBondContact O-N 2.98Å; S405-Q408 PolarHBondContact O-N 2.64Å; L406-Q408 PolarHBondContact O-N 2.79Å; Q408-V412 WeakPolarHBondContact O-CB 3.24Å; Q408-A413 VanDerWaalsContact O-CB 3.32Å; Q408-A413 WeakPolarHBondContact O-CB 3.5Å; Q408-A413 PolarHBondContact O-N 3.3Å; Q408-W516 HydrophobicContact CB-CZ2 4Å
409	R	95	Very high	94.1	Very high	15 Å²	15	13.3 Å²	13.3	6%	0.057	7%	0.071	C	C	.	.	I	π-helix	trans	-77.6	-55	-179.3	-170.1	177.5	76.7	-135.1	9.4	113.2	M196 E205 S260 Q390 S405 L406 V407 A414	M196-R409 HydrophobicContact CE-CG 3.96Å; E205-R409 IonicContact OE2-NH1 3.39Å; S260-R409 PolarHBondContact O-NH2 3.45Å; Q390-R409 VanDerWaalsContact CD-NH2 3.34Å; S405-R409 WeakPolarHBondContact O-CB 3.14Å; S405-R409 PolarHBondContact O-N 2.84Å; L406-R409 PolarHBondContact O-N 2.88Å; V407-R409 VanDerWaalsContact C-N 3.3Å; V407-R409 PolarHBondContact O-N 3.21Å; R409-A414 WeakPolarHBondContact O-CB 3.34Å; R409-A414 PolarHBondContact O-N 3.48Å
410	E	96.2	Very high	93.8	Very high	11 Å²	11	12.7 Å²	12.7	5%	0.051	7%	0.067	C	C	.	.	I	π-helix	trans	-81.8	-18.1	-167.7	-67.9	-58.4	142.4	0	0	114.2	S260 R271 S387 L406 A414	S260-E410 PolarHBondContact OG-OE1 2.87Å; S260-E410 PolarHBondContact OG-OE2 3.03Å; R271-E410 WeakPolarHBondContact CD-OE2 3.25Å; R271-E410 IonicContact CZ-OE2 2.72Å; R271-E410 IonicContact NE-OE2 3.89Å; R271-E410 PolarHBondContact NH1-O 3.49Å; R271-E410 IonicContact NH1-OE2 3.67Å; R271-E410 PolarHBondContact NH1-OE2 3.34Å; S387-E410 WeakPolarHBondContact OG-CB 3.32Å; L406-E410 HydrophobicContact CD1-CG 3.72Å; L406-E410 WeakPolarHBondContact O-CB 3.43Å; L406-E410 PolarHBondContact O-N 3.06Å; E410-A414 VanDerWaalsContact O-CB 3.25Å; E410-A414 WeakPolarHBondContact O-CB 3.12Å
411	W	95.9	Very high	93.7	Very high	2 Å²	2	12.3 Å²	12.3	1%	0.008	6%	0.064	C	C	.	.	I	π-helix	trans	-117.1	-56.4	-179.3	-61.4	79.1	0	0	0	112.1	L384 S387 V407 G415 H416 F418 V433 F434 F437	L384-W411 HydrophobicContact CB-CH2 4.02Å; L384-W411 HydrophobicContact CB-CZ2 4.06Å; S387-W411 PolarHBondContact OG-NE1 2.82Å; V407-W411 VanDerWaalsContact O-CB 3.31Å; V407-W411 WeakPolarHBondContact O-CB 3.04Å; V407-W411 PolarHBondContact O-N 3.01Å; V407-W411 VanDerWaalsContact O-N 3.13Å; W411-G415 PolarHBondContact O-N 2.91Å; W411-H416 HydrophobicContact CB-CB 4.39Å; W411-H416 HydrophobicContact CE3-CB 4.01Å; W411-H416 AromaticContact CE3-CD2 3.86Å; W411-H416 AromaticContact CE3-CG 3.62Å; W411-H416 AromaticContact CE3-ND1 3.83Å; W411-H416 AromaticContact CZ3-CE1 3.84Å; W411-H416 AromaticContact CZ3-ND1 3.82Å; W411-H416 VanDerWaalsContact O-CB 3.26Å; W411-H416 WeakPolarHBondContact O-CB 3.26Å; W411-H416 PolarHBondContact O-N 3.12Å; W411-F418 HydrophobicContact CB-CE2 4.23Å; W411-F418 HydrophobicContact CB-CZ 3.98Å; W411-V433 HydrophobicContact CH2-CG1 4.12Å; W411-V433 HydrophobicContact CZ3-CG1 4.26Å; W411-F434 AromaticContact CD2-CD2 3.55Å; W411-F434 HydrophobicContact CD2-CD2 3.55Å; W411-F434 AromaticContact CD2-CE2 3.85Å; W411-F434 HydrophobicContact CD2-CE2 3.85Å; W411-F434 AromaticContact CE2-CD2 3.87Å; W411-F434 HydrophobicContact CE3-CB 4.38Å; W411-F434 AromaticContact CE3-CD2 3.49Å; W411-F434 HydrophobicContact CE3-CD2 3.49Å; W411-F434 VanDerWaalsContact CE3-CD2 3.49Å; W411-F434 HydrophobicContact CE3-CE2 4.24Å; W411-F434 HydrophobicContact CE3-CG 4.38Å; W411-F434 HydrophobicContact CG-CD2 4.14Å; W411-F434 AromaticContact CG-CE2 3.98Å; W411-F434 HydrophobicContact CG-CE2 3.98Å; W411-F434 HydrophobicContact CH2-CD2 4.03Å; W411-F434 HydrophobicContact CZ2-CD2 4.11Å; W411-F434 HydrophobicContact CZ3-CB 4.02Å; W411-F434 AromaticContact CZ3-CD2 3.74Å; W411-F434 HydrophobicContact CZ3-CD2 3.74Å; W411-F434 HydrophobicContact CZ3-CG 4.4Å; W411-F437 AromaticContact CE2-CD1 3.92Å; W411-F437 HydrophobicContact CH2-CB 3.68Å; W411-F437 HydrophobicContact CH2-CD1 4.45Å; W411-F437 HydrophobicContact CH2-CG 4.13Å; W411-F437 HydrophobicContact CZ2-CB 3.45Å; W411-F437 VanDerWaalsContact CZ2-CB 3.45Å; W411-F437 AromaticContact CZ2-CD1 3.64Å; W411-F437 HydrophobicContact CZ2-CD1 3.64Å; W411-F437 AromaticContact CZ2-CD2 3.93Å; W411-F437 HydrophobicContact CZ2-CD2 3.93Å; W411-F437 HydrophobicContact CZ2-CE1 4.37Å; W411-F437 AromaticContact CZ2-CG 3.38Å; W411-F437 HydrophobicContact CZ2-CG 3.38Å; W411-F437 AromaticContact NE1-CE1 3.93Å
412	V	93.9	Very high	93.2	Very high	4 Å²	4	9.4 Å²	9.4	2%	0.024	5%	0.052	C	C	.	.	I	π-helix	trans	-73.4	-59.9	-174.5	-175.5	0	0	0	0	110.5	V407 Q408 A414 G415 F418 T473 F474 R482	V407-V412 PolarHBondContact O-N 3.03Å; Q408-V412 WeakPolarHBondContact O-CB 3.24Å; V412-A414 PolarHBondContact O-N 3.36Å; V412-G415 PolarHBondContact O-N 3Å; V412-G415 VanDerWaalsContact O-N 3.16Å; V412-F418 HydrophobicContact CG2-CE2 4.26Å; V412-T473 HydrophobicContact CB-CG2 4.41Å; V412-T473 HydrophobicContact CG1-CG2 3.98Å; V412-T473 HydrophobicContact CG2-CG2 3.58Å; V412-F474 HydrophobicContact CG2-CD1 4.23Å; V412-F474 HydrophobicContact CG2-CE1 3.72Å; V412-R482 PolarHBondContact O-NH2 2.94Å
413	A	93.3	Very high	92.4	Very high	6 Å²	6	9.4 Å²	9.4	5%	0.05	5%	0.052	C	C	.	.	I	π-helix	trans	-67.4	-39	-178.4	0	0	0	0	0	111.9	M196 W202 P230 Q408 G415 P479	M196-A413 HydrophobicContact CB-CB 3.72Å; M196-A413 HydrophobicContact CG-CB 4.39Å; W202-A413 HydrophobicContact CZ2-CB 4.05Å; P230-A413 WeakPolarHBondContact CB-O 3.16Å; P230-A413 WeakPolarHBondContact CD-O 3.21Å; Q408-A413 VanDerWaalsContact O-CB 3.32Å; Q408-A413 WeakPolarHBondContact O-CB 3.5Å; Q408-A413 PolarHBondContact O-N 3.3Å; A413-G415 PolarHBondContact O-N 3.38Å; A413-G415 VanDerWaalsContact O-N 3.14Å; A413-P479 WeakPolarHBondContact O-CG 3.3Å
414	A	93.6	Very high	90.9	Very high	7 Å²	7	11.1 Å²	11.1	6%	0.058	7%	0.07	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-14.7	174.8	0	0	0	0	0	113.9	R255 R409 E410 V412	R255-A414 PolarHBondContact NH1-O 3.03Å; R255-A414 PolarHBondContact NH2-O 2.87Å; R409-A414 WeakPolarHBondContact O-CB 3.34Å; R409-A414 PolarHBondContact O-N 3.48Å; E410-A414 VanDerWaalsContact O-CB 3.25Å; E410-A414 WeakPolarHBondContact O-CB 3.12Å; V412-A414 PolarHBondContact O-N 3.36Å
415	G	93.4	Very high	89.1	Confident	0 Å²	0	13.6 Å²	13.6	0%	0	9%	0.086	C	C	.	.	T	Hydrogen-bonded Turn	trans	87.1	36.5	172.4	0	0	0	0	0	115	R379 W411 V412 A413	R379-G415 PolarHBondContact NE-O 3.35Å; R379-G415 PolarHBondContact NH2-O 2.79Å; W411-G415 PolarHBondContact O-N 2.91Å; V412-G415 PolarHBondContact O-N 3Å; V412-G415 VanDerWaalsContact O-N 3.16Å; A413-G415 PolarHBondContact O-N 3.38Å; A413-G415 VanDerWaalsContact O-N 3.14Å
416	H	94.6	Very high	87.5	Confident	6 Å²	6	16.8 Å²	16.8	3%	0.028	12%	0.121	C	C	.	.			trans	-56.7	129.7	168.2	-179.9	69.6	0	0	0	110	R379 D380 W411 F418	R379-H416 PolarHBondContact O-ND1 3.35Å; D380-H416 IonicContact OD1-CE1 2.73Å; D380-H416 PolarHBondContact OD1-CE1 3.46Å; D380-H416 IonicContact OD1-ND1 3.73Å; D380-H416 PolarHBondContact OD1-ND1 2.79Å; W411-H416 HydrophobicContact CB-CB 4.39Å; W411-H416 HydrophobicContact CE3-CB 4.01Å; W411-H416 AromaticContact CE3-CD2 3.86Å; W411-H416 AromaticContact CE3-CG 3.62Å; W411-H416 AromaticContact CE3-ND1 3.83Å; W411-H416 AromaticContact CZ3-CE1 3.84Å; W411-H416 AromaticContact CZ3-ND1 3.82Å; W411-H416 VanDerWaalsContact O-CB 3.26Å; W411-H416 WeakPolarHBondContact O-CB 3.26Å; W411-H416 PolarHBondContact O-N 3.12Å; H416-F418 HydrophobicContact CB-CD2 4.27Å; H416-F418 HydrophobicContact CB-CE2 3.98Å; H416-F418 HydrophobicContact CB-CZ 4.49Å; H416-F418 AromaticContact CD2-CD1 3.71Å; H416-F418 AromaticContact CD2-CD2 3.79Å; H416-F418 AromaticContact CD2-CE1 3.73Å; H416-F418 AromaticContact CD2-CE2 3.8Å; H416-F418 AromaticContact CD2-CG 3.74Å; H416-F418 AromaticContact CD2-CZ 3.78Å; H416-F418 WeakPolarHBondContact O-CD2 3.31Å; H416-F418 PolarHBondContact O-N 3.2Å
417	P	92.3	Very high	85.8	Confident	5 Å²	5	18.7 Å²	18.7	3%	0.032	14%	0.137	C	C	.	.			trans	-78.8	64.9	-174.2	29.9	-33.8	0	0	0	112.9	L419 T420 R421 N477	P417-L419 PolarHBondContact O-N 2.8Å; P417-T420 PolarHBondContact O-N 3.18Å; P417-R421 HydrophobicContact CG-CG 3.92Å; P417-R421 WeakPolarHBondContact O-CB 3.39Å; P417-R421 VanDerWaalsContact O-CG 3.23Å; P417-R421 WeakPolarHBondContact O-CG 3.5Å; P417-R421 PolarHBondContact O-N 3.33Å; P417-N477 VanDerWaalsContact CA-OD1 3.31Å; P417-N477 WeakPolarHBondContact CA-OD1 2.98Å; P417-N477 HydrophobicContact CB-CB 4.1Å; P417-N477 PolarHBondContact O-OD1 2.64Å
418	F	90.8	Very high	84.2	Confident	1 Å²	1	25 Å²	25	0%	0.004	18%	0.181	C	C	.	.	H	α-helix	trans	-49.7	-51.5	-175.8	-77.4	-80.5	0	0	0	112.6	W411 V412 H416 T420 R421 L422 F434 V466 F474	W411-F418 HydrophobicContact CB-CE2 4.23Å; W411-F418 HydrophobicContact CB-CZ 3.98Å; V412-F418 HydrophobicContact CG2-CE2 4.26Å; H416-F418 HydrophobicContact CB-CD2 4.27Å; H416-F418 HydrophobicContact CB-CE2 3.98Å; H416-F418 HydrophobicContact CB-CZ 4.49Å; H416-F418 AromaticContact CD2-CD1 3.71Å; H416-F418 AromaticContact CD2-CD2 3.79Å; H416-F418 AromaticContact CD2-CE1 3.73Å; H416-F418 AromaticContact CD2-CE2 3.8Å; H416-F418 AromaticContact CD2-CG 3.74Å; H416-F418 AromaticContact CD2-CZ 3.78Å; H416-F418 WeakPolarHBondContact O-CD2 3.31Å; H416-F418 PolarHBondContact O-N 3.2Å; F418-T420 PolarHBondContact O-N 2.87Å; F418-R421 PolarHBondContact O-N 3.4Å; F418-L422 HydrophobicContact CB-CD1 4.18Å; F418-L422 VanDerWaalsContact O-CB 3.27Å; F418-L422 WeakPolarHBondContact O-CB 2.85Å; F418-L422 VanDerWaalsContact O-CD1 3.25Å; F418-L422 WeakPolarHBondContact O-CD1 3.19Å; F418-L422 WeakPolarHBondContact O-CG 3.21Å; F418-L422 PolarHBondContact O-N 3.15Å; F418-F434 HydrophobicContact CE1-CB 4.16Å; F418-F434 HydrophobicContact CE1-CD1 4.06Å; F418-F434 HydrophobicContact CE1-CD2 4.13Å; F418-F434 HydrophobicContact CE1-CE1 4.47Å; F418-F434 AromaticContact CE1-CG 3.85Å; F418-F434 HydrophobicContact CE1-CG 3.85Å; F418-F434 HydrophobicContact CZ-CD2 4.29Å; F418-F434 HydrophobicContact CZ-CE2 4.45Å; F418-F434 HydrophobicContact CZ-CG 4.47Å; F418-V466 HydrophobicContact CD1-CG1 3.92Å; F418-V466 HydrophobicContact CE1-CG1 4.33Å; F418-V466 HydrophobicContact CE1-CG2 4.37Å; F418-F474 WeakPolarHBondContact CB-O 3.15Å; F418-F474 HydrophobicContact CD1-CB 4.3Å; F418-F474 AromaticContact CD1-CD1 3.87Å; F418-F474 HydrophobicContact CD1-CD1 3.87Å; F418-F474 HydrophobicContact CD1-CG 4.38Å; F418-F474 AromaticContact CD2-CD1 3.93Å; F418-F474 HydrophobicContact CD2-CD1 3.93Å; F418-F474 AromaticContact CE1-CD1 3.53Å; F418-F474 HydrophobicContact CE1-CD1 3.53Å; F418-F474 AromaticContact CE1-CE1 3.88Å; F418-F474 HydrophobicContact CE1-CE1 3.88Å; F418-F474 HydrophobicContact CE1-CG 4.33Å; F418-F474 AromaticContact CE2-CD1 3.59Å; F418-F474 HydrophobicContact CE2-CD1 3.59Å; F418-F474 AromaticContact CE2-CE1 3.99Å; F418-F474 HydrophobicContact CE2-CE1 3.99Å; F418-F474 HydrophobicContact CG-CB 4.27Å; F418-F474 HydrophobicContact CG-CD1 4.07Å; F418-F474 AromaticContact CZ-CD1 3.38Å; F418-F474 HydrophobicContact CZ-CD1 3.38Å; F418-F474 AromaticContact CZ-CE1 3.5Å; F418-F474 HydrophobicContact CZ-CE1 3.5Å
419	L	85.4	Confident	83.6	Confident	29 Å²	29	29.7 Å²	29.7	15%	0.152	20%	0.203	C	C	.	.	H	α-helix	trans	-60.2	-43.2	-176.7	-173.1	64	0	0	0	113.1	P170 P417 G423 G424 T425 L475 N477	P170-L419 HydrophobicContact CB-CD1 4.13Å; P170-L419 HydrophobicContact CG-CD1 4.07Å; P417-L419 PolarHBondContact O-N 2.8Å; L419-G423 PolarHBondContact O-N 3.22Å; L419-G424 WeakPolarHBondContact O-CA 3.35Å; L419-G424 PolarHBondContact O-N 3.28Å; L419-T425 HydrophobicContact CD2-CG2 4.06Å; L419-T425 HydrophobicContact CG-CG2 4.01Å; L419-L475 WeakPolarHBondContact CB-O 3.4Å; L419-L475 HydrophobicContact CD1-CD1 4.4Å; L419-N477 WeakPolarHBondContact CB-OD1 2.9Å; L419-N477 PolarHBondContact N-OD1 2.65Å; L419-N477 VanDerWaalsContact N-OD1 3.11Å
420	T	88.6	Confident	83.3	Confident	17 Å²	17	31.5 Å²	31.5	10%	0.104	21%	0.212	C	C	.	.	H	α-helix	trans	-67.1	-46.2	176.2	-65.8	0	0	0	0	110.7	P417 F418 L422 G423 E429 N477	P417-T420 PolarHBondContact O-N 3.18Å; F418-T420 PolarHBondContact O-N 2.87Å; T420-L422 VanDerWaalsContact C-N 3.26Å; T420-L422 PolarHBondContact O-N 2.85Å; T420-G423 PolarHBondContact O-N 2.86Å; T420-E429 HydrophobicContact CG2-CB 3.94Å; T420-N477 PolarHBondContact N-OD1 3.18Å; T420-N477 PolarHBondContact OG1-ND2 3.02Å; T420-N477 PolarHBondContact OG1-OD1 3.13Å
421	R	90.9	Very high	83.2	Confident	16 Å²	16	31 Å²	31	6%	0.06	21%	0.209	C	C	.	.	H	α-helix	trans	-67.4	-26.7	-176.8	-68.4	-66.4	175.2	-95.1	-4.7	113.2	D380 P417 F418 G423 E429 E430 A431	D380-R421 IonicContact OD1-CZ 3.64Å; D380-R421 IonicContact OD1-NE 3.94Å; D380-R421 PolarHBondContact OD1-NE 3.29Å; D380-R421 IonicContact OD1-NH2 3.28Å; D380-R421 IonicContact OD2-CZ 3.03Å; D380-R421 IonicContact OD2-NE 3.22Å; D380-R421 PolarHBondContact OD2-NE 3.43Å; D380-R421 IonicContact OD2-NH2 3.58Å; D380-R421 PolarHBondContact OD2-NH2 3.11Å; P417-R421 HydrophobicContact CG-CG 3.92Å; P417-R421 WeakPolarHBondContact O-CB 3.39Å; P417-R421 VanDerWaalsContact O-CG 3.23Å; P417-R421 WeakPolarHBondContact O-CG 3.5Å; P417-R421 PolarHBondContact O-N 3.33Å; F418-R421 PolarHBondContact O-N 3.4Å; R421-G423 VanDerWaalsContact C-N 3.32Å; R421-E429 WeakPolarHBondContact CD-O 3.09Å; R421-E429 IonicContact CZ-OE2 2.62Å; R421-E429 PolarHBondContact NH1-O 3.06Å; R421-E429 IonicContact NH1-OE2 3.63Å; R421-E429 PolarHBondContact NH1-OE2 2.9Å; R421-E429 IonicContact NH2-OE2 3.64Å; R421-E430 WeakPolarHBondContact O-CG 3.44Å; R421-A431 WeakPolarHBondContact CB-O 3.31Å; R421-A431 CarbonylContact O-C 3.58Å; R421-A431 PolarHBondContact O-N 3.09Å
422	L	83.5	Confident	83.1	Confident	30 Å²	30	31.2 Å²	31.2	16%	0.157	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.1	-1.1	174.7	-62.4	164	0	0	0	113.4	R136 F418 T420 V466	R136-L422 PolarHBondContact NH1-O 2.81Å; F418-L422 HydrophobicContact CB-CD1 4.18Å; F418-L422 VanDerWaalsContact O-CB 3.27Å; F418-L422 WeakPolarHBondContact O-CB 2.85Å; F418-L422 VanDerWaalsContact O-CD1 3.25Å; F418-L422 WeakPolarHBondContact O-CD1 3.19Å; F418-L422 WeakPolarHBondContact O-CG 3.21Å; F418-L422 PolarHBondContact O-N 3.15Å; T420-L422 VanDerWaalsContact C-N 3.26Å; T420-L422 PolarHBondContact O-N 2.85Å; L422-V466 HydrophobicContact CD1-CG1 3.46Å; L422-V466 VanDerWaalsContact CD1-CG1 3.46Å; L422-V466 WeakPolarHBondContact CD1-O 3.25Å; L422-V466 HydrophobicContact CD2-CG1 3.55Å; L422-V466 HydrophobicContact CG-CG1 4.04Å
423	G	76.8	Confident	83.2	Confident	12 Å²	12	31 Å²	31	12%	0.124	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	75.9	24	178.8	0	0	0	0	0	113.9	L419 T420 R421 T425	L419-G423 PolarHBondContact O-N 3.22Å; T420-G423 PolarHBondContact O-N 2.86Å; R421-G423 VanDerWaalsContact C-N 3.32Å; G423-T425 VanDerWaalsContact C-N 3.34Å
424	G	65.5	Low	83.3	Confident	36 Å²	36	31.3 Å²	31.3	37%	0.371	21%	0.21	S	C	.	.	S	Bend	trans	-77.5	-16.2	179	0	0	0	0	0	114.4	L419	L419-G424 WeakPolarHBondContact O-CA 3.35Å; L419-G424 PolarHBondContact O-N 3.28Å
425	T	59.1	Low	83.5	Confident	70 Å²	70	31.2 Å²	31.2	43%	0.429	21%	0.209	S	C	.	.	S	Bend	trans	-100.3	-5.6	179	60.3	0	0	0	0	113.7	L419 G423 A427	L419-T425 HydrophobicContact CD2-CG2 4.06Å; L419-T425 HydrophobicContact CG-CG2 4.01Å; G423-T425 VanDerWaalsContact C-N 3.34Å; T425-A427 PolarHBondContact O-N 3.4Å; T425-A427 WeakPolarHBondContact OG1-CB 3.47Å; T425-A427 PolarHBondContact OG1-N 2.97Å
426	G	60.2	Low	83.7	Confident	75 Å²	75	31.2 Å²	31.2	77%	0.773	21%	0.209	S	C	*	.			trans	67.5	11.2	-172.4	0	0	0	0	0	114.5
427	A	60.1	Low	83.9	Confident	42 Å²	42	31 Å²	31	35%	0.347	21%	0.208	S	C	.	.			trans	-78.8	154.9	-179	0	0	0	0	0	112.8	T425 E429	T425-A427 PolarHBondContact O-N 3.4Å; T425-A427 WeakPolarHBondContact OG1-CB 3.47Å; T425-A427 PolarHBondContact OG1-N 2.97Å; A427-E429 PolarHBondContact O-N 3Å
428	S	64.8	Low	84.1	Confident	133 Å²	133	30.7 Å²	30.7	93%	0.93	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.4	11.2	179.6	-171.1	0	0	0	0	115
429	E	81	Confident	84.5	Confident	106 Å²	106	30.7 Å²	30.7	50%	0.495	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-114.9	23.3	-176.5	-50.3	-172.7	172.1	0	0	113.5	T420 R421 A427 A431	T420-E429 HydrophobicContact CG2-CB 3.94Å; R421-E429 WeakPolarHBondContact CD-O 3.09Å; R421-E429 IonicContact CZ-OE2 2.62Å; R421-E429 PolarHBondContact NH1-O 3.06Å; R421-E429 IonicContact NH1-OE2 3.63Å; R421-E429 PolarHBondContact NH1-OE2 2.9Å; R421-E429 IonicContact NH2-OE2 3.64Å; A427-E429 PolarHBondContact O-N 3Å; E429-A431 PolarHBondContact O-N 3.45Å
430	E	89.8	Confident	85.1	Confident	53 Å²	53	29.3 Å²	29.3	25%	0.248	20%	0.199	C	C	.	.			trans	-60.5	129.2	169.7	-171	-177.7	156	0	0	109.1	Q316 R421	Q316-E430 WeakPolarHBondContact CB-O 3.18Å; Q316-E430 VanDerWaalsContact CG-O 3.24Å; Q316-E430 WeakPolarHBondContact CG-O 3.4Å; Q316-E430 PolarHBondContact NE2-OE1 3.15Å; Q316-E430 VanDerWaalsContact NE2-OE1 3.09Å; R421-E430 WeakPolarHBondContact O-CG 3.44Å
431	A	92.8	Very high	85.6	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	19%	0.194	C	C	.	.			trans	-165	121.1	176.5	0	0	0	0	0	109.2	L312 Q316 R421 E429 V433	L312-A431 HydrophobicContact CB-CB 3.99Å; L312-A431 HydrophobicContact CD2-CB 4.07Å; L312-A431 WeakPolarHBondContact O-CB 3.08Å; Q316-A431 HydrophobicContact CB-CB 4.46Å; R421-A431 WeakPolarHBondContact CB-O 3.31Å; R421-A431 CarbonylContact O-C 3.58Å; R421-A431 PolarHBondContact O-N 3.09Å; E429-A431 PolarHBondContact O-N 3.45Å; A431-V433 HydrophobicContact CB-CG2 4.09Å; A431-V433 PolarHBondContact O-N 2.87Å
432	P	93.6	Very high	85.9	Confident	8 Å²	8	28.3 Å²	28.3	5%	0.052	19%	0.193	C	C	.	.			trans	-82	56.9	-174.4	37.1	-42.2	0	0	0	111.9	V315 H319 W346 F434 L435 L436	V315-P432 HydrophobicContact CG1-CG 4.3Å; H319-P432 HydrophobicContact CB-CG 3.56Å; H319-P432 VanDerWaalsContact CG-CG 3.49Å; W346-P432 HydrophobicContact CH2-CG 4.12Å; W346-P432 HydrophobicContact CZ3-CG 4.23Å; P432-F434 VanDerWaalsContact C-N 3.26Å; P432-F434 PolarHBondContact O-N 3.02Å; P432-L435 HydrophobicContact CB-CB 4.06Å; P432-L435 HydrophobicContact CB-CD2 4.37Å; P432-L435 WeakPolarHBondContact O-CB 3.22Å; P432-L435 PolarHBondContact O-N 2.9Å; P432-L436 PolarHBondContact O-N 3.35Å
433	V	96.1	Very high	86.6	Confident	0 Å²	0	27 Å²	27	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-59.8	-36.9	-178.2	-177.3	0	0	0	0	111.5	L312 D380 L381 L384 W411 A431 L436 F437	L312-V433 HydrophobicContact CD2-CG2 3.59Å; D380-V433 HydrophobicContact CB-CG1 4.22Å; D380-V433 HydrophobicContact CB-CG2 4.28Å; L381-V433 HydrophobicContact CD2-CG1 4.33Å; L384-V433 HydrophobicContact CD1-CG1 4.25Å; W411-V433 HydrophobicContact CH2-CG1 4.12Å; W411-V433 HydrophobicContact CZ3-CG1 4.26Å; A431-V433 HydrophobicContact CB-CG2 4.09Å; A431-V433 PolarHBondContact O-N 2.87Å; V433-L436 WeakPolarHBondContact O-CB 3.26Å; V433-L436 PolarHBondContact O-N 2.98Å; V433-F437 PolarHBondContact O-N 3.18Å
434	F	96.9	Very high	87.5	Confident	11 Å²	11	26.4 Å²	26.4	5%	0.048	18%	0.18	C	C	.	.	H	α-helix	trans	-65.7	-37.1	175.7	-169.3	-112.7	0	0	0	112.6	V407 W411 F418 P432 F437 L438 L462 V466	V407-F434 HydrophobicContact CG1-CE2 3.98Å; V407-F434 HydrophobicContact CG1-CZ 3.87Å; V407-F434 HydrophobicContact CG2-CE2 4.49Å; W411-F434 AromaticContact CD2-CD2 3.55Å; W411-F434 HydrophobicContact CD2-CD2 3.55Å; W411-F434 AromaticContact CD2-CE2 3.85Å; W411-F434 HydrophobicContact CD2-CE2 3.85Å; W411-F434 AromaticContact CE2-CD2 3.87Å; W411-F434 HydrophobicContact CE3-CB 4.38Å; W411-F434 AromaticContact CE3-CD2 3.49Å; W411-F434 HydrophobicContact CE3-CD2 3.49Å; W411-F434 VanDerWaalsContact CE3-CD2 3.49Å; W411-F434 HydrophobicContact CE3-CE2 4.24Å; W411-F434 HydrophobicContact CE3-CG 4.38Å; W411-F434 HydrophobicContact CG-CD2 4.14Å; W411-F434 AromaticContact CG-CE2 3.98Å; W411-F434 HydrophobicContact CG-CE2 3.98Å; W411-F434 HydrophobicContact CH2-CD2 4.03Å; W411-F434 HydrophobicContact CZ2-CD2 4.11Å; W411-F434 HydrophobicContact CZ3-CB 4.02Å; W411-F434 AromaticContact CZ3-CD2 3.74Å; W411-F434 HydrophobicContact CZ3-CD2 3.74Å; W411-F434 HydrophobicContact CZ3-CG 4.4Å; F418-F434 HydrophobicContact CE1-CB 4.16Å; F418-F434 HydrophobicContact CE1-CD1 4.06Å; F418-F434 HydrophobicContact CE1-CD2 4.13Å; F418-F434 HydrophobicContact CE1-CE1 4.47Å; F418-F434 AromaticContact CE1-CG 3.85Å; F418-F434 HydrophobicContact CE1-CG 3.85Å; F418-F434 HydrophobicContact CZ-CD2 4.29Å; F418-F434 HydrophobicContact CZ-CE2 4.45Å; F418-F434 HydrophobicContact CZ-CG 4.47Å; P432-F434 VanDerWaalsContact C-N 3.26Å; P432-F434 PolarHBondContact O-N 3.02Å; F434-F437 HydrophobicContact CD2-CD1 4.03Å; F434-F437 AromaticContact CE2-CD1 3.91Å; F434-F437 HydrophobicContact CE2-CD1 3.91Å; F434-F437 HydrophobicContact CE2-CE1 4.18Å; F434-F437 WeakPolarHBondContact O-CB 3.35Å; F434-F437 PolarHBondContact O-N 2.86Å; F434-L438 HydrophobicContact CD1-CD1 4.06Å; F434-L438 HydrophobicContact CD1-CG 4.34Å; F434-L438 HydrophobicContact CE1-CD1 3.83Å; F434-L438 HydrophobicContact CE1-CD2 4.3Å; F434-L438 HydrophobicContact CE1-CG 4.16Å; F434-L438 HydrophobicContact CZ-CD2 4.23Å; F434-L438 HydrophobicContact CZ-CG 4.49Å; F434-L438 WeakPolarHBondContact O-CG 3.36Å; F434-L438 PolarHBondContact O-N 2.75Å; F434-L462 HydrophobicContact CE1-CD2 4.33Å; F434-L462 HydrophobicContact CE1-CG 4.03Å; F434-L462 HydrophobicContact CZ-CD2 3.92Å; F434-L462 HydrophobicContact CZ-CG 4.06Å; F434-V466 HydrophobicContact CD1-CG2 3.71Å; F434-V466 HydrophobicContact CE1-CG2 3.57Å
435	L	96.6	Very high	88.9	Confident	6 Å²	6	25.2 Å²	25.2	3%	0.031	17%	0.165	C	C	.	.	H	α-helix	trans	-67.6	-38.7	173	172	60.8	0	0	0	111.4	F138 W346 P432 F437 L438 D439 Y639	F138-L435 HydrophobicContact CE2-CD2 4.11Å; W346-L435 HydrophobicContact CH2-CG 4.4Å; W346-L435 HydrophobicContact CZ2-CD2 4.39Å; W346-L435 HydrophobicContact CZ2-CG 4.08Å; P432-L435 HydrophobicContact CB-CB 4.06Å; P432-L435 HydrophobicContact CB-CD2 4.37Å; P432-L435 WeakPolarHBondContact O-CB 3.22Å; P432-L435 PolarHBondContact O-N 2.9Å; L435-F437 VanDerWaalsContact C-N 3.27Å; L435-F437 PolarHBondContact O-N 3.4Å; L435-L438 PolarHBondContact O-N 2.74Å; L435-D439 PolarHBondContact O-N 2.88Å; L435-Y639 HydrophobicContact CD1-CE1 4.28Å; L435-Y639 HydrophobicContact CD2-CE1 4.22Å
436	L	97.7	Very high	90.5	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-58.6	-42.2	173.4	-179.8	64.7	0	0	0	111	V315 W346 I350 L384 P432 V433 D439 C440	V315-L436 HydrophobicContact CG1-CD2 4.37Å; V315-L436 HydrophobicContact CG2-CD2 4.15Å; W346-L436 HydrophobicContact CH2-CB 3.84Å; W346-L436 HydrophobicContact CH2-CD1 4.18Å; W346-L436 HydrophobicContact CZ2-CB 4.15Å; W346-L436 HydrophobicContact CZ2-CD1 4.09Å; I350-L436 HydrophobicContact CG1-CD1 3.66Å; L384-L436 HydrophobicContact CD1-CB 4.34Å; L384-L436 HydrophobicContact CD1-CD2 4.04Å; L384-L436 HydrophobicContact CD1-CG 4.03Å; P432-L436 PolarHBondContact O-N 3.35Å; V433-L436 WeakPolarHBondContact O-CB 3.26Å; V433-L436 PolarHBondContact O-N 2.98Å; L436-D439 PolarHBondContact O-N 3.11Å; L436-C440 PolarHBondContact O-N 2.87Å; L436-C440 PolarHBondContact O-SG 3.4Å
437	F	98.5	Very high	92	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-60.9	-50.4	172.3	163.9	-109.8	0	0	0	112.1	L384 L388 L391 F403 V407 W411 V433 F434 L435 D439 C440 V441	L384-F437 HydrophobicContact CD1-CB 3.97Å; L384-F437 HydrophobicContact CG-CB 3.97Å; L384-F437 HydrophobicContact CG-CD2 4.39Å; L388-F437 HydrophobicContact CD2-CD2 4.14Å; L388-F437 HydrophobicContact CD2-CE2 4.11Å; L388-F437 HydrophobicContact CG-CD2 4.28Å; L388-F437 HydrophobicContact CG-CE2 4.43Å; L391-F437 HydrophobicContact CD1-CE2 4.13Å; L391-F437 HydrophobicContact CD1-CZ 4.26Å; F403-F437 HydrophobicContact CE2-CE1 4.35Å; F403-F437 AromaticContact CE2-CZ 3.92Å; F403-F437 HydrophobicContact CE2-CZ 3.92Å; F403-F437 AromaticContact CZ-CE1 3.81Å; F403-F437 HydrophobicContact CZ-CE1 3.81Å; F403-F437 AromaticContact CZ-CZ 3.85Å; F403-F437 HydrophobicContact CZ-CZ 3.85Å; V407-F437 HydrophobicContact CG2-CE1 4.21Å; W411-F437 AromaticContact CE2-CD1 3.92Å; W411-F437 HydrophobicContact CH2-CB 3.68Å; W411-F437 HydrophobicContact CH2-CD1 4.45Å; W411-F437 HydrophobicContact CH2-CG 4.13Å; W411-F437 HydrophobicContact CZ2-CB 3.45Å; W411-F437 VanDerWaalsContact CZ2-CB 3.45Å; W411-F437 AromaticContact CZ2-CD1 3.64Å; W411-F437 HydrophobicContact CZ2-CD1 3.64Å; W411-F437 AromaticContact CZ2-CD2 3.93Å; W411-F437 HydrophobicContact CZ2-CD2 3.93Å; W411-F437 HydrophobicContact CZ2-CE1 4.37Å; W411-F437 AromaticContact CZ2-CG 3.38Å; W411-F437 HydrophobicContact CZ2-CG 3.38Å; W411-F437 AromaticContact NE1-CE1 3.93Å; V433-F437 PolarHBondContact O-N 3.18Å; F434-F437 HydrophobicContact CD2-CD1 4.03Å; F434-F437 AromaticContact CE2-CD1 3.91Å; F434-F437 HydrophobicContact CE2-CD1 3.91Å; F434-F437 HydrophobicContact CE2-CE1 4.18Å; F434-F437 WeakPolarHBondContact O-CB 3.35Å; F434-F437 PolarHBondContact O-N 2.86Å; L435-F437 VanDerWaalsContact C-N 3.27Å; L435-F437 PolarHBondContact O-N 3.4Å; F437-D439 VanDerWaalsContact C-N 3.27Å; F437-D439 PolarHBondContact O-N 3.38Å; F437-C440 WeakPolarHBondContact O-CB 3.35Å; F437-C440 PolarHBondContact O-N 3.45Å; F437-C440 VanDerWaalsContact O-N 3.1Å; F437-V441 HydrophobicContact CD2-CG2 4.02Å; F437-V441 HydrophobicContact CE1-CG2 4.2Å; F437-V441 HydrophobicContact CE2-CG2 3.51Å; F437-V441 HydrophobicContact CZ-CG2 3.63Å; F437-V441 WeakPolarHBondContact O-CG2 3.07Å; F437-V441 PolarHBondContact O-N 3.15Å
438	L	98.4	Very high	93.5	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-60.2	-37	179.8	-66.1	-179.9	0	0	0	112.5	F403 F434 L435 V441 W442 L459 L462 H463 W635	F403-L438 HydrophobicContact CZ-CD2 4.26Å; F434-L438 HydrophobicContact CD1-CD1 4.06Å; F434-L438 HydrophobicContact CD1-CG 4.34Å; F434-L438 HydrophobicContact CE1-CD1 3.83Å; F434-L438 HydrophobicContact CE1-CD2 4.3Å; F434-L438 HydrophobicContact CE1-CG 4.16Å; F434-L438 HydrophobicContact CZ-CD2 4.23Å; F434-L438 HydrophobicContact CZ-CG 4.49Å; F434-L438 WeakPolarHBondContact O-CG 3.36Å; F434-L438 PolarHBondContact O-N 2.75Å; L435-L438 PolarHBondContact O-N 2.74Å; L438-V441 PolarHBondContact O-N 3.48Å; L438-W442 PolarHBondContact O-N 2.68Å; L438-L459 HydrophobicContact CD2-CD2 4.25Å; L438-L462 HydrophobicContact CD2-CD2 3.83Å; L438-L462 HydrophobicContact CD2-CG 4.48Å; L438-H463 HydrophobicContact CD1-CB 3.84Å; L438-W635 HydrophobicContact CB-CH2 4.27Å; L438-W635 HydrophobicContact CB-CZ3 4.07Å
439	D	98.2	Very high	94.8	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-66.1	-44.2	174.4	-163.1	-20.8	0	0	0	110.8	W346 I350 L435 L436 F437 V441 W442 Q443 W635 Y639	W346-D439 PolarHBondContact NE1-OD2 3.33Å; I350-D439 HydrophobicContact CD1-CB 3.99Å; I350-D439 WeakPolarHBondContact CD1-OD2 3.37Å; I350-D439 HydrophobicContact CG1-CB 4.43Å; L435-D439 PolarHBondContact O-N 2.88Å; L436-D439 PolarHBondContact O-N 3.11Å; F437-D439 VanDerWaalsContact C-N 3.27Å; F437-D439 PolarHBondContact O-N 3.38Å; D439-V441 VanDerWaalsContact C-N 3.27Å; D439-V441 PolarHBondContact O-N 2.9Å; D439-W442 CarbonylContact O-C 3.47Å; D439-W442 WeakPolarHBondContact O-CA 3.37Å; D439-W442 WeakPolarHBondContact O-CB 3.33Å; D439-W442 PolarHBondContact O-N 2.67Å; D439-Q443 WeakPolarHBondContact O-CG 3.33Å; D439-Q443 PolarHBondContact O-N 3.24Å; D439-Q443 PolarHBondContact OD1-NE2 3.46Å; D439-W635 HydrophobicContact CB-CE3 4.03Å; D439-W635 HydrophobicContact CB-CZ3 4.34Å; D439-Y639 VanDerWaalsContact OD2-CE2 3.24Å; D439-Y639 WeakPolarHBondContact OD2-CE2 3.35Å; D439-Y639 PolarHBondContact OD2-OH 2.77Å
440	C	98.4	Very high	95.2	Very high	0 Å²	0	16.9 Å²	16.9	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-54.9	-43.5	172.4	-64.7	0	0	0	0	111.9	L354 L388 L436 F437 Q443 L444	L354-C440 HydrophobicContact CD2-CB 3.96Å; L354-C440 HydrophobicContact CG-CB 4.31Å; L388-C440 HydrophobicContact CD1-CB 3.88Å; L388-C440 HydrophobicContact CD2-CB 3.79Å; L388-C440 HydrophobicContact CG-CB 4.45Å; L436-C440 PolarHBondContact O-N 2.87Å; L436-C440 PolarHBondContact O-SG 3.4Å; F437-C440 WeakPolarHBondContact O-CB 3.35Å; F437-C440 PolarHBondContact O-N 3.45Å; F437-C440 VanDerWaalsContact O-N 3.1Å; C440-Q443 WeakPolarHBondContact O-CB 3.44Å; C440-Q443 PolarHBondContact O-N 3.16Å; C440-L444 WeakPolarHBondContact O-CG 3.17Å; C440-L444 PolarHBondContact O-N 3.34Å; C440-L444 VanDerWaalsContact O-N 3.14Å
441	V	98.6	Very high	95.3	Very high	0 Å²	0	15.4 Å²	15.4	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-64.7	-40.6	176	179.6	0	0	0	0	111.3	L388 L391 F403 F437 L438 D439 Q443 L444 L445 F454 L459	L388-V441 HydrophobicContact CD2-CG2 4.19Å; L391-V441 HydrophobicContact CD1-CG1 4.46Å; L391-V441 HydrophobicContact CD1-CG2 3.67Å; F403-V441 HydrophobicContact CE2-CB 4.42Å; F403-V441 HydrophobicContact CE2-CG1 3.74Å; F403-V441 HydrophobicContact CE2-CG2 3.9Å; F403-V441 HydrophobicContact CZ-CG1 4.18Å; F403-V441 HydrophobicContact CZ-CG2 4.19Å; F437-V441 HydrophobicContact CD2-CG2 4.02Å; F437-V441 HydrophobicContact CE1-CG2 4.2Å; F437-V441 HydrophobicContact CE2-CG2 3.51Å; F437-V441 HydrophobicContact CZ-CG2 3.63Å; F437-V441 WeakPolarHBondContact O-CG2 3.07Å; F437-V441 PolarHBondContact O-N 3.15Å; L438-V441 PolarHBondContact O-N 3.48Å; D439-V441 VanDerWaalsContact C-N 3.27Å; D439-V441 PolarHBondContact O-N 2.9Å; V441-Q443 VanDerWaalsContact C-N 3.32Å; V441-Q443 PolarHBondContact O-N 3.28Å; V441-L444 WeakPolarHBondContact O-CB 3.44Å; V441-L444 PolarHBondContact O-N 2.93Å; V441-L444 VanDerWaalsContact O-N 3.15Å; V441-L445 PolarHBondContact O-N 2.84Å; V441-F454 HydrophobicContact CG1-CE2 3.83Å; V441-F454 HydrophobicContact CG1-CZ 3.79Å; V441-L459 HydrophobicContact CB-CD1 4.47Å; V441-L459 HydrophobicContact CG1-CD1 4.1Å; V441-L459 HydrophobicContact CG1-CD2 3.94Å
442	W	97.7	Very high	95.4	Very high	13 Å²	13	15.4 Å²	15.4	5%	0.049	8%	0.083	C	C	.	.	H	α-helix	trans	-61.2	-40.2	174.7	-179.7	84.7	0	0	0	111.6	L438 D439 L444 L445 Q446 E456 L459 R633 F634 W635	L438-W442 PolarHBondContact O-N 2.68Å; D439-W442 CarbonylContact O-C 3.47Å; D439-W442 WeakPolarHBondContact O-CA 3.37Å; D439-W442 WeakPolarHBondContact O-CB 3.33Å; D439-W442 PolarHBondContact O-N 2.67Å; W442-L444 VanDerWaalsContact C-N 3.32Å; W442-L444 PolarHBondContact O-N 2.92Å; W442-L445 WeakPolarHBondContact O-CB 3.31Å; W442-L445 PolarHBondContact O-N 2.92Å; W442-Q446 HydrophobicContact CD2-CG 3.95Å; W442-Q446 HydrophobicContact CE3-CG 4.17Å; W442-Q446 HydrophobicContact CH2-CG 3.92Å; W442-Q446 HydrophobicContact CZ2-CG 3.68Å; W442-Q446 HydrophobicContact CZ3-CG 4.15Å; W442-Q446 VanDerWaalsContact O-CG 3.29Å; W442-Q446 WeakPolarHBondContact O-CG 3.41Å; W442-Q446 PolarHBondContact O-N 3.24Å; W442-E456 PolarHBondContact NE1-OE2 3.43Å; W442-L459 HydrophobicContact CB-CD1 3.93Å; W442-R633 HydrophobicContact CH2-CB 3.65Å; W442-R633 HydrophobicContact CZ3-CB 3.69Å; W442-F634 WeakPolarHBondContact CH2-O 3.08Å; W442-W635 HydrophobicContact CB-CD2 4.01Å; W442-W635 HydrophobicContact CB-CE3 4.02Å; W442-W635 HydrophobicContact CB-CH2 4.31Å; W442-W635 HydrophobicContact CB-CZ2 4.29Å; W442-W635 HydrophobicContact CB-CZ3 4.17Å; W442-W635 AromaticContact CD1-CD1 3.73Å; W442-W635 AromaticContact CD1-CD2 3.97Å; W442-W635 AromaticContact CD1-CE2 3.51Å; W442-W635 AromaticContact CD1-CZ2 3.98Å; W442-W635 AromaticContact CD1-NE1 3.34Å; W442-W635 VanDerWaalsContact CD1-NE1 3.34Å; W442-W635 HydrophobicContact CD2-CB 3.91Å; W442-W635 AromaticContact CD2-CD1 3.72Å; W442-W635 AromaticContact CD2-CD2 3.97Å; W442-W635 HydrophobicContact CD2-CD2 3.97Å; W442-W635 AromaticContact CD2-CG 3.62Å; W442-W635 HydrophobicContact CD2-CG 3.62Å; W442-W635 AromaticContact CE2-CD1 3.37Å; W442-W635 AromaticContact CE2-CG 3.76Å; W442-W635 AromaticContact CE2-NE1 3.82Å; W442-W635 HydrophobicContact CE3-CB 3.75Å; W442-W635 AromaticContact CE3-CG 4Å; W442-W635 HydrophobicContact CE3-CG 4Å; W442-W635 AromaticContact CG-CD1 3.95Å; W442-W635 AromaticContact CG-CD2 3.71Å; W442-W635 HydrophobicContact CG-CD2 3.71Å; W442-W635 AromaticContact CG-CE2 3.71Å; W442-W635 HydrophobicContact CG-CE3 4.22Å; W442-W635 AromaticContact CG-CG 3.89Å; W442-W635 HydrophobicContact CG-CG 3.89Å; W442-W635 HydrophobicContact CG-CZ2 4.23Å; W442-W635 AromaticContact CG-NE1 3.85Å; W442-W635 HydrophobicContact CH2-CB 4.17Å; W442-W635 HydrophobicContact CZ2-CB 4.31Å; W442-W635 AromaticContact CZ2-CD1 3.84Å; W442-W635 HydrophobicContact CZ2-CG 4.26Å; W442-W635 HydrophobicContact CZ3-CB 3.89Å; W442-W635 HydrophobicContact CZ3-CG 4.47Å; W442-W635 AromaticContact NE1-CD1 3.35Å; W442-W635 AromaticContact NE1-CE2 3.95Å; W442-W635 AromaticContact NE1-NE1 3.3Å
443	Q	97.3	Very high	95.5	Very high	1 Å²	1	17.2 Å²	17.2	1%	0.005	9%	0.091	C	C	.	.	H	α-helix	trans	-59.3	-42.7	172.9	-57.1	-58	-37	0	0	111.9	I350 L354 D439 C440 V441 Q446 Q447 I632 R633	I350-Q443 HydrophobicContact CG2-CG 3.68Å; L354-Q443 HydrophobicContact CD1-CB 3.84Å; L354-Q443 HydrophobicContact CD1-CG 4.06Å; D439-Q443 WeakPolarHBondContact O-CG 3.33Å; D439-Q443 PolarHBondContact O-N 3.24Å; D439-Q443 PolarHBondContact OD1-NE2 3.46Å; C440-Q443 WeakPolarHBondContact O-CB 3.44Å; C440-Q443 PolarHBondContact O-N 3.16Å; V441-Q443 VanDerWaalsContact C-N 3.32Å; V441-Q443 PolarHBondContact O-N 3.28Å; Q443-Q446 PolarHBondContact O-N 2.82Å; Q443-Q447 WeakPolarHBondContact O-CG 3.45Å; Q443-Q447 PolarHBondContact O-N 3.21Å; Q443-Q447 VanDerWaalsContact O-N 3.11Å; Q443-I632 HydrophobicContact CG-CD1 4.27Å; Q443-R633 PolarHBondContact NE2-O 2.99Å; Q443-R633 PolarHBondContact OE1-O 3.5Å
444	L	96.4	Very high	95.4	Very high	0 Å²	0	17.2 Å²	17.2	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-62.7	-45.4	176.7	-62.3	-178.4	0	0	0	111.5	L354 L388 L391 L392 C440 V441 W442 Q446 Q447 F448 F452 P625	L354-L444 HydrophobicContact CD2-CD2 3.82Å; L354-L444 HydrophobicContact CD2-CG 4.07Å; L388-L444 HydrophobicContact CD2-CD1 4.17Å; L391-L444 HydrophobicContact CB-CD1 4.34Å; L392-L444 HydrophobicContact CD2-CD1 3.85Å; L392-L444 HydrophobicContact CD2-CD2 3.65Å; L392-L444 HydrophobicContact CD2-CG 4.41Å; L392-L444 HydrophobicContact CG-CD1 4.47Å; C440-L444 WeakPolarHBondContact O-CG 3.17Å; C440-L444 PolarHBondContact O-N 3.34Å; C440-L444 VanDerWaalsContact O-N 3.14Å; V441-L444 WeakPolarHBondContact O-CB 3.44Å; V441-L444 PolarHBondContact O-N 2.93Å; V441-L444 VanDerWaalsContact O-N 3.15Å; W442-L444 VanDerWaalsContact C-N 3.32Å; W442-L444 PolarHBondContact O-N 2.92Å; L444-Q446 VanDerWaalsContact C-N 3.26Å; L444-Q446 PolarHBondContact O-N 3.43Å; L444-Q447 PolarHBondContact O-N 3.06Å; L444-Q447 VanDerWaalsContact O-N 3.15Å; L444-F448 HydrophobicContact CD2-CE2 4.45Å; L444-F448 WeakPolarHBondContact O-CD2 3.28Å; L444-F448 PolarHBondContact O-N 2.8Å; L444-F452 HydrophobicContact CB-CE2 3.92Å; L444-F452 HydrophobicContact CB-CZ 3.65Å; L444-F452 HydrophobicContact CD1-CZ 4.25Å; L444-P625 HydrophobicContact CD2-CB 3.55Å; L444-P625 HydrophobicContact CD2-CG 3.77Å
445	L	94.9	Very high	95.3	Very high	11 Å²	11	17.1 Å²	17.1	6%	0.058	9%	0.092	C	C	.	.	H	α-helix	trans	-58.2	-37.9	175.8	176.8	64.8	0	0	0	112	V441 W442 P449 F452 F454 E456 L459	V441-L445 PolarHBondContact O-N 2.84Å; W442-L445 WeakPolarHBondContact O-CB 3.31Å; W442-L445 PolarHBondContact O-N 2.92Å; L445-P449 WeakPolarHBondContact O-CA 3.27Å; L445-F452 HydrophobicContact CD1-CB 3.53Å; L445-F452 HydrophobicContact CD1-CG 4.13Å; L445-F454 WeakPolarHBondContact CD1-O 3.42Å; L445-E456 HydrophobicContact CD2-CB 4.24Å; L445-L459 HydrophobicContact CD2-CD1 4.39Å
446	Q	92.3	Very high	95	Very high	56 Å²	56	18.2 Å²	18.2	26%	0.262	10%	0.097	S	C	.	.	H	α-helix	trans	-70.7	-32.2	177.7	-69.2	-60.1	-58.5	0	0	113.5	W442 Q443 L444 R633	W442-Q446 HydrophobicContact CD2-CG 3.95Å; W442-Q446 HydrophobicContact CE3-CG 4.17Å; W442-Q446 HydrophobicContact CH2-CG 3.92Å; W442-Q446 HydrophobicContact CZ2-CG 3.68Å; W442-Q446 HydrophobicContact CZ3-CG 4.15Å; W442-Q446 VanDerWaalsContact O-CG 3.29Å; W442-Q446 WeakPolarHBondContact O-CG 3.41Å; W442-Q446 PolarHBondContact O-N 3.24Å; Q443-Q446 PolarHBondContact O-N 2.82Å; L444-Q446 VanDerWaalsContact C-N 3.26Å; L444-Q446 PolarHBondContact O-N 3.43Å; Q446-R633 VanDerWaalsContact OE1-NH1 3.14Å
447	Q	91.6	Very high	94.6	Very high	52 Å²	52	20.6 Å²	20.6	24%	0.243	11%	0.108	C	C	.	.	H	α-helix	trans	-87.2	-30.3	-178.5	-67.1	-178.4	31.3	0	0	112.4	Q443 L444 P449 G626 Q631	Q443-Q447 WeakPolarHBondContact O-CG 3.45Å; Q443-Q447 PolarHBondContact O-N 3.21Å; Q443-Q447 VanDerWaalsContact O-N 3.11Å; L444-Q447 PolarHBondContact O-N 3.06Å; L444-Q447 VanDerWaalsContact O-N 3.15Å; Q447-P449 VanDerWaalsContact C-CD 3.45Å; Q447-G626 PolarHBondContact NE2-O 3.36Å; Q447-G626 PolarHBondContact OE1-O 3.35Å; Q447-Q631 PolarHBondContact NE2-O 3.41Å
448	F	92.1	Very high	94.4	Very high	43 Å²	43	20.6 Å²	20.6	19%	0.189	11%	0.108	C	C	.	.			trans	-128	60.4	-176.7	-52.6	-72.1	0	0	0	111.4	L444 A450 D451 F452 L623 P625	L444-F448 HydrophobicContact CD2-CE2 4.45Å; L444-F448 WeakPolarHBondContact O-CD2 3.28Å; L444-F448 PolarHBondContact O-N 2.8Å; F448-A450 PolarHBondContact O-N 2.62Å; F448-A450 VanDerWaalsContact O-N 3.15Å; F448-D451 HydrophobicContact CB-CB 4.11Å; F448-D451 PolarHBondContact O-N 2.86Å; F448-D451 VanDerWaalsContact O-N 3.14Å; F448-F452 HydrophobicContact CB-CD2 4.45Å; F448-F452 HydrophobicContact CB-CE2 4.26Å; F448-F452 WeakPolarHBondContact O-CD2 3.35Å; F448-L623 HydrophobicContact CB-CD1 4.08Å; F448-L623 HydrophobicContact CB-CD2 4.47Å; F448-L623 HydrophobicContact CD1-CD2 3.78Å; F448-L623 HydrophobicContact CD2-CB 4.23Å; F448-L623 HydrophobicContact CD2-CD1 3.9Å; F448-L623 HydrophobicContact CD2-CD2 4.44Å; F448-L623 HydrophobicContact CD2-CG 4.41Å; F448-L623 HydrophobicContact CE1-CD2 4.07Å; F448-L623 HydrophobicContact CE2-CB 4.01Å; F448-L623 HydrophobicContact CG-CD1 3.93Å; F448-L623 HydrophobicContact CG-CD2 3.98Å; F448-L623 HydrophobicContact CG-CG 4.38Å; F448-L623 HydrophobicContact CZ-CB 4.18Å; F448-P625 HydrophobicContact CE2-CB 4.15Å
449	P	91.4	Very high	94.3	Very high	72 Å²	72	20.6 Å²	20.6	47%	0.468	11%	0.108	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-22.8	-172.7	26	-35.6	0	0	0	114.1	L445 Q447 N532	L445-P449 WeakPolarHBondContact O-CA 3.27Å; Q447-P449 VanDerWaalsContact C-CD 3.45Å; P449-N532 PolarHBondContact O-ND2 2.96Å
450	A	90.4	Very high	93.9	Very high	28 Å²	28	21.3 Å²	21.3	23%	0.231	11%	0.111	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-20.9	178.3	0	0	0	0	0	113.6	F448 G534 Y535 D536	F448-A450 PolarHBondContact O-N 2.62Å; F448-A450 VanDerWaalsContact O-N 3.15Å; A450-G534 WeakPolarHBondContact CA-O 3.44Å; A450-Y535 VanDerWaalsContact O-CD2 3.29Å; A450-Y535 WeakPolarHBondContact O-CD2 3.07Å; A450-D536 PolarHBondContact O-N 3.02Å
451	D	92.1	Very high	93.5	Very high	22 Å²	22	21.4 Å²	21.4	12%	0.118	11%	0.112	C	C	.	.	S	Bend	trans	-87.8	-11.8	-173.2	-75.3	-88.3	0	0	0	114.4	R398 F448 L623	R398-D451 WeakPolarHBondContact CB-O 3.41Å; R398-D451 WeakPolarHBondContact CD-O 3.47Å; R398-D451 IonicContact NH1-OD1 3.85Å; R398-D451 PolarHBondContact NH1-OD1 3.24Å; F448-D451 HydrophobicContact CB-CB 4.11Å; F448-D451 PolarHBondContact O-N 2.86Å; F448-D451 VanDerWaalsContact O-N 3.14Å; D451-L623 HydrophobicContact CB-CD1 4.14Å
452	F	94.6	Very high	93.2	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	11%	0.112	C	C	.	.			trans	-115.2	122.4	-173.9	-73.9	-95.1	0	0	0	111.5	L391 R398 L444 L445 F448 F454 N532 L623	L391-F452 HydrophobicContact CD2-CE1 4.26Å; R398-F452 HydrophobicContact CB-CD1 3.85Å; R398-F452 HydrophobicContact CB-CE1 4.14Å; R398-F452 HydrophobicContact CB-CG 4.26Å; R398-F452 HydrophobicContact CG-CD1 4.12Å; R398-F452 HydrophobicContact CG-CE1 3.9Å; R398-F452 HydrophobicContact CG-CZ 4.16Å; L444-F452 HydrophobicContact CB-CE2 3.92Å; L444-F452 HydrophobicContact CB-CZ 3.65Å; L444-F452 HydrophobicContact CD1-CZ 4.25Å; L445-F452 HydrophobicContact CD1-CB 3.53Å; L445-F452 HydrophobicContact CD1-CG 4.13Å; F448-F452 HydrophobicContact CB-CD2 4.45Å; F448-F452 HydrophobicContact CB-CE2 4.26Å; F448-F452 WeakPolarHBondContact O-CD2 3.35Å; F452-F454 VanDerWaalsContact C-N 3.28Å; F452-F454 AromaticContact CD1-CE1 3.78Å; F452-F454 HydrophobicContact CD1-CE1 3.78Å; F452-F454 AromaticContact CD1-CE2 3.95Å; F452-F454 HydrophobicContact CD1-CE2 3.95Å; F452-F454 AromaticContact CD1-CZ 3.39Å; F452-F454 HydrophobicContact CD1-CZ 3.39Å; F452-F454 HydrophobicContact CE1-CE1 4.44Å; F452-F454 AromaticContact CE1-CZ 3.88Å; F452-F454 HydrophobicContact CE1-CZ 3.88Å; F452-F454 HydrophobicContact CG-CZ 4.49Å; F452-F454 PolarHBondContact O-N 2.85Å; F452-N532 WeakPolarHBondContact O-CB 3.44Å; F452-N532 PolarHBondContact O-ND2 3.48Å; F452-L623 HydrophobicContact CE2-CD1 4.05Å
453	E	94.8	Very high	92.9	Very high	47 Å²	47	21 Å²	21	22%	0.22	11%	0.111	C	C	.	.	S	Bend	trans	-70.2	-27.5	179.7	-170.2	-170.3	176.5	0	0	112	R398 T399 L400 Q531 N532 Y535	R398-E453 PolarHBondContact O-N 2.88Å; T399-E453 WeakPolarHBondContact CA-OE2 3.47Å; T399-E453 WeakPolarHBondContact CB-OE2 3.45Å; L400-E453 PolarHBondContact N-OE2 2.61Å; E453-Q531 CarbonylContact O-C 3.55Å; E453-Q531 WeakPolarHBondContact O-CA 3.43Å; E453-N532 WeakPolarHBondContact O-CB 3.36Å; E453-N532 PolarHBondContact O-N 3.27Å; E453-Y535 VanDerWaalsContact CA-CG 3.49Å; E453-Y535 HydrophobicContact CB-CD1 3.93Å; E453-Y535 HydrophobicContact CB-CD2 4.18Å; E453-Y535 HydrophobicContact CB-CE1 3.92Å; E453-Y535 HydrophobicContact CB-CE2 4.18Å; E453-Y535 HydrophobicContact CB-CG 4.06Å; E453-Y535 HydrophobicContact CG-CD1 3.83Å; E453-Y535 HydrophobicContact CG-CE1 3.9Å; E453-Y535 HydrophobicContact CG-CG 4.37Å
454	F	95.4	Very high	92.4	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	12%	0.117	C	C	.	.	B	Isolated β-bridge	trans	-97	148.8	-176.3	59.1	-100.9	0	0	0	112.9	R398 L400 F403 V441 L445 F452 F458 L459 F530	R398-F454 WeakPolarHBondContact O-CD1 3.31Å; R398-F454 WeakPolarHBondContact O-CE1 3.32Å; L400-F454 HydrophobicContact CD2-CB 3.53Å; L400-F454 HydrophobicContact CG-CB 3.92Å; F403-F454 HydrophobicContact CB-CD1 4.07Å; F403-F454 HydrophobicContact CB-CE1 3.64Å; F403-F454 HydrophobicContact CB-CZ 4.42Å; F403-F454 AromaticContact CD2-CE1 3.58Å; F403-F454 HydrophobicContact CD2-CE1 3.58Å; F403-F454 AromaticContact CD2-CZ 3.53Å; F403-F454 HydrophobicContact CD2-CZ 3.53Å; F403-F454 HydrophobicContact CE2-CE1 4.4Å; F403-F454 AromaticContact CE2-CZ 3.9Å; F403-F454 HydrophobicContact CE2-CZ 3.9Å; F403-F454 HydrophobicContact CG-CD1 4.37Å; F403-F454 AromaticContact CG-CE1 3.7Å; F403-F454 HydrophobicContact CG-CE1 3.7Å; F403-F454 AromaticContact CG-CZ 3.99Å; F403-F454 HydrophobicContact CG-CZ 3.99Å; V441-F454 HydrophobicContact CG1-CE2 3.83Å; V441-F454 HydrophobicContact CG1-CZ 3.79Å; L445-F454 WeakPolarHBondContact CD1-O 3.42Å; F452-F454 VanDerWaalsContact C-N 3.28Å; F452-F454 AromaticContact CD1-CE1 3.78Å; F452-F454 HydrophobicContact CD1-CE1 3.78Å; F452-F454 AromaticContact CD1-CE2 3.95Å; F452-F454 HydrophobicContact CD1-CE2 3.95Å; F452-F454 AromaticContact CD1-CZ 3.39Å; F452-F454 HydrophobicContact CD1-CZ 3.39Å; F452-F454 HydrophobicContact CE1-CE1 4.44Å; F452-F454 AromaticContact CE1-CZ 3.88Å; F452-F454 HydrophobicContact CE1-CZ 3.88Å; F452-F454 HydrophobicContact CG-CZ 4.49Å; F452-F454 PolarHBondContact O-N 2.85Å; F454-F458 HydrophobicContact CB-CB 4.16Å; F454-F458 HydrophobicContact CB-CD1 3.62Å; F454-F458 HydrophobicContact CB-CE1 4.32Å; F454-F458 HydrophobicContact CB-CG 4.09Å; F454-F458 HydrophobicContact CD1-CD1 4.38Å; F454-F458 HydrophobicContact CD1-CE1 4.4Å; F454-F458 AromaticContact CD2-CD1 3.82Å; F454-F458 HydrophobicContact CD2-CD1 3.82Å; F454-F458 HydrophobicContact CD2-CE1 4.45Å; F454-F458 AromaticContact CG-CD1 3.69Å; F454-F458 HydrophobicContact CG-CD1 3.69Å; F454-F458 HydrophobicContact CG-CE1 4.14Å; F454-L459 HydrophobicContact CD2-CD2 4.17Å; F454-L459 HydrophobicContact CD2-CG 4.27Å; F454-L459 HydrophobicContact CE2-CD1 4.31Å; F454-L459 HydrophobicContact CE2-CD2 3.75Å; F454-L459 HydrophobicContact CE2-CG 4.12Å; F454-F530 CarbonylContact C-O 3.56Å; F454-F530 WeakPolarHBondContact CA-O 3.39Å
455	S	92.9	Very high	91.9	Very high	9 Å²	9	22.3 Å²	22.3	6%	0.063	12%	0.118	C	C	.	.			trans	-91.7	173.9	177.3	82.5	0	0	0	0	111.9	F457 F458 Q529 F530	S455-F457 PolarHBondContact O-N 2.86Å; S455-F457 PolarHBondContact OG-N 2.88Å; S455-F457 VanDerWaalsContact OG-N 3.13Å; S455-F458 WeakPolarHBondContact O-CB 3.48Å; S455-F458 PolarHBondContact O-N 2.69Å; S455-Q529 WeakPolarHBondContact CB-O 3.32Å; S455-Q529 PolarHBondContact OG-O 2.95Å; S455-F530 PolarHBondContact N-O 3.11Å
456	E	91.2	Very high	91.5	Very high	28 Å²	28	22.4 Å²	22.4	13%	0.131	12%	0.119	C	C	.	.	H	α-helix	trans	-65.4	-22.4	173.4	70.4	-177.2	170.2	0	0	113.5	W442 L445 F458 L459 L460 R637	W442-E456 PolarHBondContact NE1-OE2 3.43Å; L445-E456 HydrophobicContact CD2-CB 4.24Å; E456-F458 VanDerWaalsContact C-N 3.27Å; E456-F458 PolarHBondContact O-N 3.38Å; E456-L459 PolarHBondContact O-N 2.82Å; E456-L460 WeakPolarHBondContact O-CB 3.41Å; E456-L460 VanDerWaalsContact O-CG 3.29Å; E456-L460 WeakPolarHBondContact O-CG 3.42Å; E456-L460 PolarHBondContact O-N 3.49Å; E456-R637 VanDerWaalsContact CD-CD 3.44Å; E456-R637 WeakPolarHBondContact OE1-CD 3.27Å; E456-R637 IonicContact OE1-CZ 3.25Å; E456-R637 IonicContact OE1-NE 3.14Å; E456-R637 PolarHBondContact OE1-NE 2.91Å; E456-R637 VanDerWaalsContact OE1-NE 3.09Å; E456-R637 IonicContact OE1-NH1 2.77Å; E456-R637 PolarHBondContact OE1-NH1 3.45Å; E456-R637 IonicContact OE1-NH2 2.74Å
457	F	89.8	Confident	90.9	Very high	51 Å²	51	20.8 Å²	20.8	22%	0.224	11%	0.111	C	C	.	.	H	α-helix	trans	-64.4	-36.5	176.4	-68	-70.1	0	0	0	111.6	S455 L460 A461 Q529 F530 R637 P653	S455-F457 PolarHBondContact O-N 2.86Å; S455-F457 PolarHBondContact OG-N 2.88Å; S455-F457 VanDerWaalsContact OG-N 3.13Å; F457-L460 PolarHBondContact O-N 3.13Å; F457-A461 WeakPolarHBondContact O-CB 3.48Å; F457-A461 PolarHBondContact O-N 3.25Å; F457-Q529 HydrophobicContact CB-CB 4.43Å; F457-Q529 HydrophobicContact CD2-CB 3.83Å; F457-Q529 HydrophobicContact CE2-CB 4.23Å; F457-Q529 HydrophobicContact CG-CB 4.27Å; F457-F530 HydrophobicContact CB-CD1 4.39Å; F457-R637 VanDerWaalsContact CE1-NH1 3.34Å; F457-P653 HydrophobicContact CD2-CG 4.26Å; F457-P653 HydrophobicContact CE2-CB 4.5Å; F457-P653 HydrophobicContact CE2-CG 3.28Å; F457-P653 HydrophobicContact CZ-CG 3.86Å
458	F	94	Very high	90.2	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-63.5	-43.6	174	171.3	-109.1	0	0	0	111.6	L400 F403 Q404 F454 S455 E456 L460 A461 L462 W518 F530	L400-F458 HydrophobicContact CD2-CB 4.44Å; L400-F458 HydrophobicContact CD2-CD1 4.11Å; L400-F458 HydrophobicContact CD2-CD2 3.78Å; L400-F458 HydrophobicContact CD2-CE1 4.29Å; L400-F458 HydrophobicContact CD2-CE2 4Å; L400-F458 HydrophobicContact CD2-CG 3.84Å; L400-F458 HydrophobicContact CD2-CZ 4.25Å; F403-F458 HydrophobicContact CB-CE1 4.45Å; F403-F458 AromaticContact CD1-CE1 3.42Å; F403-F458 HydrophobicContact CD1-CE1 3.42Å; F403-F458 VanDerWaalsContact CD1-CE1 3.42Å; F403-F458 AromaticContact CD1-CZ 3.9Å; F403-F458 HydrophobicContact CD1-CZ 3.9Å; F403-F458 AromaticContact CE1-CE1 3.91Å; F403-F458 HydrophobicContact CE1-CE1 3.91Å; F403-F458 HydrophobicContact CG-CE1 4.14Å; Q404-F458 HydrophobicContact CG-CE2 4.13Å; Q404-F458 HydrophobicContact CG-CZ 3.75Å; F454-F458 HydrophobicContact CB-CB 4.16Å; F454-F458 HydrophobicContact CB-CD1 3.62Å; F454-F458 HydrophobicContact CB-CE1 4.32Å; F454-F458 HydrophobicContact CB-CG 4.09Å; F454-F458 HydrophobicContact CD1-CD1 4.38Å; F454-F458 HydrophobicContact CD1-CE1 4.4Å; F454-F458 AromaticContact CD2-CD1 3.82Å; F454-F458 HydrophobicContact CD2-CD1 3.82Å; F454-F458 HydrophobicContact CD2-CE1 4.45Å; F454-F458 AromaticContact CG-CD1 3.69Å; F454-F458 HydrophobicContact CG-CD1 3.69Å; F454-F458 HydrophobicContact CG-CE1 4.14Å; S455-F458 WeakPolarHBondContact O-CB 3.48Å; S455-F458 PolarHBondContact O-N 2.69Å; E456-F458 VanDerWaalsContact C-N 3.27Å; E456-F458 PolarHBondContact O-N 3.38Å; F458-L460 VanDerWaalsContact C-N 3.32Å; F458-L460 PolarHBondContact O-N 3.37Å; F458-A461 PolarHBondContact O-N 3.28Å; F458-L462 WeakPolarHBondContact O-CB 3.29Å; F458-L462 PolarHBondContact O-N 3.26Å; F458-W518 HydrophobicContact CD2-CZ2 4.33Å; F458-W518 AromaticContact CE2-CZ2 3.69Å; F458-W518 HydrophobicContact CE2-CZ2 3.69Å; F458-F530 HydrophobicContact CB-CB 3.89Å; F458-F530 HydrophobicContact CB-CD1 4.07Å; F458-F530 HydrophobicContact CB-CG 3.94Å; F458-F530 HydrophobicContact CD2-CB 4.37Å; F458-F530 AromaticContact CD2-CD2 3.84Å; F458-F530 HydrophobicContact CD2-CD2 3.84Å; F458-F530 HydrophobicContact CD2-CE2 4.24Å; F458-F530 HydrophobicContact CD2-CG 4.08Å; F458-F530 HydrophobicContact CG-CB 4.49Å; F458-F530 HydrophobicContact CG-CG 4.48Å
459	L	95.4	Very high	89.1	Confident	0 Å²	0	18.6 Å²	18.6	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-63.7	-39.1	176.7	-61.2	-179.9	0	0	0	112.1	F403 L438 V441 W442 L445 F454 E456 L462 H463 W635	F403-L459 HydrophobicContact CE1-CD2 4.2Å; F403-L459 HydrophobicContact CZ-CD2 3.99Å; L438-L459 HydrophobicContact CD2-CD2 4.25Å; V441-L459 HydrophobicContact CB-CD1 4.47Å; V441-L459 HydrophobicContact CG1-CD1 4.1Å; V441-L459 HydrophobicContact CG1-CD2 3.94Å; W442-L459 HydrophobicContact CB-CD1 3.93Å; L445-L459 HydrophobicContact CD2-CD1 4.39Å; F454-L459 HydrophobicContact CD2-CD2 4.17Å; F454-L459 HydrophobicContact CD2-CG 4.27Å; F454-L459 HydrophobicContact CE2-CD1 4.31Å; F454-L459 HydrophobicContact CE2-CD2 3.75Å; F454-L459 HydrophobicContact CE2-CG 4.12Å; E456-L459 PolarHBondContact O-N 2.82Å; L459-L462 PolarHBondContact O-N 3.1Å; L459-H463 PolarHBondContact O-N 3.2Å; L459-W635 HydrophobicContact CB-CH2 3.79Å; L459-W635 HydrophobicContact CB-CZ2 3.91Å; L459-W635 HydrophobicContact CD1-CH2 4.48Å
460	L	91	Very high	87.8	Confident	14 Å²	14	16 Å²	16	7%	0.073	9%	0.087	C	C	.	.	H	α-helix	trans	-65.1	-45.1	174.9	-75	177.5	0	0	0	111.9	E456 F457 F458 L462 H463 D464 W635 R637 C638	E456-L460 WeakPolarHBondContact O-CB 3.41Å; E456-L460 VanDerWaalsContact O-CG 3.29Å; E456-L460 WeakPolarHBondContact O-CG 3.42Å; E456-L460 PolarHBondContact O-N 3.49Å; F457-L460 PolarHBondContact O-N 3.13Å; F458-L460 VanDerWaalsContact C-N 3.32Å; F458-L460 PolarHBondContact O-N 3.37Å; L460-L462 VanDerWaalsContact C-N 3.28Å; L460-L462 PolarHBondContact O-N 2.99Å; L460-H463 WeakPolarHBondContact O-CB 3.44Å; L460-H463 PolarHBondContact O-N 3.44Å; L460-D464 PolarHBondContact O-N 2.85Å; L460-W635 HydrophobicContact CD2-CH2 4.33Å; L460-W635 HydrophobicContact CD2-CZ2 3.58Å; L460-W635 HydrophobicContact CG-CZ2 3.91Å; L460-R637 HydrophobicContact CD1-CB 4.2Å; L460-C638 HydrophobicContact CD2-CB 3.77Å
461	A	90.1	Very high	86.9	Confident	3 Å²	3	15 Å²	15	3%	0.025	8%	0.078	C	C	.	.	H	α-helix	trans	-59.1	-41	174.8	0	0	0	0	0	111.7	F457 F458 D464 S465 W518 Y522 F530	F457-A461 WeakPolarHBondContact O-CB 3.48Å; F457-A461 PolarHBondContact O-N 3.25Å; F458-A461 PolarHBondContact O-N 3.28Å; A461-D464 PolarHBondContact O-N 2.85Å; A461-S465 WeakPolarHBondContact O-CB 3.45Å; A461-S465 PolarHBondContact O-N 2.97Å; A461-W518 HydrophobicContact CB-CH2 4.49Å; A461-W518 HydrophobicContact CB-CZ3 4.13Å; A461-Y522 WeakPolarHBondContact CA-OH 3.5Å; A461-Y522 HydrophobicContact CB-CE1 4.38Å; A461-Y522 HydrophobicContact CB-CE2 3.79Å; A461-Y522 WeakPolarHBondContact CB-OH 3.24Å; A461-F530 HydrophobicContact CB-CE1 3.73Å; A461-F530 HydrophobicContact CB-CZ 3.61Å
462	L	92.2	Very high	86	Confident	0 Å²	0	16.2 Å²	16.2	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-66.5	-44.3	175.8	-171.5	59.7	0	0	0	112	F403 V407 F434 L438 F458 L459 L460 D464 S465 V466 F474 W516 W518	F403-L462 HydrophobicContact CE1-CD2 3.7Å; V407-L462 HydrophobicContact CG2-CD2 4.29Å; F434-L462 HydrophobicContact CE1-CD2 4.33Å; F434-L462 HydrophobicContact CE1-CG 4.03Å; F434-L462 HydrophobicContact CZ-CD2 3.92Å; F434-L462 HydrophobicContact CZ-CG 4.06Å; L438-L462 HydrophobicContact CD2-CD2 3.83Å; L438-L462 HydrophobicContact CD2-CG 4.48Å; F458-L462 WeakPolarHBondContact O-CB 3.29Å; F458-L462 PolarHBondContact O-N 3.26Å; L459-L462 PolarHBondContact O-N 3.1Å; L460-L462 VanDerWaalsContact C-N 3.28Å; L460-L462 PolarHBondContact O-N 2.99Å; L462-D464 VanDerWaalsContact C-N 3.28Å; L462-D464 PolarHBondContact O-N 2.82Å; L462-S465 PolarHBondContact O-N 2.69Å; L462-S465 PolarHBondContact O-OG 3.02Å; L462-V466 WeakPolarHBondContact O-CG2 3.25Å; L462-V466 PolarHBondContact O-N 3.5Å; L462-F474 HydrophobicContact CD1-CE2 3.93Å; L462-F474 HydrophobicContact CD1-CZ 3.83Å; L462-W516 HydrophobicContact CD1-CH2 4.28Å; L462-W516 HydrophobicContact CD1-CZ3 4.12Å; L462-W518 HydrophobicContact CB-CH2 4.46Å; L462-W518 HydrophobicContact CD1-CH2 4.23Å
463	H	91.5	Very high	85.4	Confident	4 Å²	4	16.7 Å²	16.7	2%	0.019	9%	0.087	C	C	.	.	H	α-helix	trans	-55.7	-44	173.2	165	-103.4	0	0	0	112.1	L438 L459 L460 V466	L438-H463 HydrophobicContact CD1-CB 3.84Å; L459-H463 PolarHBondContact O-N 3.2Å; L460-H463 WeakPolarHBondContact O-CB 3.44Å; L460-H463 PolarHBondContact O-N 3.44Å; H463-V466 PolarHBondContact O-N 2.83Å
464	D	86.8	Confident	85	Confident	25 Å²	25	14.9 Å²	14.9	13%	0.134	8%	0.078	C	C	.	.	H	α-helix	trans	-69.9	-38.6	-178.4	-63.4	-21.7	0	0	0	111	L460 A461 L462 V466 R467 V468 R641	L460-D464 PolarHBondContact O-N 2.85Å; A461-D464 PolarHBondContact O-N 2.85Å; L462-D464 VanDerWaalsContact C-N 3.28Å; L462-D464 PolarHBondContact O-N 2.82Å; D464-V466 PolarHBondContact O-N 3.03Å; D464-R467 PolarHBondContact O-N 2.96Å; D464-V468 WeakPolarHBondContact O-CG2 3.1Å; D464-V468 PolarHBondContact O-N 3.37Å; D464-R641 IonicContact OD1-CZ 2.63Å; D464-R641 IonicContact OD1-NH1 2.96Å; D464-R641 PolarHBondContact OD1-NH1 3.27Å; D464-R641 IonicContact OD1-NH2 3.41Å; D464-R641 IonicContact OD2-CZ 3.72Å; D464-R641 IonicContact OD2-NH1 2.77Å; D464-R641 PolarHBondContact OD2-NH1 2.81Å; D464-R641 IonicContact OD2-NH2 3.91Å; D464-R641 PolarHBondContact OD2-NH2 3.08Å
465	S	85.9	Confident	84	Confident	3 Å²	3	15.1 Å²	15.1	2%	0.021	8%	0.08	C	C	.	.	H	α-helix	trans	-61.1	-29.3	179.6	75	0	0	0	0	114.3	A461 L462 R467 F474 V515 R521	A461-S465 WeakPolarHBondContact O-CB 3.45Å; A461-S465 PolarHBondContact O-N 2.97Å; L462-S465 PolarHBondContact O-N 2.69Å; L462-S465 PolarHBondContact O-OG 3.02Å; S465-R467 PolarHBondContact O-N 2.89Å; S465-F474 WeakPolarHBondContact OG-CE2 3.26Å; S465-V515 WeakPolarHBondContact OG-CG2 3.42Å; S465-R521 VanDerWaalsContact CA-NH1 3.33Å; S465-R521 VanDerWaalsContact CB-NH1 3.3Å
466	V	85.8	Confident	83.5	Confident	14 Å²	14	16.4 Å²	16.4	9%	0.085	8%	0.083	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-22.9	177.7	176.6	0	0	0	0	111.5	F418 L422 F434 L462 H463 D464 F474	F418-V466 HydrophobicContact CD1-CG1 3.92Å; F418-V466 HydrophobicContact CE1-CG1 4.33Å; F418-V466 HydrophobicContact CE1-CG2 4.37Å; L422-V466 HydrophobicContact CD1-CG1 3.46Å; L422-V466 VanDerWaalsContact CD1-CG1 3.46Å; L422-V466 WeakPolarHBondContact CD1-O 3.25Å; L422-V466 HydrophobicContact CD2-CG1 3.55Å; L422-V466 HydrophobicContact CG-CG1 4.04Å; F434-V466 HydrophobicContact CD1-CG2 3.71Å; F434-V466 HydrophobicContact CE1-CG2 3.57Å; L462-V466 WeakPolarHBondContact O-CG2 3.25Å; L462-V466 PolarHBondContact O-N 3.5Å; H463-V466 PolarHBondContact O-N 2.83Å; D464-V466 PolarHBondContact O-N 3.03Å; V466-F474 HydrophobicContact CB-CD2 4.23Å; V466-F474 HydrophobicContact CB-CG 4.46Å; V466-F474 HydrophobicContact CG1-CB 4.49Å; V466-F474 HydrophobicContact CG2-CD1 4.27Å; V466-F474 HydrophobicContact CG2-CD2 3.55Å; V466-F474 HydrophobicContact CG2-CE1 4.4Å; V466-F474 HydrophobicContact CG2-CE2 3.68Å; V466-F474 HydrophobicContact CG2-CG 3.86Å; V466-F474 HydrophobicContact CG2-CZ 4.13Å
467	R	79.8	Confident	83.2	Confident	21 Å²	21	16 Å²	16	8%	0.079	8%	0.082	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.7	-9.3	-177.4	-62.2	-72	174.3	70.5	-4.7	113.3	N102 R136 D464 S465	N102-R467 HydrophobicContact CB-CB 4.22Å; R136-R467 PolarHBondContact O-NH1 3.28Å; D464-R467 PolarHBondContact O-N 2.96Å; S465-R467 PolarHBondContact O-N 2.89Å
468	V	77.2	Confident	83.2	Confident	38 Å²	38	14 Å²	14	23%	0.23	7%	0.074	C	C	.	.	S	Bend	trans	-104.3	120.3	178	-178.7	0	0	0	0	108.9	D464 D470	D464-V468 WeakPolarHBondContact O-CG2 3.1Å; D464-V468 PolarHBondContact O-N 3.37Å; V468-D470 HydrophobicContact CG1-CB 4.14Å; V468-D470 PolarHBondContact O-N 3.43Å
469	P	67.9	Low	82.9	Confident	12 Å²	12	14.7 Å²	14.7	8%	0.078	8%	0.078	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.8	46.3	-173	36.1	-36.6	0	0	0	113.1	V101 Y174	V101-P469 HydrophobicContact CG2-CB 4.39Å; V101-P469 HydrophobicContact CG2-CG 3.74Å; Y174-P469 HydrophobicContact CE1-CB 4.46Å; Y174-P469 VanDerWaalsContact CE1-O 3.24Å; Y174-P469 WeakPolarHBondContact CE1-O 3.37Å; Y174-P469 HydrophobicContact CE2-CB 3.66Å; Y174-P469 VanDerWaalsContact CZ-CB 3.48Å; Y174-P469 VanDerWaalsContact CZ-O 3.22Å; Y174-P469 WeakPolarHBondContact OH-CA 3.4Å; Y174-P469 WeakPolarHBondContact OH-CB 3.44Å
470	D	66	Low	82.5	Confident	17 Å²	17	18.5 Å²	18.5	9%	0.091	9%	0.093	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.5	-32.9	178.2	56.9	-11.5	0	0	0	112.2	V468 R521	V468-D470 HydrophobicContact CG1-CB 4.14Å; V468-D470 PolarHBondContact O-N 3.43Å; D470-R521 VanDerWaalsContact CG-NH1 3.33Å; D470-R521 VanDerWaalsContact CG-NH2 3.29Å; D470-R521 IonicContact OD1-CZ 2.67Å; D470-R521 IonicContact OD1-NH1 2.84Å; D470-R521 PolarHBondContact OD1-NH1 2.71Å; D470-R521 IonicContact OD1-NH2 3.85Å; D470-R521 PolarHBondContact OD1-NH2 2.87Å; D470-R521 IonicContact OD2-CZ 2.75Å; D470-R521 IonicContact OD2-NE 3.82Å; D470-R521 PolarHBondContact OD2-NE 3.31Å; D470-R521 IonicContact OD2-NH1 2.71Å; D470-R521 PolarHBondContact OD2-NH1 3.05Å; D470-R521 IonicContact OD2-NH2 3.23Å; D470-R521 PolarHBondContact OD2-NH2 3.47Å
471	T	71.6	Confident	82.1	Confident	8 Å²	8	20.4 Å²	20.4	5%	0.049	10%	0.101	C	C	.	.			trans	-80.1	126.8	173.3	118.2	0	0	0	0	119.1	Y174 T473 V515 R521	Y174-T471 VanDerWaalsContact CE1-O 3.25Å; Y174-T471 WeakPolarHBondContact CE1-O 3.47Å; Y174-T471 PolarHBondContact OH-O 3.37Å; T471-T473 PolarHBondContact O-N 3.47Å; T471-T473 PolarHBondContact OG1-OG1 2.82Å; T471-V515 VanDerWaalsContact OG1-CA 3.29Å; T471-V515 WeakPolarHBondContact OG1-CA 3.3Å; T471-V515 WeakPolarHBondContact OG1-CB 3.25Å; T471-V515 PolarHBondContact OG1-N 3.33Å; T471-R521 PolarHBondContact OG1-NH2 3.45Å
472	L	73.1	Confident	81.6	Confident	47 Å²	47	21.6 Å²	21.6	25%	0.246	11%	0.105	C	C	.	.	S	Bend	trans	-68.8	-17.3	163.4	-73.1	178	0	0	0	113.2	Y174 F474 L475	Y174-L472 HydrophobicContact CD1-CD2 3.64Å; Y174-L472 HydrophobicContact CD1-CG 4.42Å; Y174-L472 HydrophobicContact CE1-CD2 4.24Å; Y174-L472 HydrophobicContact CG-CD2 4.23Å; L472-F474 PolarHBondContact O-N 3.16Å; L472-L475 HydrophobicContact CD2-CD2 4.02Å
473	T	81.4	Confident	80.6	Confident	10 Å²	10	21.8 Å²	21.8	6%	0.061	11%	0.107	C	C	.	.	S	Bend	trans	-56.1	-48	-174.9	-54.4	0	0	0	0	112.5	V412 T471 V515	V412-T473 HydrophobicContact CB-CG2 4.41Å; V412-T473 HydrophobicContact CG1-CG2 3.98Å; V412-T473 HydrophobicContact CG2-CG2 3.58Å; T471-T473 PolarHBondContact O-N 3.47Å; T471-T473 PolarHBondContact OG1-OG1 2.82Å; T473-V515 HydrophobicContact CG2-CB 4.31Å; T473-V515 HydrophobicContact CG2-CG1 3.68Å; T473-V515 PolarHBondContact OG1-N 3.11Å; T473-V515 VanDerWaalsContact OG1-N 3.1Å
474	F	85.6	Confident	79.5	Confident	8 Å²	8	26.9 Å²	26.9	4%	0.035	13%	0.129	C	C	.	.	S	Bend	trans	-106.6	4.7	-174.4	-58.6	-50.3	0	0	0	115	V407 V412 F418 L462 S465 V466 L472 V515	V407-F474 HydrophobicContact CG1-CE1 4.47Å; V407-F474 HydrophobicContact CG1-CZ 4.41Å; V412-F474 HydrophobicContact CG2-CD1 4.23Å; V412-F474 HydrophobicContact CG2-CE1 3.72Å; F418-F474 WeakPolarHBondContact CB-O 3.15Å; F418-F474 HydrophobicContact CD1-CB 4.3Å; F418-F474 AromaticContact CD1-CD1 3.87Å; F418-F474 HydrophobicContact CD1-CD1 3.87Å; F418-F474 HydrophobicContact CD1-CG 4.38Å; F418-F474 AromaticContact CD2-CD1 3.93Å; F418-F474 HydrophobicContact CD2-CD1 3.93Å; F418-F474 AromaticContact CE1-CD1 3.53Å; F418-F474 HydrophobicContact CE1-CD1 3.53Å; F418-F474 AromaticContact CE1-CE1 3.88Å; F418-F474 HydrophobicContact CE1-CE1 3.88Å; F418-F474 HydrophobicContact CE1-CG 4.33Å; F418-F474 AromaticContact CE2-CD1 3.59Å; F418-F474 HydrophobicContact CE2-CD1 3.59Å; F418-F474 AromaticContact CE2-CE1 3.99Å; F418-F474 HydrophobicContact CE2-CE1 3.99Å; F418-F474 HydrophobicContact CG-CB 4.27Å; F418-F474 HydrophobicContact CG-CD1 4.07Å; F418-F474 AromaticContact CZ-CD1 3.38Å; F418-F474 HydrophobicContact CZ-CD1 3.38Å; F418-F474 AromaticContact CZ-CE1 3.5Å; F418-F474 HydrophobicContact CZ-CE1 3.5Å; L462-F474 HydrophobicContact CD1-CE2 3.93Å; L462-F474 HydrophobicContact CD1-CZ 3.83Å; S465-F474 WeakPolarHBondContact OG-CE2 3.26Å; V466-F474 HydrophobicContact CB-CD2 4.23Å; V466-F474 HydrophobicContact CB-CG 4.46Å; V466-F474 HydrophobicContact CG1-CB 4.49Å; V466-F474 HydrophobicContact CG2-CD1 4.27Å; V466-F474 HydrophobicContact CG2-CD2 3.55Å; V466-F474 HydrophobicContact CG2-CE1 4.4Å; V466-F474 HydrophobicContact CG2-CE2 3.68Å; V466-F474 HydrophobicContact CG2-CG 3.86Å; V466-F474 HydrophobicContact CG2-CZ 4.13Å; L472-F474 PolarHBondContact O-N 3.16Å; F474-V515 HydrophobicContact CD2-CG2 4.37Å; F474-V515 HydrophobicContact CE2-CB 4.09Å; F474-V515 HydrophobicContact CE2-CG1 3.93Å; F474-V515 HydrophobicContact CE2-CG2 3.79Å; F474-V515 HydrophobicContact CZ-CG1 4.09Å
475	L	75.7	Confident	77.9	Confident	6 Å²	6	30.3 Å²	30.3	3%	0.031	15%	0.145	C	C	.	.	S	Bend	trans	-75.7	-25.4	-175.1	179.4	53.6	0	0	0	114.6	P170 Y174 L419 L472	P170-L475 HydrophobicContact CB-CD1 4.21Å; Y174-L475 HydrophobicContact CD1-CD2 3.5Å; Y174-L475 VanDerWaalsContact CD1-CD2 3.5Å; Y174-L475 HydrophobicContact CD1-CG 4.47Å; Y174-L475 HydrophobicContact CD2-CD1 3.84Å; Y174-L475 HydrophobicContact CD2-CD2 3.08Å; Y174-L475 HydrophobicContact CD2-CG 3.91Å; Y174-L475 HydrophobicContact CE1-CB 3.89Å; Y174-L475 HydrophobicContact CE1-CD1 4.34Å; Y174-L475 HydrophobicContact CE1-CD2 3.47Å; Y174-L475 VanDerWaalsContact CE1-CD2 3.47Å; Y174-L475 HydrophobicContact CE1-CG 3.97Å; Y174-L475 HydrophobicContact CE2-CB 4.12Å; Y174-L475 HydrophobicContact CE2-CD1 2.98Å; Y174-L475 HydrophobicContact CE2-CD2 3.08Å; Y174-L475 HydrophobicContact CE2-CG 3.37Å; Y174-L475 HydrophobicContact CG-CD2 3.25Å; Y174-L475 HydrophobicContact CG-CG 4.39Å; Y174-L475 VanDerWaalsContact OH-CB 3.26Å; Y174-L475 WeakPolarHBondContact OH-CB 3.4Å; Y174-L475 WeakPolarHBondContact OH-CD1 3.44Å; Y174-L475 WeakPolarHBondContact OH-CG 3.48Å; L419-L475 WeakPolarHBondContact CB-O 3.4Å; L419-L475 HydrophobicContact CD1-CD1 4.4Å; L472-L475 HydrophobicContact CD2-CD2 4.02Å
476	R	81.2	Confident	76.2	Confident	35 Å²	35	31 Å²	31	13%	0.132	15%	0.149	C	C	.	.			trans	-117.1	156	-163.7	-62.3	-60	-172.5	168.3	-4.2	112.2	E481 R482	R476-E481 HydrophobicContact CB-CB 4Å; R476-E481 HydrophobicContact CG-CB 4.14Å; R476-R482 HydrophobicContact CB-CG 3.61Å; R476-R482 HydrophobicContact CG-CG 3.83Å; R476-R482 PolarHBondContact O-NH1 3.45Å
477	N	86.1	Confident	74.4	Confident	19 Å²	19	31.9 Å²	31.9	10%	0.102	16%	0.162	C	C	.	.	S	Bend	trans	-83.9	-33.3	179.4	-74.8	-33.3	0	0	0	112.1	R379 P417 L419 T420 E481	R379-N477 PolarHBondContact NH2-O 2.74Å; P417-N477 VanDerWaalsContact CA-OD1 3.31Å; P417-N477 WeakPolarHBondContact CA-OD1 2.98Å; P417-N477 HydrophobicContact CB-CB 4.1Å; P417-N477 PolarHBondContact O-OD1 2.64Å; L419-N477 WeakPolarHBondContact CB-OD1 2.9Å; L419-N477 PolarHBondContact N-OD1 2.65Å; L419-N477 VanDerWaalsContact N-OD1 3.11Å; T420-N477 PolarHBondContact N-OD1 3.18Å; T420-N477 PolarHBondContact OG1-ND2 3.02Å; T420-N477 PolarHBondContact OG1-OD1 3.13Å; N477-E481 PolarHBondContact N-OE2 2.67Å
478	T	88.3	Confident	73	Confident	9 Å²	9	34 Å²	34	6%	0.055	17%	0.173	C	C	.	.	S	Bend	trans	-126.8	152	-172.6	62.7	0	0	0	0	112.6	T227 W480 E481 R482	T227-T478 WeakPolarHBondContact O-CB 3.24Å; T478-W480 PolarHBondContact O-N 2.87Å; T478-E481 PolarHBondContact N-OE2 2.9Å; T478-E481 PolarHBondContact O-N 3.14Å; T478-E481 WeakPolarHBondContact OG1-CB 3.45Å; T478-E481 WeakPolarHBondContact OG1-CG 3.19Å; T478-E481 PolarHBondContact OG1-N 3.35Å; T478-E481 VanDerWaalsContact OG1-N 3.17Å; T478-E481 PolarHBondContact OG1-OE1 3.07Å; T478-E481 VanDerWaalsContact OG1-OE1 3.11Å; T478-R482 PolarHBondContact O-N 2.88Å
479	P	87.7	Confident	71.4	Confident	15 Å²	15	33.1 Å²	33.1	10%	0.097	17%	0.166	C	C	.	.	H	α-helix	trans	-61.9	-32.7	171.9	-21.4	34.6	0	0	0	112.1	F223 S228 A413 R482 G483	F223-P479 HydrophobicContact CE1-CB 4.13Å; S228-P479 WeakPolarHBondContact O-CD 3.32Å; A413-P479 WeakPolarHBondContact O-CG 3.3Å; P479-R482 PolarHBondContact O-N 2.72Å; P479-G483 PolarHBondContact O-N 2.95Å
480	W	87.1	Confident	70.3	Confident	81 Å²	81	37.6 Å²	37.6	31%	0.307	19%	0.19	S	C	.	.	H	α-helix	trans	-59.7	-47	173.9	-179.9	88.3	0	0	0	112.7	F223 T227 T478 R482 G483 K484 L489	F223-W480 HydrophobicContact CD1-CB 3.81Å; F223-W480 HydrophobicContact CD1-CG 4.46Å; F223-W480 HydrophobicContact CD2-CB 4.32Å; F223-W480 AromaticContact CD2-CD1 3.44Å; F223-W480 VanDerWaalsContact CD2-CD1 3.44Å; F223-W480 HydrophobicContact CD2-CG 4.27Å; F223-W480 HydrophobicContact CE1-CB 3.81Å; F223-W480 HydrophobicContact CE2-CB 4.28Å; F223-W480 AromaticContact CE2-CD1 3.93Å; F223-W480 HydrophobicContact CE2-CG 4.48Å; F223-W480 HydrophobicContact CG-CB 4.05Å; F223-W480 AromaticContact CG-CD1 3.56Å; F223-W480 HydrophobicContact CG-CG 4.21Å; F223-W480 HydrophobicContact CZ-CB 4.03Å; T227-W480 HydrophobicContact CG2-CB 4.37Å; T227-W480 HydrophobicContact CG2-CD2 4.43Å; T227-W480 HydrophobicContact CG2-CG 4.11Å; T227-W480 WeakPolarHBondContact O-CB 3.43Å; T478-W480 PolarHBondContact O-N 2.87Å; W480-R482 VanDerWaalsContact C-N 3.28Å; W480-R482 PolarHBondContact O-N 3.24Å; W480-G483 PolarHBondContact O-N 3.15Å; W480-K484 HydrophobicContact CH2-CD 3.94Å; W480-K484 HydrophobicContact CZ2-CD 4.23Å; W480-K484 HydrophobicContact CZ3-CD 4.41Å; W480-K484 PolarHBondContact O-N 3.16Å; W480-L489 HydrophobicContact CZ2-CD2 4.48Å
481	E	83.4	Confident	69.2	Low	53 Å²	53	40.5 Å²	40.5	25%	0.248	21%	0.211	C	C	.	.	H	α-helix	trans	-59.3	-38.8	176.4	-78.9	158.3	-146.9	0	0	112.2	R476 N477 T478	R476-E481 HydrophobicContact CB-CB 4Å; R476-E481 HydrophobicContact CG-CB 4.14Å; N477-E481 PolarHBondContact N-OE2 2.67Å; T478-E481 PolarHBondContact N-OE2 2.9Å; T478-E481 PolarHBondContact O-N 3.14Å; T478-E481 WeakPolarHBondContact OG1-CB 3.45Å; T478-E481 WeakPolarHBondContact OG1-CG 3.19Å; T478-E481 PolarHBondContact OG1-N 3.35Å; T478-E481 VanDerWaalsContact OG1-N 3.17Å; T478-E481 PolarHBondContact OG1-OE1 3.07Å; T478-E481 VanDerWaalsContact OG1-OE1 3.11Å
482	R	80.4	Confident	67.9	Low	28 Å²	28	47.4 Å²	47.4	11%	0.106	24%	0.237	C	C	.	.	H	α-helix	trans	-65.8	-46.7	175.4	-69.6	-174.1	-88.4	-81.7	-5.7	111.4	V412 R476 T478 P479 W480 K484 Q485	V412-R482 PolarHBondContact O-NH2 2.94Å; R476-R482 HydrophobicContact CB-CG 3.61Å; R476-R482 HydrophobicContact CG-CG 3.83Å; R476-R482 PolarHBondContact O-NH1 3.45Å; T478-R482 PolarHBondContact O-N 2.88Å; P479-R482 PolarHBondContact O-N 2.72Å; W480-R482 VanDerWaalsContact C-N 3.28Å; W480-R482 PolarHBondContact O-N 3.24Å; R482-K484 VanDerWaalsContact C-N 3.34Å; R482-K484 PolarHBondContact O-N 3.4Å; R482-Q485 PolarHBondContact O-N 2.77Å
483	G	70.6	Confident	66.4	Low	5 Å²	5	49.8 Å²	49.8	5%	0.052	25%	0.254	C	S	.	.	H	α-helix	trans	-67.1	-27.6	-177.6	0	0	0	0	0	114.9	P479 W480 Q485	P479-G483 PolarHBondContact O-N 2.95Å; W480-G483 PolarHBondContact O-N 3.15Å; G483-Q485 VanDerWaalsContact C-N 3.3Å; G483-Q485 PolarHBondContact O-N 2.76Å
484	K	67.6	Low	64.4	Low	110 Å²	110	57.1 Å²	57.1	48%	0.478	29%	0.288	S	S	.	.	H	α-helix	trans	-63.6	-31.9	178.8	-172	174.6	179.4	177.9	0	113.2	W480 R482 L489	W480-K484 HydrophobicContact CH2-CD 3.94Å; W480-K484 HydrophobicContact CZ2-CD 4.23Å; W480-K484 HydrophobicContact CZ3-CD 4.41Å; W480-K484 PolarHBondContact O-N 3.16Å; R482-K484 VanDerWaalsContact C-N 3.34Å; R482-K484 PolarHBondContact O-N 3.4Å; K484-L489 HydrophobicContact CB-CD2 4.19Å; K484-L489 HydrophobicContact CG-CD2 4.34Å
485	Q	53.7	Low	62	Low	98 Å²	98	62.3 Å²	62.3	46%	0.458	32%	0.32	S	S	.	.	H	α-helix	trans	-92.9	-21.7	-177.3	-69.9	-169.6	-39.2	0	0	113.9	R482 G483 G487	R482-Q485 PolarHBondContact O-N 2.77Å; G483-Q485 VanDerWaalsContact C-N 3.3Å; G483-Q485 PolarHBondContact O-N 2.76Å; Q485-G487 PolarHBondContact O-N 2.74Å
486	S	50.8	Low	60	Low	16 Å²	16	72.1 Å²	72.1	11%	0.112	36%	0.358	C	S	.	.	S	Bend	trans	-65	1	172.7	-179.7	0	0	0	0	113.2	Q488 N510	S486-Q488 PolarHBondContact O-N 3.42Å; S486-N510 PolarHBondContact O-ND2 3.24Å
487	G	48.4	Very low	57.6	Low	34 Å²	34	75.7 Å²	75.7	35%	0.351	38%	0.384	S	S	.	.	S	Bend	trans	71.1	-13.9	-176.1	0	0	0	0	0	114.2	Q485 L489 N490	Q485-G487 PolarHBondContact O-N 2.74Å; G487-L489 PolarHBondContact O-N 2.97Å; G487-N490 PolarHBondContact O-N 3.47Å
488	Q	48.6	Very low	54.9	Low	66 Å²	66	80.2 Å²	80.2	31%	0.308	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-22.5	179.6	-69.1	179.5	-4.5	0	0	114.3	S486 S491	S486-Q488 PolarHBondContact O-N 3.42Å; Q488-S491 PolarHBondContact O-OG 2.89Å
489	L	45.1	Very low	52.4	Low	19 Å²	19	82.1 Å²	82.1	10%	0.099	44%	0.435	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.2	-17.9	178.8	-153.7	76.3	0	0	0	113.1	F223 W480 K484 G487 S491 Y492	F223-L489 HydrophobicContact CD2-CD1 4.43Å; F223-L489 HydrophobicContact CE2-CD1 4.36Å; W480-L489 HydrophobicContact CZ2-CD2 4.48Å; K484-L489 HydrophobicContact CB-CD2 4.19Å; K484-L489 HydrophobicContact CG-CD2 4.34Å; G487-L489 PolarHBondContact O-N 2.97Å; L489-S491 PolarHBondContact O-N 3.25Å; L489-Y492 PolarHBondContact O-N 2.97Å
490	N	43.8	Very low	49.7	Very low	105 Å²	105	92.3 Å²	92.3	56%	0.561	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.9	-12	-175.3	-77.2	-12.5	0	0	0	113.6	G487	G487-N490 PolarHBondContact O-N 3.47Å
491	S	42.3	Very low	47	Very low	78 Å²	78	93.9 Å²	93.9	55%	0.545	50%	0.497	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-23.4	176	48.2	0	0	0	0	113.8	Q488 L489	Q488-S491 PolarHBondContact O-OG 2.89Å; L489-S491 PolarHBondContact O-N 3.25Å
492	Y	44.6	Very low	44.3	Very low	153 Å²	153	100.1 Å²	100.1	60%	0.6	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.5	-20.3	-169.2	-64.4	-74.5	0	0	0	115	L489	L489-Y492 PolarHBondContact O-N 2.97Å
493	T	41.7	Very low	42	Very low	97 Å²	97	103.9 Å²	103.9	60%	0.595	55%	0.554	S	S	*	*			trans	-96.9	27.5	179.6	43.3	0	0	0	0	114	V495	T493-V495 PolarHBondContact O-N 2.84Å
494	Q	39.9	Very low	40.1	Very low	164 Å²	164	109.5 Å²	109.5	77%	0.766	59%	0.59	S	S	*	*			trans	-68.1	84.4	165.2	-73.9	-164.9	1.6	0	0	109.4	Y496	Q494-Y496 PolarHBondContact O-N 2.85Å
495	V	35.4	Very low	38.5	Very low	118 Å²	118	109.9 Å²	109.9	72%	0.715	61%	0.614	S	S	*	*			trans	-58.2	117.1	154.1	177.9	0	0	0	0	105.4	T493 T497	T493-V495 PolarHBondContact O-N 2.84Å; V495-T497 VanDerWaalsContact C-N 3.3Å; V495-T497 PolarHBondContact O-N 3.35Å; V495-T497 PolarHBondContact O-OG1 3.13Å; V495-T497 VanDerWaalsContact O-OG1 3.1Å
496	Y	32.5	Very low	37.3	Very low	212 Å²	212	107.5 Å²	107.5	83%	0.831	62%	0.615	S	S	*	*			trans	-56.7	94.1	179.4	-157.7	-89.8	0	0	0	108.9	Q494 P498	Q494-Y496 PolarHBondContact O-N 2.85Å; Y496-P498 HydrophobicContact CD1-CG 4.32Å; Y496-P498 HydrophobicContact CE1-CG 4.43Å
497	T	31.3	Very low	36.6	Very low	109 Å²	109	113.7 Å²	113.7	67%	0.669	65%	0.647	S	S	*	*			trans	-104.6	106.5	172.2	-43	0	0	0	0	104.6	V495 G499	V495-T497 VanDerWaalsContact C-N 3.3Å; V495-T497 PolarHBondContact O-N 3.35Å; V495-T497 PolarHBondContact O-OG1 3.13Å; V495-T497 VanDerWaalsContact O-OG1 3.1Å; T497-G499 PolarHBondContact O-N 3.07Å
498	P	30.6	Very low	35.8	Very low	114 Å²	114	117 Å²	117	74%	0.74	67%	0.665	S	S	*	*	S	Bend	trans	-71.4	108	-179	0.9	13.3	0	0	0	107.9	Y496	Y496-P498 HydrophobicContact CD1-CG 4.32Å; Y496-P498 HydrophobicContact CE1-CG 4.43Å
499	G	34.7	Very low	35.1	Very low	49 Å²	49	121.3 Å²	121.3	51%	0.505	68%	0.683	S	S	.	*	S	Bend	trans	119	116.2	172.8	0	0	0	0	0	113.1	T497	T497-G499 PolarHBondContact O-N 3.07Å
500	Y	32.2	Very low	35.1	Very low	229 Å²	229	125.4 Å²	125.4	90%	0.898	71%	0.705	S	S	*	*	S	Bend	trans	96.5	124.1	162.9	-59.8	-79.9	0	0	0	119.2
501	S	29	Very low	35.4	Very low	115 Å²	115	121.9 Å²	121.9	80%	0.804	69%	0.686	S	S	*	*			trans	70.9	90.6	166.7	43.7	0	0	0	0	118.7
502	Q	28.1	Very low	36.1	Very low	184 Å²	184	121.6 Å²	121.6	86%	0.86	68%	0.676	S	S	*	*	P	Polyproline II helix	trans	-58.1	136	145.6	-72.7	176.6	-22.1	0	0	108.9
503	P	30.7	Very low	37.4	Very low	107 Å²	107	115.8 Å²	115.8	70%	0.695	66%	0.655	S	S	*	*	P	Polyproline II helix	trans	-66.2	138.4	164.9	28.1	-29.7	0	0	0	108.3	A505	P503-A505 PolarHBondContact O-N 3.07Å
504	P	31.1	Very low	39.2	Very low	123 Å²	123	111.2 Å²	111.2	80%	0.799	63%	0.627	S	S	*	*	P	Polyproline II helix	trans	-61.3	133.2	178.8	24.5	-30.9	0	0	0	109.3	G506	P504-G506 PolarHBondContact O-N 3.25Å
505	A	33.5	Very low	41.4	Very low	118 Å²	118	103.4 Å²	103.4	98%	0.975	59%	0.59	S	S	*	*			trans	-66.6	77.4	169.6	0	0	0	0	0	109.4	P503	P503-A505 PolarHBondContact O-N 3.07Å
506	G	29.4	Very low	43.9	Very low	47 Å²	47	98 Å²	98	49%	0.485	56%	0.557	S	S	.	*			trans	-120.5	125.6	165.3	0	0	0	0	0	107.4	P504 S508	P504-G506 PolarHBondContact O-N 3.25Å; G506-S508 VanDerWaalsContact C-N 3.25Å; G506-S508 PolarHBondContact O-N 3.28Å; G506-S508 PolarHBondContact O-OG 2.79Å
507	N	35.3	Very low	46.3	Very low	147 Å²	147	88.3 Å²	88.3	79%	0.786	52%	0.52	S	S	*	.			trans	-52.1	90.2	171.7	-82.3	-4.9	0	0	0	109.8	F509	N507-F509 VanDerWaalsContact C-N 3.31Å; N507-F509 HydrophobicContact CB-CD2 4.32Å; N507-F509 HydrophobicContact CB-CE2 3.92Å; N507-F509 HydrophobicContact CB-CZ 4.37Å; N507-F509 WeakPolarHBondContact O-CD2 3.47Å; N507-F509 PolarHBondContact O-N 3.26Å
508	S	33.1	Very low	48.8	Very low	103 Å²	103	83.9 Å²	83.9	72%	0.72	49%	0.491	S	S	*	.			trans	-79.4	90	171.1	-63.3	0	0	0	0	105.9	G506 N510	G506-S508 VanDerWaalsContact C-N 3.25Å; G506-S508 PolarHBondContact O-N 3.28Å; G506-S508 PolarHBondContact O-OG 2.79Å; S508-N510 VanDerWaalsContact C-N 3.32Å; S508-N510 PolarHBondContact O-N 3.07Å
509	F	33.6	Very low	51	Low	157 Å²	157	81.6 Å²	81.6	69%	0.689	47%	0.472	S	S	*	.			trans	-60.6	97.8	168.1	-67.6	-83.5	0	0	0	107.7	N507 L511	N507-F509 VanDerWaalsContact C-N 3.31Å; N507-F509 HydrophobicContact CB-CD2 4.32Å; N507-F509 HydrophobicContact CB-CE2 3.92Å; N507-F509 HydrophobicContact CB-CZ 4.37Å; N507-F509 WeakPolarHBondContact O-CD2 3.47Å; N507-F509 PolarHBondContact O-N 3.26Å; F509-L511 HydrophobicContact CB-CD1 4.21Å; F509-L511 PolarHBondContact O-N 2.71Å
510	N	43.3	Very low	52.9	Low	104 Å²	104	81.6 Å²	81.6	56%	0.556	46%	0.461	S	S	*	.			trans	-70.7	85.6	169.5	-90.5	-42.5	0	0	0	107.9	S486 S508 Q512	S486-N510 PolarHBondContact O-ND2 3.24Å; S508-N510 VanDerWaalsContact C-N 3.32Å; S508-N510 PolarHBondContact O-N 3.07Å; N510-Q512 VanDerWaalsContact C-N 3.32Å; N510-Q512 PolarHBondContact O-N 2.67Å
511	L	50.7	Low	54.8	Low	32 Å²	32	71 Å²	71	17%	0.168	42%	0.419	C	S	.	.			trans	-69.6	96.3	165.6	-87.7	114.5	0	0	0	108.2	A182 A185 F509 L513	A182-L511 HydrophobicContact CB-CB 3.98Å; A182-L511 HydrophobicContact CB-CD1 3.69Å; A182-L511 HydrophobicContact CB-CG 4.42Å; A182-L511 WeakPolarHBondContact O-CD1 3.44Å; A185-L511 HydrophobicContact CB-CD2 3.85Å; F509-L511 HydrophobicContact CB-CD1 4.21Å; F509-L511 PolarHBondContact O-N 2.71Å; L511-L513 VanDerWaalsContact C-N 3.34Å; L511-L513 PolarHBondContact O-N 3.25Å
512	Q	58.4	Low	57.2	Low	71 Å²	71	66.8 Å²	66.8	33%	0.332	39%	0.386	S	S	.	.			trans	-79.7	85	178.1	-169.9	168.8	3.9	0	0	109.3	L195 E197 N510 S514	L195-Q512 HydrophobicContact CD1-CG 3.98Å; E197-Q512 PolarHBondContact OE1-NE2 3.2Å; E197-Q512 PolarHBondContact OE2-NE2 2.86Å; E197-Q512 PolarHBondContact OE2-OE1 2.69Å; N510-Q512 VanDerWaalsContact C-N 3.32Å; N510-Q512 PolarHBondContact O-N 2.67Å; Q512-S514 PolarHBondContact O-N 3.11Å
513	L	70.3	Confident	59.6	Low	31 Å²	31	59.7 Å²	59.7	16%	0.162	36%	0.356	C	S	.	.			trans	-65.1	127.6	174.5	-61	172.2	0	0	0	109.6	K181 L511 L520	K181-L513 HydrophobicContact CB-CD1 3.79Å; K181-L513 HydrophobicContact CD-CD1 3.92Å; L511-L513 VanDerWaalsContact C-N 3.34Å; L511-L513 PolarHBondContact O-N 3.25Å; L513-L520 HydrophobicContact CD2-CD1 3.91Å
514	S	80.3	Confident	62	Low	1 Å²	1	60.5 Å²	60.5	1%	0.007	36%	0.355	C	S	.	.			trans	-110.7	162.3	-179.2	76.3	0	0	0	0	110.6	Q512 W516 D517	Q512-S514 PolarHBondContact O-N 3.11Å; S514-W516 PolarHBondContact O-N 2.99Å; S514-W516 PolarHBondContact OG-N 2.73Å; S514-D517 WeakPolarHBondContact CA-OD2 3.29Å; S514-D517 PolarHBondContact N-OD2 2.91Å; S514-D517 PolarHBondContact O-N 2.92Å; S514-D517 PolarHBondContact OG-OD2 3.5Å
515	V	85.4	Confident	64.2	Low	0 Å²	0	57.8 Å²	57.8	0%	0	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-22.8	171.5	69.9	0	0	0	0	112.6	S465 T471 T473 F474 D517 W518	S465-V515 WeakPolarHBondContact OG-CG2 3.42Å; T471-V515 VanDerWaalsContact OG1-CA 3.29Å; T471-V515 WeakPolarHBondContact OG1-CA 3.3Å; T471-V515 WeakPolarHBondContact OG1-CB 3.25Å; T471-V515 PolarHBondContact OG1-N 3.33Å; T473-V515 HydrophobicContact CG2-CB 4.31Å; T473-V515 HydrophobicContact CG2-CG1 3.68Å; T473-V515 PolarHBondContact OG1-N 3.11Å; T473-V515 VanDerWaalsContact OG1-N 3.1Å; F474-V515 HydrophobicContact CD2-CG2 4.37Å; F474-V515 HydrophobicContact CE2-CB 4.09Å; F474-V515 HydrophobicContact CE2-CG1 3.93Å; F474-V515 HydrophobicContact CE2-CG2 3.79Å; F474-V515 HydrophobicContact CZ-CG1 4.09Å; V515-D517 PolarHBondContact O-N 3.15Å; V515-W518 HydrophobicContact CG2-CH2 4.14Å; V515-W518 HydrophobicContact CG2-CZ3 4.35Å
516	W	88.6	Confident	66.6	Low	4 Å²	4	55.3 Å²	55.3	2%	0.015	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-10.5	-177.3	-44.6	122.2	0	0	0	113.3	P192 V193 Q404 V407 Q408 L462 S514 W518	P192-W516 HydrophobicContact CG-CB 3.69Å; P192-W516 WeakPolarHBondContact CG-O 3.27Å; V193-W516 HydrophobicContact CB-CG 4.29Å; V193-W516 HydrophobicContact CG2-CG 4.47Å; Q404-W516 HydrophobicContact CB-CD2 4.03Å; Q404-W516 HydrophobicContact CB-CE3 3.66Å; Q404-W516 HydrophobicContact CB-CH2 4.06Å; Q404-W516 HydrophobicContact CB-CZ2 4.39Å; Q404-W516 HydrophobicContact CB-CZ3 3.69Å; Q404-W516 HydrophobicContact CG-CD2 4.27Å; Q404-W516 HydrophobicContact CG-CE3 3.46Å; Q404-W516 VanDerWaalsContact CG-CE3 3.46Å; Q404-W516 HydrophobicContact CG-CH2 4.32Å; Q404-W516 HydrophobicContact CG-CZ3 3.5Å; Q404-W516 VanDerWaalsContact CG-CZ3 3.5Å; Q404-W516 WeakPolarHBondContact O-CZ2 3.37Å; V407-W516 HydrophobicContact CB-CH2 3.84Å; V407-W516 HydrophobicContact CB-CZ2 4.28Å; V407-W516 HydrophobicContact CG1-CH2 3.77Å; V407-W516 HydrophobicContact CG1-CZ2 4.17Å; Q408-W516 HydrophobicContact CB-CZ2 4Å; L462-W516 HydrophobicContact CD1-CH2 4.28Å; L462-W516 HydrophobicContact CD1-CZ3 4.12Å; S514-W516 PolarHBondContact O-N 2.99Å; S514-W516 PolarHBondContact OG-N 2.73Å; W516-W518 AromaticContact CE3-CZ2 3.97Å; W516-W518 HydrophobicContact CE3-CZ2 3.97Å; W516-W518 HydrophobicContact CZ3-CZ2 4.07Å; W516-W518 VanDerWaalsContact O-CD1 3.28Å; W516-W518 PolarHBondContact O-N 3.38Å
517	D	82.7	Confident	69.3	Low	9 Å²	9	55.2 Å²	55.2	5%	0.048	30%	0.299	C	S	.	.			trans	-78.5	66	171.3	-57.7	-61.6	0	0	0	109.8	S514 V515 D519 L520	S514-D517 WeakPolarHBondContact CA-OD2 3.29Å; S514-D517 PolarHBondContact N-OD2 2.91Å; S514-D517 PolarHBondContact O-N 2.92Å; S514-D517 PolarHBondContact OG-OD2 3.5Å; V515-D517 PolarHBondContact O-N 3.15Å; D517-D519 PolarHBondContact O-N 2.8Å; D517-L520 HydrophobicContact CB-CD1 3.54Å; D517-L520 HydrophobicContact CB-CG 3.91Å; D517-L520 VanDerWaalsContact O-CB 3.28Å; D517-L520 WeakPolarHBondContact O-CB 3.15Å; D517-L520 WeakPolarHBondContact O-CG 3.46Å; D517-L520 PolarHBondContact O-N 2.89Å
518	W	83.4	Confident	71.7	Confident	16 Å²	16	53.8 Å²	53.8	6%	0.061	29%	0.291	C	S	.	.	G	3₁₀ helix	trans	-61.8	-27.9	-172.3	-66.8	115.6	0	0	0	113.7	F458 A461 L462 V515 W516 L520 R521 Y522 I527 F530	F458-W518 HydrophobicContact CD2-CZ2 4.33Å; F458-W518 AromaticContact CE2-CZ2 3.69Å; F458-W518 HydrophobicContact CE2-CZ2 3.69Å; A461-W518 HydrophobicContact CB-CH2 4.49Å; A461-W518 HydrophobicContact CB-CZ3 4.13Å; L462-W518 HydrophobicContact CB-CH2 4.46Å; L462-W518 HydrophobicContact CD1-CH2 4.23Å; V515-W518 HydrophobicContact CG2-CH2 4.14Å; V515-W518 HydrophobicContact CG2-CZ3 4.35Å; W516-W518 AromaticContact CE3-CZ2 3.97Å; W516-W518 HydrophobicContact CE3-CZ2 3.97Å; W516-W518 HydrophobicContact CZ3-CZ2 4.07Å; W516-W518 VanDerWaalsContact O-CD1 3.28Å; W516-W518 PolarHBondContact O-N 3.38Å; W518-L520 PolarHBondContact O-N 3.23Å; W518-R521 CarbonylContact O-C 3.18Å; W518-R521 PolarHBondContact O-N 2.82Å; W518-Y522 AromaticContact CE3-CD2 3.79Å; W518-Y522 HydrophobicContact CE3-CD2 3.79Å; W518-Y522 AromaticContact CE3-CE2 3.63Å; W518-Y522 HydrophobicContact CE3-CE2 3.63Å; W518-Y522 HydrophobicContact CZ3-CD2 4.45Å; W518-Y522 AromaticContact CZ3-CE2 3.83Å; W518-Y522 HydrophobicContact CZ3-CE2 3.83Å; W518-Y522 PolarHBondContact O-N 3.32Å; W518-I527 HydrophobicContact CB-CD1 4.12Å; W518-I527 HydrophobicContact CB-CG1 4.27Å; W518-F530 HydrophobicContact CB-CE2 4.11Å; W518-F530 AromaticContact CD2-CE2 3.72Å; W518-F530 HydrophobicContact CD2-CE2 3.72Å; W518-F530 HydrophobicContact CD2-CZ 4.37Å; W518-F530 HydrophobicContact CE3-CE2 4.04Å; W518-F530 HydrophobicContact CE3-CZ 4.23Å; W518-F530 AromaticContact CG-CE2 3.75Å; W518-F530 HydrophobicContact CG-CE2 3.75Å
519	D	77.6	Confident	74.2	Confident	66 Å²	66	52.3 Å²	52.3	35%	0.353	27%	0.273	S	S	.	.	G	3₁₀ helix	trans	-65.6	-14.9	176.1	65	-45.6	0	0	0	113.4	R189 D517 I527	R189-D519 IonicContact CZ-OD1 2.68Å; R189-D519 IonicContact CZ-OD2 3.36Å; R189-D519 IonicContact NH1-OD1 3.88Å; R189-D519 PolarHBondContact NH1-OD1 2.82Å; R189-D519 IonicContact NH1-OD2 3.83Å; R189-D519 PolarHBondContact NH1-OD2 3.4Å; R189-D519 IonicContact NH2-OD1 3.7Å; R189-D519 PolarHBondContact NH2-OD1 3.29Å; R189-D519 IonicContact NH2-OD2 2.91Å; R189-D519 PolarHBondContact NH2-OD2 3.23Å; D517-D519 PolarHBondContact O-N 2.8Å; D519-I527 HydrophobicContact CB-CD1 4.15Å
520	L	74.4	Confident	77	Confident	50 Å²	50	45.3 Å²	45.3	26%	0.262	24%	0.242	S	C	.	.	G	3₁₀ helix	trans	-72	-32.7	167.4	-57.4	175.7	0	0	0	111.5	L92 L513 D517 W518	L92-L520 HydrophobicContact CD1-CB 3.89Å; L92-L520 VanDerWaalsContact CD1-O 3.27Å; L92-L520 WeakPolarHBondContact CD1-O 3.2Å; L92-L520 WeakPolarHBondContact CG-O 3.46Å; L92-L520 PolarHBondContact N-O 2.95Å; L92-L520 VanDerWaalsContact N-O 3.17Å; L513-L520 HydrophobicContact CD2-CD1 3.91Å; D517-L520 HydrophobicContact CB-CD1 3.54Å; D517-L520 HydrophobicContact CB-CG 3.91Å; D517-L520 VanDerWaalsContact O-CB 3.28Å; D517-L520 WeakPolarHBondContact O-CB 3.15Å; D517-L520 WeakPolarHBondContact O-CG 3.46Å; D517-L520 PolarHBondContact O-N 2.89Å; W518-L520 PolarHBondContact O-N 3.23Å
521	R	72.7	Confident	79.3	Confident	7 Å²	7	45.3 Å²	45.3	3%	0.026	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.5	-15.2	-168.1	-61.6	177	-167.6	-119	2.3	114.6	P91 L92 S465 D470 T471 W518	P91-R521 WeakPolarHBondContact CB-O 3.31Å; L92-R521 HydrophobicContact CD1-CG 4.43Å; S465-R521 VanDerWaalsContact CA-NH1 3.33Å; S465-R521 VanDerWaalsContact CB-NH1 3.3Å; D470-R521 VanDerWaalsContact CG-NH1 3.33Å; D470-R521 VanDerWaalsContact CG-NH2 3.29Å; D470-R521 IonicContact OD1-CZ 2.67Å; D470-R521 IonicContact OD1-NH1 2.84Å; D470-R521 PolarHBondContact OD1-NH1 2.71Å; D470-R521 IonicContact OD1-NH2 3.85Å; D470-R521 PolarHBondContact OD1-NH2 2.87Å; D470-R521 IonicContact OD2-CZ 2.75Å; D470-R521 IonicContact OD2-NE 3.82Å; D470-R521 PolarHBondContact OD2-NE 3.31Å; D470-R521 IonicContact OD2-NH1 2.71Å; D470-R521 PolarHBondContact OD2-NH1 3.05Å; D470-R521 IonicContact OD2-NH2 3.23Å; D470-R521 PolarHBondContact OD2-NH2 3.47Å; T471-R521 PolarHBondContact OG1-NH2 3.45Å; W518-R521 CarbonylContact O-C 3.18Å; W518-R521 PolarHBondContact O-N 2.82Å
522	Y	77.8	Confident	81.2	Confident	25 Å²	25	45 Å²	45	10%	0.098	24%	0.237	C	C	.	.	S	Bend	trans	-141.1	142.2	-175.1	-62.7	-75.6	0	0	0	109.7	A461 W518 Q526 F530	A461-Y522 WeakPolarHBondContact CA-OH 3.5Å; A461-Y522 HydrophobicContact CB-CE1 4.38Å; A461-Y522 HydrophobicContact CB-CE2 3.79Å; A461-Y522 WeakPolarHBondContact CB-OH 3.24Å; W518-Y522 AromaticContact CE3-CD2 3.79Å; W518-Y522 HydrophobicContact CE3-CD2 3.79Å; W518-Y522 AromaticContact CE3-CE2 3.63Å; W518-Y522 HydrophobicContact CE3-CE2 3.63Å; W518-Y522 HydrophobicContact CZ3-CD2 4.45Å; W518-Y522 AromaticContact CZ3-CE2 3.83Å; W518-Y522 HydrophobicContact CZ3-CE2 3.83Å; W518-Y522 PolarHBondContact O-N 3.32Å; Y522-Q526 HydrophobicContact CD1-CB 4.26Å; Y522-F530 HydrophobicContact CD2-CE2 4.45Å; Y522-F530 AromaticContact CD2-CZ 3.74Å; Y522-F530 HydrophobicContact CD2-CZ 3.74Å; Y522-F530 HydrophobicContact CE2-CZ 4.01Å; Y522-F530 HydrophobicContact CG-CZ 4.07Å
523	S	79	Confident	82.5	Confident	35 Å²	35	46.5 Å²	46.5	25%	0.245	25%	0.253	C	S	.	.			trans	-66	158.2	169.8	63.1	0	0	0	0	110.7	A525 Q526 I527	S523-A525 PolarHBondContact O-N 3.5Å; S523-A525 VanDerWaalsContact O-N 3.17Å; S523-Q526 WeakPolarHBondContact O-CB 3.23Å; S523-Q526 PolarHBondContact O-N 2.79Å; S523-Q526 WeakPolarHBondContact OG-CG 3.37Å; S523-Q526 PolarHBondContact OG-N 2.87Å; S523-Q526 PolarHBondContact OG-OE1 3.04Å; S523-I527 WeakPolarHBondContact O-CG1 3.43Å; S523-I527 PolarHBondContact O-N 3.34Å
524	N	80.8	Confident	83.1	Confident	125 Å²	125	47.1 Å²	47.1	67%	0.668	27%	0.266	S	S	*	.	H	α-helix	trans	-54.3	-37.6	176.4	-72.6	-39.5	0	0	0	112.6	Q526 I527 L528	N524-Q526 VanDerWaalsContact C-N 3.35Å; N524-Q526 PolarHBondContact O-N 3.47Å; N524-I527 PolarHBondContact O-N 3.05Å; N524-L528 WeakPolarHBondContact O-CG 3.23Å; N524-L528 PolarHBondContact O-N 2.95Å
525	A	78.7	Confident	83.5	Confident	66 Å²	66	50.2 Å²	50.2	55%	0.545	28%	0.278	S	S	.	.	H	α-helix	trans	-63.4	-38.6	176.5	0	0	0	0	0	112.7	S523	S523-A525 PolarHBondContact O-N 3.5Å; S523-A525 VanDerWaalsContact O-N 3.17Å
526	Q	82.3	Confident	83.4	Confident	65 Å²	65	53.4 Å²	53.4	30%	0.304	30%	0.296	S	S	.	.	H	α-helix	trans	-72.3	-37.8	175.2	-71.7	166.3	-49.2	0	0	111.8	Y522 S523 N524 L528 Q529	Y522-Q526 HydrophobicContact CD1-CB 4.26Å; S523-Q526 WeakPolarHBondContact O-CB 3.23Å; S523-Q526 PolarHBondContact O-N 2.79Å; S523-Q526 WeakPolarHBondContact OG-CG 3.37Å; S523-Q526 PolarHBondContact OG-N 2.87Å; S523-Q526 PolarHBondContact OG-OE1 3.04Å; N524-Q526 VanDerWaalsContact C-N 3.35Å; N524-Q526 PolarHBondContact O-N 3.47Å; Q526-L528 VanDerWaalsContact C-N 3.29Å; Q526-L528 PolarHBondContact O-N 3.29Å; Q526-Q529 VanDerWaalsContact O-CB 3.3Å; Q526-Q529 WeakPolarHBondContact O-CB 3.21Å; Q526-Q529 PolarHBondContact O-N 3.42Å
527	I	86	Confident	82.7	Confident	46 Å²	46	56.9 Å²	56.9	24%	0.236	32%	0.319	C	S	.	.	H	α-helix	trans	-63.4	-37.2	176.5	-65.8	170.6	0	0	0	110.7	W518 D519 S523 N524 Q529 F530	W518-I527 HydrophobicContact CB-CD1 4.12Å; W518-I527 HydrophobicContact CB-CG1 4.27Å; D519-I527 HydrophobicContact CB-CD1 4.15Å; S523-I527 WeakPolarHBondContact O-CG1 3.43Å; S523-I527 PolarHBondContact O-N 3.34Å; N524-I527 PolarHBondContact O-N 3.05Å; I527-Q529 PolarHBondContact O-N 3.29Å; I527-F530 HydrophobicContact CG2-CD2 4.38Å; I527-F530 WeakPolarHBondContact O-CB 3.33Å; I527-F530 WeakPolarHBondContact O-CG 3.49Å; I527-F530 PolarHBondContact O-N 3.46Å
528	L	86.3	Confident	82	Confident	117 Å²	117	64.4 Å²	64.4	61%	0.613	35%	0.354	S	S	*	.	H	α-helix	trans	-61.2	-28.5	174	-72.4	171.8	0	0	0	112.7	N524 Q526 F530 Q531	N524-L528 WeakPolarHBondContact O-CG 3.23Å; N524-L528 PolarHBondContact O-N 2.95Å; Q526-L528 VanDerWaalsContact C-N 3.29Å; Q526-L528 PolarHBondContact O-N 3.29Å; L528-F530 PolarHBondContact O-N 3.42Å; L528-Q531 PolarHBondContact O-N 2.93Å
529	Q	86.9	Confident	81	Confident	72 Å²	72	68.7 Å²	68.7	34%	0.336	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-13.6	174.8	-59.7	176.2	2.7	0	0	112.8	S455 F457 Q526 I527 Q531	S455-Q529 WeakPolarHBondContact CB-O 3.32Å; S455-Q529 PolarHBondContact OG-O 2.95Å; F457-Q529 HydrophobicContact CB-CB 4.43Å; F457-Q529 HydrophobicContact CD2-CB 3.83Å; F457-Q529 HydrophobicContact CE2-CB 4.23Å; F457-Q529 HydrophobicContact CG-CB 4.27Å; Q526-Q529 VanDerWaalsContact O-CB 3.3Å; Q526-Q529 WeakPolarHBondContact O-CB 3.21Å; Q526-Q529 PolarHBondContact O-N 3.42Å; I527-Q529 PolarHBondContact O-N 3.29Å; Q529-Q531 PolarHBondContact O-N 3.23Å
530	F	91.9	Very high	80	Confident	9 Å²	9	67.5 Å²	67.5	4%	0.039	37%	0.37	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-22.9	174.2	-67	-4.6	0	0	0	112.1	L400 F454 S455 F457 F458 A461 W518 Y522 I527 L528	L400-F530 HydrophobicContact CD2-CB 4.17Å; F454-F530 CarbonylContact C-O 3.56Å; F454-F530 WeakPolarHBondContact CA-O 3.39Å; S455-F530 PolarHBondContact N-O 3.11Å; F457-F530 HydrophobicContact CB-CD1 4.39Å; F458-F530 HydrophobicContact CB-CB 3.89Å; F458-F530 HydrophobicContact CB-CD1 4.07Å; F458-F530 HydrophobicContact CB-CG 3.94Å; F458-F530 HydrophobicContact CD2-CB 4.37Å; F458-F530 AromaticContact CD2-CD2 3.84Å; F458-F530 HydrophobicContact CD2-CD2 3.84Å; F458-F530 HydrophobicContact CD2-CE2 4.24Å; F458-F530 HydrophobicContact CD2-CG 4.08Å; F458-F530 HydrophobicContact CG-CB 4.49Å; F458-F530 HydrophobicContact CG-CG 4.48Å; A461-F530 HydrophobicContact CB-CE1 3.73Å; A461-F530 HydrophobicContact CB-CZ 3.61Å; W518-F530 HydrophobicContact CB-CE2 4.11Å; W518-F530 AromaticContact CD2-CE2 3.72Å; W518-F530 HydrophobicContact CD2-CE2 3.72Å; W518-F530 HydrophobicContact CD2-CZ 4.37Å; W518-F530 HydrophobicContact CE3-CE2 4.04Å; W518-F530 HydrophobicContact CE3-CZ 4.23Å; W518-F530 AromaticContact CG-CE2 3.75Å; W518-F530 HydrophobicContact CG-CE2 3.75Å; Y522-F530 HydrophobicContact CD2-CE2 4.45Å; Y522-F530 AromaticContact CD2-CZ 3.74Å; Y522-F530 HydrophobicContact CD2-CZ 3.74Å; Y522-F530 HydrophobicContact CE2-CZ 4.01Å; Y522-F530 HydrophobicContact CG-CZ 4.07Å; I527-F530 HydrophobicContact CG2-CD2 4.38Å; I527-F530 WeakPolarHBondContact O-CB 3.33Å; I527-F530 WeakPolarHBondContact O-CG 3.49Å; I527-F530 PolarHBondContact O-N 3.46Å; L528-F530 PolarHBondContact O-N 3.42Å
531	Q	91.2	Very high	78.9	Confident	104 Å²	104	67.3 Å²	67.3	49%	0.486	37%	0.372	S	S	.	.	B	Isolated β-bridge	trans	-80.6	139.6	175.8	-68.1	177.7	-8	0	0	110.7	L400 E453 L528 Q529	L400-Q531 HydrophobicContact CD1-CG 3.72Å; E453-Q531 CarbonylContact O-C 3.55Å; E453-Q531 WeakPolarHBondContact O-CA 3.43Å; L528-Q531 PolarHBondContact O-N 2.93Å; Q529-Q531 PolarHBondContact O-N 3.23Å
532	N	90.6	Very high	77.5	Confident	27 Å²	27	74.5 Å²	74.5	14%	0.144	41%	0.411	C	S	.	.			trans	-90.2	114.8	173.3	174.8	15.9	0	0	0	109.2	P449 F452 E453 G534 Y535	P449-N532 PolarHBondContact O-ND2 2.96Å; F452-N532 WeakPolarHBondContact O-CB 3.44Å; F452-N532 PolarHBondContact O-ND2 3.48Å; E453-N532 WeakPolarHBondContact O-CB 3.36Å; E453-N532 PolarHBondContact O-N 3.27Å; N532-G534 PolarHBondContact O-N 3.34Å; N532-G534 PolarHBondContact OD1-N 2.87Å; N532-Y535 VanDerWaalsContact O-CB 3.3Å; N532-Y535 WeakPolarHBondContact O-CB 3.36Å; N532-Y535 PolarHBondContact O-N 3.19Å; N532-Y535 VanDerWaalsContact O-N 3.16Å
533	P	85.3	Confident	76	Confident	102 Å²	102	76 Å²	76	66%	0.662	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.9	-15.3	-180	27.7	-33.6	0	0	0	113.5	Y535 P653	P533-Y535 VanDerWaalsContact C-N 3.32Å; P533-P653 VanDerWaalsContact CG-O 3.25Å; P533-P653 WeakPolarHBondContact CG-O 3.43Å
534	G	82.9	Confident	74.6	Confident	43 Å²	43	77.5 Å²	77.5	44%	0.443	43%	0.425	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.3	-2.7	175	0	0	0	0	0	114.4	A450 N532 D536	A450-G534 WeakPolarHBondContact CA-O 3.44Å; N532-G534 PolarHBondContact O-N 3.34Å; N532-G534 PolarHBondContact OD1-N 2.87Å; G534-D536 PolarHBondContact O-N 3.29Å
535	Y	88.6	Confident	73	Confident	66 Å²	66	78 Å²	78	26%	0.259	43%	0.428	S	S	.	.			trans	-66.7	127.6	179.7	177.4	-119.4	0	0	0	111.3	A450 E453 N532 P533 P537	A450-Y535 VanDerWaalsContact O-CD2 3.29Å; A450-Y535 WeakPolarHBondContact O-CD2 3.07Å; E453-Y535 VanDerWaalsContact CA-CG 3.49Å; E453-Y535 HydrophobicContact CB-CD1 3.93Å; E453-Y535 HydrophobicContact CB-CD2 4.18Å; E453-Y535 HydrophobicContact CB-CE1 3.92Å; E453-Y535 HydrophobicContact CB-CE2 4.18Å; E453-Y535 HydrophobicContact CB-CG 4.06Å; E453-Y535 HydrophobicContact CG-CD1 3.83Å; E453-Y535 HydrophobicContact CG-CE1 3.9Å; E453-Y535 HydrophobicContact CG-CG 4.37Å; N532-Y535 VanDerWaalsContact O-CB 3.3Å; N532-Y535 WeakPolarHBondContact O-CB 3.36Å; N532-Y535 PolarHBondContact O-N 3.19Å; N532-Y535 VanDerWaalsContact O-N 3.16Å; P533-Y535 VanDerWaalsContact C-N 3.32Å; Y535-P537 HydrophobicContact CE1-CB 4.05Å
536	D	83.8	Confident	71.5	Confident	68 Å²	68	79.4 Å²	79.4	36%	0.364	43%	0.431	S	S	.	.			trans	-115.4	105.3	176	-178.4	4.6	0	0	0	109.7	A450 G534 E538 H539	A450-D536 PolarHBondContact O-N 3.02Å; G534-D536 PolarHBondContact O-N 3.29Å; D536-E538 PolarHBondContact O-N 3.31Å; D536-E538 WeakPolarHBondContact OD1-CB 3.32Å; D536-E538 PolarHBondContact OD1-N 3.18Å; D536-H539 HydrophobicContact CB-CB 3.98Å; D536-H539 WeakPolarHBondContact O-CB 3.38Å; D536-H539 PolarHBondContact O-N 3.44Å
537	P	74.9	Confident	70	Confident	77 Å²	77	84.5 Å²	84.5	50%	0.5	45%	0.447	S	S	.	.	G	3₁₀ helix	trans	-65.6	-22.4	-179.8	27.1	-33.3	0	0	0	113.1	Y535 C540	Y535-P537 HydrophobicContact CE1-CB 4.05Å; P537-C540 WeakPolarHBondContact O-CB 3.34Å
538	E	66.9	Low	67.9	Low	167 Å²	167	88.4 Å²	88.4	78%	0.78	48%	0.476	S	S	*	.	G	3₁₀ helix	trans	-85	-13.5	180	-59.6	-68.8	154.2	0	0	112.3	D536 C540	D536-E538 PolarHBondContact O-N 3.31Å; D536-E538 WeakPolarHBondContact OD1-CB 3.32Å; D536-E538 PolarHBondContact OD1-N 3.18Å; E538-C540 PolarHBondContact O-N 3.35Å; E538-C540 VanDerWaalsContact O-N 3.12Å
539	H	63.4	Low	66	Low	106 Å²	106	89.5 Å²	89.5	49%	0.491	48%	0.477	S	S	.	.	G	3₁₀ helix	trans	-68.6	-5.8	173.3	-157.2	75.2	0	0	0	112.7	D536 P541	D536-H539 HydrophobicContact CB-CB 3.98Å; D536-H539 WeakPolarHBondContact O-CB 3.38Å; D536-H539 PolarHBondContact O-N 3.44Å; H539-P541 VanDerWaalsContact O-CD 3.26Å; H539-P541 WeakPolarHBondContact O-CD 3.42Å
540	C	55.8	Low	63.8	Low	41 Å²	41	91.6 Å²	91.6	28%	0.277	50%	0.497	S	S	.	.	S	Bend	trans	-85.9	105.7	177.8	-157.5	0	0	0	0	110.1	P395 P537 E538 D542	P395-C540 WeakPolarHBondContact CB-SG 3.49Å; P395-C540 WeakPolarHBondContact CG-SG 3.07Å; P537-C540 WeakPolarHBondContact O-CB 3.34Å; E538-C540 PolarHBondContact O-N 3.35Å; E538-C540 VanDerWaalsContact O-N 3.12Å; C540-D542 PolarHBondContact O-N 3.29Å
541	P	50.8	Low	61.3	Low	45 Å²	45	95.6 Å²	95.6	29%	0.292	53%	0.526	S	S	.	.			trans	-66.4	132.8	-173	26.8	-33.7	0	0	0	110.9	H539 S543 P620	H539-P541 VanDerWaalsContact O-CD 3.26Å; H539-P541 WeakPolarHBondContact O-CD 3.42Å; P541-S543 WeakPolarHBondContact CB-OG 3.45Å; P541-S543 PolarHBondContact O-N 3.17Å; P541-S543 PolarHBondContact O-OG 3.39Å; P541-P620 HydrophobicContact CB-CB 4.18Å; P541-P620 HydrophobicContact CG-CB 3.9Å
542	D	43.1	Very low	58.9	Low	158 Å²	158	99.6 Å²	99.6	85%	0.845	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.6	-1.9	176.9	-72.7	-44.7	0	0	0	115.5	C540 W544	C540-D542 PolarHBondContact O-N 3.29Å; D542-W544 PolarHBondContact O-N 3.32Å
543	S	46.1	Very low	56.7	Low	56 Å²	56	102.8 Å²	102.8	39%	0.392	56%	0.558	S	S	.	*	T	Hydrogen-bonded Turn	trans	-77.2	9.4	-179.1	48.1	0	0	0	0	115.6	P541 L545 P620	P541-S543 WeakPolarHBondContact CB-OG 3.45Å; P541-S543 PolarHBondContact O-N 3.17Å; P541-S543 PolarHBondContact O-OG 3.39Å; S543-L545 PolarHBondContact O-N 3.3Å; S543-P620 WeakPolarHBondContact OG-CB 3.45Å; S543-P620 WeakPolarHBondContact OG-CG 3.47Å
544	W	50.3	Low	54.7	Low	67 Å²	67	105.1 Å²	105.1	25%	0.254	56%	0.563	S	S	.	*			trans	-64.3	5.8	167.5	-81.1	83.6	0	0	0	114.1	P264 S393 A394 P395 D542	P264-W544 HydrophobicContact CG-CE3 3.66Å; P264-W544 HydrophobicContact CG-CZ3 3.57Å; S393-W544 WeakPolarHBondContact O-CH2 3.26Å; S393-W544 WeakPolarHBondContact O-CZ2 3.5Å; A394-W544 HydrophobicContact CB-CH2 4.12Å; A394-W544 HydrophobicContact CB-CZ3 4.27Å; P395-W544 HydrophobicContact CG-CZ2 3.84Å; D542-W544 PolarHBondContact O-N 3.32Å
545	L	48.5	Very low	52.9	Low	137 Å²	137	108 Å²	108	72%	0.717	57%	0.574	S	S	*	*	P	Polyproline II helix	trans	-63	129	-179.9	-68.2	169.2	0	0	0	111.2	S543 R547	S543-L545 PolarHBondContact O-N 3.3Å; L545-R547 PolarHBondContact O-N 3.11Å
546	P	47.1	Very low	51.2	Low	94 Å²	94	107 Å²	107	61%	0.61	58%	0.583	S	S	*	*	P	Polyproline II helix	trans	-54.6	128.8	174.4	-21.2	29.7	0	0	0	110.3
547	R	50.7	Low	50	Low	172 Å²	172	109.3 Å²	109.3	65%	0.649	60%	0.602	S	S	*	*	P	Polyproline II helix	trans	-60.7	136.1	165	-80.4	-173.7	-179.6	179.2	2.8	108	L545 Q549	L545-R547 PolarHBondContact O-N 3.11Å; R547-Q549 PolarHBondContact O-N 3.29Å
548	P	40.8	Very low	49.4	Very low	128 Å²	128	107.2 Å²	107.2	83%	0.831	59%	0.589	S	S	*	*			trans	-55.9	114.6	174.4	-20.2	29.6	0	0	0	109.4
549	Q	47.5	Very low	49.4	Very low	140 Å²	140	103.2 Å²	103.2	65%	0.654	58%	0.579	S	S	*	*			trans	-69	135	176.9	-68.3	-176.8	-3.6	0	0	109.1	R547 S551	R547-Q549 PolarHBondContact O-N 3.29Å; Q549-S551 PolarHBondContact O-N 3.36Å; Q549-S551 VanDerWaalsContact O-N 3.08Å
550	P	40.7	Very low	50	Low	116 Å²	116	99 Å²	99	75%	0.753	56%	0.561	S	S	*	*			trans	-62.3	111.7	156.4	-11.1	25.4	0	0	0	107.2	F552	P550-F552 PolarHBondContact O-N 2.7Å
551	S	38.9	Very low	51.4	Low	93 Å²	93	97.5 Å²	97.5	65%	0.65	55%	0.551	S	S	*	*	S	Bend	trans	-57.6	132.8	163.9	37.5	0	0	0	0	107.7	Q549	Q549-S551 PolarHBondContact O-N 3.36Å; Q549-S551 VanDerWaalsContact O-N 3.08Å
552	F	41	Very low	52.9	Low	189 Å²	189	96.7 Å²	96.7	83%	0.829	54%	0.542	S	S	*	.			trans	86.2	81.2	177.1	-49.4	-78.4	0	0	0	116.9	P550	P550-F552 PolarHBondContact O-N 2.7Å
553	M	44.4	Very low	55	Low	93 Å²	93	90.8 Å²	90.8	46%	0.458	51%	0.51	S	S	.	.			trans	-87	113.2	148.9	-68	-86.9	-106.3	0	0	108.3
554	I	43.3	Very low	56.9	Low	151 Å²	151	88.1 Å²	88.1	77%	0.774	49%	0.492	S	S	*	.			trans	-73	132.7	174.7	-61	173.3	0	0	0	107.6	G556	I554-G556 PolarHBondContact O-N 3.1Å
555	P	43.7	Very low	58.5	Low	104 Å²	104	86 Å²	86	68%	0.675	49%	0.488	S	S	*	.			trans	-63.2	123.4	178	23.9	-28.8	0	0	0	110.5
556	G	52.7	Low	59.8	Low	44 Å²	44	85.2 Å²	85.2	45%	0.454	48%	0.475	S	S	.	.			trans	-149.1	169.3	175.6	0	0	0	0	0	110.2	I554	I554-G556 PolarHBondContact O-N 3.1Å
557	P	59.7	Low	61.2	Low	117 Å²	117	81.5 Å²	81.5	76%	0.76	45%	0.453	S	S	*	.	S	Bend	trans	-56	154.2	171.8	26.1	-33.8	0	0	0	110.6	S559	P557-S559 PolarHBondContact O-N 3.1Å
558	P	63.3	Low	62.4	Low	33 Å²	33	75.4 Å²	75.4	21%	0.214	44%	0.44	C	S	.	.			trans	-62.6	132.8	-178.7	30.8	-30.8	0	0	0	108.3	Q294 S298 V300 S560 V561 L575	Q294-P558 HydrophobicContact CG-CB 4.31Å; Q294-P558 VanDerWaalsContact NE2-CD 3.31Å; S298-P558 CarbonylContact O-C 3.18Å; S298-P558 VanDerWaalsContact O-CA 3.23Å; S298-P558 WeakPolarHBondContact O-CA 3.34Å; S298-P558 WeakPolarHBondContact O-CB 3.21Å; V300-P558 HydrophobicContact CG2-CB 4.44Å; P558-S560 VanDerWaalsContact C-N 3.26Å; P558-S560 PolarHBondContact O-N 3.48Å; P558-V561 HydrophobicContact CB-CG2 3.85Å; P558-V561 HydrophobicContact CG-CG2 3.58Å; P558-L575 HydrophobicContact CB-CD1 4.44Å; P558-L575 HydrophobicContact CG-CD1 3.77Å; P558-L575 HydrophobicContact CG-CG 4.43Å
559	S	65.1	Low	64.3	Low	83 Å²	83	70.1 Å²	70.1	58%	0.58	41%	0.405	S	S	*	.	S	Bend	trans	-66.6	-33.4	176	45	0	0	0	0	111.3	S298 D299 P557	S298-S559 WeakPolarHBondContact CB-OG 3.39Å; S298-S559 PolarHBondContact O-N 3.19Å; S298-S559 PolarHBondContact O-OG 3Å; S298-S559 VanDerWaalsContact O-OG 3.11Å; S298-S559 PolarHBondContact OG-OG 2.72Å; D299-S559 PolarHBondContact OD1-OG 3.24Å; P557-S559 PolarHBondContact O-N 3.1Å
560	S	77.5	Confident	65.9	Low	17 Å²	17	66.6 Å²	66.6	12%	0.119	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	141.2	177	78.4	0	0	0	0	112.3	S298 D299 V300 P558 W562	S298-S560 PolarHBondContact O-N 3.31Å; D299-S560 WeakPolarHBondContact CA-O 3.47Å; D299-S560 VanDerWaalsContact CG-OG 3.24Å; D299-S560 PolarHBondContact OD1-OG 3.41Å; V300-S560 PolarHBondContact N-O 3.28Å; P558-S560 VanDerWaalsContact C-N 3.26Å; P558-S560 PolarHBondContact O-N 3.48Å; S560-W562 PolarHBondContact OG-NE1 3.36Å
561	V	83.5	Confident	67.8	Low	10 Å²	10	65.4 Å²	65.4	6%	0.061	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	130.8	179.3	-174.1	0	0	0	0	108	V300 P558 L572 L575	V300-V561 CarbonylContact O-C 3.6Å; V300-V561 WeakPolarHBondContact O-CA 3.38Å; P558-V561 HydrophobicContact CB-CG2 3.85Å; P558-V561 HydrophobicContact CG-CG2 3.58Å; V561-L572 HydrophobicContact CB-CB 4.24Å; V561-L572 HydrophobicContact CG1-CB 3.96Å; V561-L572 HydrophobicContact CG1-CD1 4.21Å; V561-L572 PolarHBondContact O-N 3Å; V561-L575 HydrophobicContact CG1-CD2 3.68Å; V561-L575 HydrophobicContact CG1-CG 3.95Å; V561-L575 HydrophobicContact CG2-CD1 4.43Å; V561-L575 HydrophobicContact CG2-CD2 4.11Å; V561-L575 HydrophobicContact CG2-CG 3.78Å
562	W	84.3	Confident	69.6	Low	28 Å²	28	62.9 Å²	62.9	11%	0.106	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	143.1	-174.7	-57.7	83.1	0	0	0	110.8	V300 V301 L302 S560 L569 T570 P571 P610 W613	V300-W562 PolarHBondContact O-N 3.2Å; V301-W562 CarbonylContact C-O 3.56Å; V301-W562 WeakPolarHBondContact CA-O 3.37Å; V301-W562 HydrophobicContact CG1-CB 4.49Å; V301-W562 HydrophobicContact CG2-CB 4.35Å; L302-W562 PolarHBondContact N-O 3.06Å; S560-W562 PolarHBondContact OG-NE1 3.36Å; W562-L569 HydrophobicContact CB-CD2 4.1Å; W562-L569 HydrophobicContact CE3-CB 4.16Å; W562-T570 WeakPolarHBondContact CA-O 3.34Å; W562-P571 HydrophobicContact CE3-CB 4.04Å; W562-P571 HydrophobicContact CH2-CB 3.81Å; W562-P571 HydrophobicContact CH2-CG 4.35Å; W562-P571 HydrophobicContact CZ2-CB 4.41Å; W562-P571 HydrophobicContact CZ3-CB 3.65Å; W562-P571 HydrophobicContact CZ3-CG 4Å; W562-P610 HydrophobicContact CE3-CG 4.42Å; W562-P610 HydrophobicContact CH2-CB 4.18Å; W562-P610 HydrophobicContact CH2-CG 3.14Å; W562-P610 HydrophobicContact CZ2-CB 4.37Å; W562-P610 HydrophobicContact CZ2-CG 3.41Å; W562-P610 VanDerWaalsContact CZ2-CG 3.41Å; W562-P610 HydrophobicContact CZ3-CG 3.67Å; W562-W613 AromaticContact CD1-CH2 3.69Å; W562-W613 AromaticContact CD1-CZ2 3.72Å; W562-W613 AromaticContact CD2-CH2 3.81Å; W562-W613 HydrophobicContact CD2-CH2 3.81Å; W562-W613 HydrophobicContact CD2-CZ2 4.07Å; W562-W613 AromaticContact CE2-CH2 3.72Å; W562-W613 AromaticContact CE2-CZ2 3.47Å; W562-W613 VanDerWaalsContact CE2-CZ2 3.47Å; W562-W613 AromaticContact CG-CH2 3.84Å; W562-W613 HydrophobicContact CG-CH2 3.84Å; W562-W613 HydrophobicContact CG-CZ2 4.24Å; W562-W613 HydrophobicContact CZ2-CH2 4.41Å; W562-W613 AromaticContact CZ2-CZ2 3.95Å; W562-W613 HydrophobicContact CZ2-CZ2 3.95Å; W562-W613 AromaticContact NE1-CH2 3.62Å; W562-W613 AromaticContact NE1-CZ2 3.22Å
563	L	85.8	Confident	70.8	Confident	34 Å²	34	61.9 Å²	61.9	18%	0.178	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	126	165.1	175.9	66.8	0	0	0	108.4	L302 D304 L569 T570 L572	L302-L563 HydrophobicContact CB-CD1 4.31Å; L302-L563 CarbonylContact O-C 3.6Å; L302-L563 WeakPolarHBondContact O-CA 3.28Å; D304-L563 HydrophobicContact CB-CD1 4.28Å; L563-L569 WeakPolarHBondContact O-CA 3.29Å; L563-T570 PolarHBondContact N-O 2.99Å; L563-T570 PolarHBondContact O-N 3.48Å; L563-T570 PolarHBondContact O-OG1 3.45Å; L563-L572 HydrophobicContact CB-CD1 3.87Å; L563-L572 HydrophobicContact CB-CD2 4.3Å; L563-L572 HydrophobicContact CB-CG 3.99Å
564	F	85.9	Confident	71.8	Confident	1 Å²	1	63.1 Å²	63.1	0%	0.004	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	106.7	171.9	-176.2	-116.6	0	0	0	110.2	V301 L302 V303 D304 K356 D359 L363 A568 L569 W607	V301-F564 HydrophobicContact CG1-CB 3.93Å; L302-F564 PolarHBondContact O-N 2.71Å; V303-F564 HydrophobicContact CG1-CD1 4.09Å; V303-F564 HydrophobicContact CG2-CB 4.23Å; V303-F564 HydrophobicContact CG2-CD1 4.29Å; D304-F564 PolarHBondContact N-O 3.38Å; K356-F564 HydrophobicContact CD-CE1 4.02Å; K356-F564 VanDerWaalsContact NZ-CD1 3.31Å; K356-F564 VanDerWaalsContact NZ-CE1 3.31Å; D359-F564 HydrophobicContact CB-CE1 3.72Å; D359-F564 HydrophobicContact CB-CZ 3.58Å; L363-F564 HydrophobicContact CD1-CB 4.31Å; L363-F564 HydrophobicContact CD1-CD1 3.92Å; L363-F564 HydrophobicContact CD1-CD2 4.28Å; L363-F564 HydrophobicContact CD1-CE1 4.33Å; L363-F564 HydrophobicContact CD1-CG 3.9Å; F564-A568 WeakPolarHBondContact CA-O 3.37Å; F564-A568 WeakPolarHBondContact CD2-O 3.19Å; F564-L569 HydrophobicContact CB-CD2 3.79Å; F564-L569 HydrophobicContact CD2-CD2 3.79Å; F564-L569 HydrophobicContact CD2-CG 3.92Å; F564-L569 HydrophobicContact CG-CD2 4.21Å; F564-W607 AromaticContact CE2-CE3 3.67Å; F564-W607 HydrophobicContact CE2-CE3 3.67Å; F564-W607 AromaticContact CE2-CZ3 3.74Å; F564-W607 HydrophobicContact CE2-CZ3 3.74Å; F564-W607 HydrophobicContact CZ-CE3 4.08Å; F564-W607 HydrophobicContact CZ-CH2 4.35Å; F564-W607 AromaticContact CZ-CZ3 3.68Å; F564-W607 HydrophobicContact CZ-CZ3 3.68Å
565	S	83.5	Confident	73	Confident	23 Å²	23	56.1 Å²	56.1	16%	0.161	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147	143.6	179	-178	0	0	0	0	111	G567 A568	S565-G567 PolarHBondContact O-N 2.79Å; S565-A568 PolarHBondContact N-O 3.03Å; S565-A568 VanDerWaalsContact N-O 3.07Å; S565-A568 PolarHBondContact O-N 3.44Å
566	R	77.6	Confident	74	Confident	120 Å²	120	51.3 Å²	51.3	45%	0.453	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.3	36.8	-175.6	-59.8	-174.6	175.9	175.7	3.3	113.8	D307 E308 A568 S589	D307-R566 IonicContact OD1-CZ 3.56Å; D307-R566 IonicContact OD1-NE 3.49Å; D307-R566 IonicContact OD1-NH2 3.48Å; D307-R566 PolarHBondContact OD1-NH2 3.37Å; D307-R566 WeakPolarHBondContact OD2-CG 3.14Å; D307-R566 IonicContact OD2-CZ 2.63Å; D307-R566 VanDerWaalsContact OD2-CZ 3.23Å; D307-R566 IonicContact OD2-NE 3.48Å; D307-R566 PolarHBondContact OD2-NE 3.21Å; D307-R566 IonicContact OD2-NH2 3.59Å; D307-R566 PolarHBondContact OD2-NH2 3.48Å; D307-R566 VanDerWaalsContact OD2-NH2 3.13Å; E308-R566 HydrophobicContact CG-CG 4.35Å; E308-R566 WeakPolarHBondContact OE1-CA 3.21Å; E308-R566 PolarHBondContact OE1-N 3.01Å; R566-A568 VanDerWaalsContact C-N 3.28Å; R566-A568 PolarHBondContact O-N 3.44Å; R566-S589 VanDerWaalsContact CZ-OG 3.28Å; R566-S589 PolarHBondContact NH1-O 3.41Å; R566-S589 PolarHBondContact NH1-OG 3.23Å; R566-S589 PolarHBondContact NH2-OG 3.21Å
567	G	74.9	Confident	74.1	Confident	15 Å²	15	52.7 Å²	52.7	16%	0.155	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	66.1	25.8	-177.5	0	0	0	0	0	115	E308 S565 W607	E308-G567 PolarHBondContact OE1-N 3.08Å; S565-G567 PolarHBondContact O-N 2.79Å; G567-W607 WeakPolarHBondContact O-CZ3 3.42Å
568	A	77.4	Confident	73.9	Confident	45 Å²	45	49.6 Å²	49.6	37%	0.372	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	149.4	174.1	0	0	0	0	0	110.9	F564 S565 R566	F564-A568 WeakPolarHBondContact CA-O 3.37Å; F564-A568 WeakPolarHBondContact CD2-O 3.19Å; S565-A568 PolarHBondContact N-O 3.03Å; S565-A568 VanDerWaalsContact N-O 3.07Å; S565-A568 PolarHBondContact O-N 3.44Å; R566-A568 VanDerWaalsContact C-N 3.28Å; R566-A568 PolarHBondContact O-N 3.44Å
569	L	79.3	Confident	73	Confident	16 Å²	16	55.3 Å²	55.3	8%	0.084	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	118.1	173.9	-74.1	164.6	0	0	0	110.4	V301 L363 W562 L563 F564 L609 W613	V301-L569 HydrophobicContact CG1-CD2 3.96Å; L363-L569 HydrophobicContact CD2-CD1 4.11Å; L363-L569 HydrophobicContact CD2-CD2 4.31Å; W562-L569 HydrophobicContact CB-CD2 4.1Å; W562-L569 HydrophobicContact CE3-CB 4.16Å; L563-L569 WeakPolarHBondContact O-CA 3.29Å; F564-L569 HydrophobicContact CB-CD2 3.79Å; F564-L569 HydrophobicContact CD2-CD2 3.79Å; F564-L569 HydrophobicContact CD2-CG 3.92Å; F564-L569 HydrophobicContact CG-CD2 4.21Å; L569-L609 HydrophobicContact CD1-CD2 3.69Å; L569-W613 HydrophobicContact CD1-CH2 4.29Å; L569-W613 HydrophobicContact CD1-CZ3 3.62Å
570	T	82.5	Confident	71.6	Confident	67 Å²	67	58.8 Å²	58.8	41%	0.411	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	130.8	176.7	55.3	0	0	0	0	110.4	W562 L563	W562-T570 WeakPolarHBondContact CA-O 3.34Å; L563-T570 PolarHBondContact N-O 2.99Å; L563-T570 PolarHBondContact O-N 3.48Å; L563-T570 PolarHBondContact O-OG1 3.45Å
571	P	80.2	Confident	69.6	Low	90 Å²	90	61.1 Å²	61.1	58%	0.584	33%	0.325	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.6	141.4	177.9	27.6	-31.2	0	0	0	110.5	W562	W562-P571 HydrophobicContact CE3-CB 4.04Å; W562-P571 HydrophobicContact CH2-CB 3.81Å; W562-P571 HydrophobicContact CH2-CG 4.35Å; W562-P571 HydrophobicContact CZ2-CB 4.41Å; W562-P571 HydrophobicContact CZ3-CB 3.65Å; W562-P571 HydrophobicContact CZ3-CG 4Å
572	L	75.9	Confident	67.2	Low	40 Å²	40	66 Å²	66	21%	0.209	36%	0.357	C	S	.	.			trans	-112.8	137.1	174.3	-69.9	178.3	0	0	0	110.4	L302 V561 L563 Q574	L302-L572 HydrophobicContact CD1-CD1 3.95Å; V561-L572 HydrophobicContact CB-CB 4.24Å; V561-L572 HydrophobicContact CG1-CB 3.96Å; V561-L572 HydrophobicContact CG1-CD1 4.21Å; V561-L572 PolarHBondContact O-N 3Å; L563-L572 HydrophobicContact CB-CD1 3.87Å; L563-L572 HydrophobicContact CB-CD2 4.3Å; L563-L572 HydrophobicContact CB-CG 3.99Å; L572-Q574 VanDerWaalsContact C-N 3.32Å
573	N	66.7	Low	65.1	Low	169 Å²	169	67.4 Å²	67.4	90%	0.904	37%	0.371	S	S	*	.	S	Bend	trans	-76.3	-21.8	176.4	-67.8	-20.1	0	0	0	112.7
574	Q	66.1	Low	63	Low	119 Å²	119	71 Å²	71	56%	0.556	39%	0.39	S	S	*	.			trans	-143.6	143.5	179.9	-65.6	-177.9	-3.1	0	0	109.9	L572 C576	L572-Q574 VanDerWaalsContact C-N 3.32Å; Q574-C576 PolarHBondContact O-N 3.25Å
575	L	67.1	Low	61.2	Low	3 Å²	3	75.9 Å²	75.9	2%	0.016	42%	0.415	C	S	.	.	S	Bend	trans	-64.1	-29.9	175.5	-87.7	157.9	0	0	0	112.6	E290 L293 Q294 V300 P558 V561	E290-L575 HydrophobicContact CB-CD1 4.02Å; E290-L575 HydrophobicContact CG-CB 4.17Å; E290-L575 HydrophobicContact CG-CD1 3.96Å; L293-L575 HydrophobicContact CB-CD2 4.3Å; L293-L575 HydrophobicContact CD1-CB 4.45Å; L293-L575 HydrophobicContact CD1-CD2 4.39Å; Q294-L575 HydrophobicContact CG-CD1 4.06Å; V300-L575 HydrophobicContact CB-CD2 3.98Å; V300-L575 HydrophobicContact CG1-CD2 3.67Å; V300-L575 HydrophobicContact CG2-CD2 4.27Å; P558-L575 HydrophobicContact CB-CD1 4.44Å; P558-L575 HydrophobicContact CG-CD1 3.77Å; P558-L575 HydrophobicContact CG-CG 4.43Å; V561-L575 HydrophobicContact CG1-CD2 3.68Å; V561-L575 HydrophobicContact CG1-CG 3.95Å; V561-L575 HydrophobicContact CG2-CD1 4.43Å; V561-L575 HydrophobicContact CG2-CD2 4.11Å; V561-L575 HydrophobicContact CG2-CG 3.78Å
576	C	65.3	Low	58.9	Low	4 Å²	4	78.1 Å²	78.1	3%	0.027	44%	0.435	C	S	.	.	S	Bend	trans	-133.9	112.4	-173.7	-44	0	0	0	0	110.9	F275 Q574 W578	F275-C576 HydrophobicContact CE1-CB 4.5Å; F275-C576 HydrophobicContact CZ-CB 4.07Å; Q574-C576 PolarHBondContact O-N 3.25Å; C576-W578 VanDerWaalsContact C-N 3.28Å; C576-W578 HydrophobicContact CB-CG 4.25Å; C576-W578 PolarHBondContact O-N 3.33Å
577	P	54	Low	56.7	Low	72 Å²	72	76.6 Å²	76.6	47%	0.468	44%	0.439	S	S	.	.			trans	-85.4	63.7	-174.3	35.2	-34.8	0	0	0	111.2
578	W	55.6	Low	54.8	Low	52 Å²	52	79.3 Å²	79.3	20%	0.197	46%	0.455	C	S	.	.			trans	-81.6	-23.7	-176.3	-58.7	110.8	0	0	0	114.2	H250 F275 P281 C576	H250-W578 HydrophobicContact CB-CH2 3.89Å; H250-W578 HydrophobicContact CB-CZ2 4.05Å; F275-W578 HydrophobicContact CB-CH2 3.54Å; F275-W578 HydrophobicContact CB-CZ2 4.26Å; F275-W578 HydrophobicContact CB-CZ3 3.82Å; F275-W578 AromaticContact CD1-CH2 3.16Å; F275-W578 HydrophobicContact CD1-CH2 3.16Å; F275-W578 AromaticContact CD1-CZ2 3.08Å; F275-W578 HydrophobicContact CD1-CZ2 3.08Å; F275-W578 HydrophobicContact CD1-CZ3 4.2Å; F275-W578 HydrophobicContact CE1-CH2 4Å; F275-W578 AromaticContact CE1-CZ2 3.41Å; F275-W578 HydrophobicContact CE1-CZ2 3.41Å; F275-W578 VanDerWaalsContact CE1-CZ2 3.41Å; F275-W578 AromaticContact CG-CH2 3.6Å; F275-W578 HydrophobicContact CG-CH2 3.6Å; F275-W578 AromaticContact CG-CZ2 3.81Å; F275-W578 HydrophobicContact CG-CZ2 3.81Å; F275-W578 HydrophobicContact CG-CZ3 4.24Å; F275-W578 HydrophobicContact CZ-CZ2 4.39Å; P281-W578 HydrophobicContact CG-CB 4.41Å; P281-W578 HydrophobicContact CG-CD2 3.84Å; P281-W578 HydrophobicContact CG-CG 3.78Å; P281-W578 HydrophobicContact CG-CZ2 4.49Å; C576-W578 VanDerWaalsContact C-N 3.28Å; C576-W578 HydrophobicContact CB-CG 4.25Å; C576-W578 PolarHBondContact O-N 3.33Å
579	R	45.2	Very low	53	Low	153 Å²	153	79.4 Å²	79.4	58%	0.577	45%	0.453	S	S	*	.	S	Bend	trans	-127.7	130.5	175.7	-61.9	-163.3	-153	-89	-8.4	108.5	D280	D280-R579 IonicContact OD1-CZ 3.84Å; D280-R579 VanDerWaalsContact OD1-CZ 3.28Å; D280-R579 IonicContact OD1-NH1 2.92Å; D280-R579 PolarHBondContact OD1-NH1 2.98Å; D280-R579 IonicContact OD1-NH2 3.75Å; D280-R579 PolarHBondContact OD1-NH2 2.85Å; D280-R579 IonicContact OD2-CZ 3.47Å; D280-R579 IonicContact OD2-NH1 2.97Å; D280-R579 PolarHBondContact OD2-NH1 3.28Å; D280-R579 IonicContact OD2-NH2 2.74Å
580	D	34.7	Very low	50.7	Low	157 Å²	157	88.4 Å²	88.4	84%	0.84	49%	0.486	S	S	*	.	S	Bend	trans	85.6	42.1	170.3	-49.1	-30.8	0	0	0	119.5
581	S	35.3	Very low	48.1	Very low	66 Å²	66	96.6 Å²	96.6	46%	0.462	51%	0.51	S	S	.	.			trans	-166.1	138.2	142.6	-88.8	0	0	0	0	110.3	S583	S581-S583 PolarHBondContact O-N 2.97Å
582	P	34	Very low	45.8	Very low	113 Å²	113	98.9 Å²	98.9	73%	0.734	52%	0.516	S	S	*	.	S	Bend	trans	-66.3	85.2	163.2	29.2	-29.5	0	0	0	106.8
583	S	39.4	Very low	43.4	Very low	56 Å²	56	102.6 Å²	102.6	39%	0.392	54%	0.543	S	S	.	.			trans	47.7	103.1	173.7	8.7	0	0	0	0	114.7	S581 L585 A586 V587	S581-S583 PolarHBondContact O-N 2.97Å; S583-L585 PolarHBondContact O-N 3.44Å; S583-A586 PolarHBondContact O-N 2.86Å; S583-A586 WeakPolarHBondContact OG-CB 3.39Å; S583-V587 PolarHBondContact O-N 3.13Å
584	L	43	Very low	41.8	Very low	110 Å²	110	105.9 Å²	105.9	58%	0.576	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.2	-15	156.6	-70.7	174.3	0	0	0	112
585	L	46.8	Very low	40.1	Very low	103 Å²	103	105.1 Å²	105.1	54%	0.539	55%	0.548	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.3	3.9	173.9	-56.7	175.6	0	0	0	115	D304 S583	D304-L585 VanDerWaalsContact OD2-CD2 3.27Å; D304-L585 WeakPolarHBondContact OD2-CD2 3.37Å; S583-L585 PolarHBondContact O-N 3.44Å
586	A	36.6	Very low	38.4	Very low	70 Å²	70	109.7 Å²	109.7	58%	0.579	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-135.9	-6.8	178.9	0	0	0	0	0	113.4	S583 S588	S583-A586 PolarHBondContact O-N 2.86Å; S583-A586 WeakPolarHBondContact OG-CB 3.39Å; A586-S588 PolarHBondContact O-N 3.23Å; A586-S588 VanDerWaalsContact O-N 3.17Å
587	V	31.2	Very low	37.1	Very low	89 Å²	89	115.2 Å²	115.2	54%	0.539	61%	0.614	S	S	.	*	S	Bend	trans	-66.4	113.9	163	179.1	0	0	0	0	107.6	S583 S589	S583-V587 PolarHBondContact O-N 3.13Å; V587-S589 PolarHBondContact O-N 3.49Å
588	S	35	Very low	36.4	Very low	71 Å²	71	117.6 Å²	117.6	50%	0.497	63%	0.632	S	S	.	*			trans	-54	104.2	167.4	-173.1	0	0	0	0	108.1	A586 R590	A586-S588 PolarHBondContact O-N 3.23Å; A586-S588 VanDerWaalsContact O-N 3.17Å; S588-R590 PolarHBondContact O-N 3.21Å; S588-R590 PolarHBondContact OG-NE 3.18Å
589	S	38.5	Very low	35.4	Very low	47 Å²	47	118.1 Å²	118.1	33%	0.329	64%	0.644	S	S	.	*			trans	-74.4	55.3	179.1	38.8	0	0	0	0	110.8	R566 V587 W591	R566-S589 VanDerWaalsContact CZ-OG 3.28Å; R566-S589 PolarHBondContact NH1-O 3.41Å; R566-S589 PolarHBondContact NH1-OG 3.23Å; R566-S589 PolarHBondContact NH2-OG 3.21Å; V587-S589 PolarHBondContact O-N 3.49Å; S589-W591 PolarHBondContact O-N 3.05Å
590	R	31.6	Very low	35	Very low	206 Å²	206	120 Å²	120	78%	0.777	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.1	3.6	177.4	-106.4	-175.8	-97	-147.7	-2.8	113.5	S588	S588-R590 PolarHBondContact O-N 3.21Å; S588-R590 PolarHBondContact OG-NE 3.18Å
591	W	28.4	Very low	35.1	Very low	239 Å²	239	114.9 Å²	114.9	91%	0.905	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-133.6	24.9	-169	-72.2	101.6	0	0	0	115.6	S589	S589-W591 PolarHBondContact O-N 3.05Å
592	L	30.9	Very low	35.3	Very low	137 Å²	137	113.3 Å²	113.3	72%	0.717	62%	0.622	S	S	*	*			trans	-108.2	119.3	169.7	-69.3	173.2	0	0	0	109.9
593	P	25.6	Very low	35.5	Very low	118 Å²	118	111.8 Å²	111.8	77%	0.766	62%	0.619	S	S	*	*			trans	-65.2	135.9	179.4	-4.2	14.8	0	0	0	110.5	P595	P593-P595 WeakPolarHBondContact O-CD 3.17Å
594	R	33.5	Very low	35.4	Very low	239 Å²	239	114.6 Å²	114.6	90%	0.902	63%	0.629	S	S	*	*			trans	-61	127.5	161.5	-85.9	178.6	168.7	-178.3	-4.1	109
595	P	30.6	Very low	35.6	Very low	102 Å²	102	112 Å²	112	66%	0.662	61%	0.614	S	S	*	*			trans	-77.5	115	141.1	19.5	-5	0	0	0	106.6	P593 I597	P593-P595 WeakPolarHBondContact O-CD 3.17Å; P595-I597 HydrophobicContact CB-CD1 4.03Å; P595-I597 HydrophobicContact CB-CG1 3.99Å; P595-I597 HydrophobicContact CG-CD1 4.33Å; P595-I597 PolarHBondContact O-N 2.97Å; P595-I597 VanDerWaalsContact O-N 3.16Å
596	A	31.6	Very low	35.6	Very low	99 Å²	99	115.8 Å²	115.8	82%	0.818	63%	0.629	S	S	*	*			trans	-64.2	111.6	164	0	0	0	0	0	106.8
597	I	37.8	Very low	36.2	Very low	121 Å²	121	113.6 Å²	113.6	62%	0.621	61%	0.606	S	S	*	*			trans	-123.1	103.6	175.6	-56	174.7	0	0	0	107.7	P595	P595-I597 HydrophobicContact CB-CD1 4.03Å; P595-I597 HydrophobicContact CB-CG1 3.99Å; P595-I597 HydrophobicContact CG-CD1 4.33Å; P595-I597 PolarHBondContact O-N 2.97Å; P595-I597 VanDerWaalsContact O-N 3.16Å
598	S	39	Very low	36.8	Very low	121 Å²	121	112 Å²	112	85%	0.846	61%	0.608	S	S	*	*			trans	-69.8	112.2	153.8	50.5	0	0	0	0	107.9
599	S	34.9	Very low	37.5	Very low	64 Å²	64	112.2 Å²	112.2	45%	0.448	60%	0.603	S	S	.	*			trans	-152.3	132.6	159.4	-176.6	0	0	0	0	110.2	S601	S599-S601 VanDerWaalsContact C-N 3.32Å
600	E	35.9	Very low	37.9	Very low	192 Å²	192	111 Å²	111	90%	0.897	59%	0.594	S	S	*	*	S	Bend	trans	-87.6	6	-172.7	-65.2	-179.7	141.4	0	0	112.9
601	S	36.8	Very low	38.4	Very low	50 Å²	50	107.3 Å²	107.3	35%	0.35	60%	0.6	S	S	.	*			trans	-144.6	122.5	-175.4	175.8	0	0	0	0	111.9	S599 A603 D604	S599-S601 VanDerWaalsContact C-N 3.32Å; S601-A603 PolarHBondContact O-N 2.85Å; S601-A603 WeakPolarHBondContact OG-CB 3.41Å; S601-A603 PolarHBondContact OG-N 3.26Å; S601-D604 PolarHBondContact O-N 2.86Å
602	L	41.3	Very low	39.4	Very low	33 Å²	33	101.4 Å²	101.4	17%	0.173	58%	0.582	C	S	.	*	G	3₁₀ helix	trans	-60.3	-21.6	171.5	-90.3	168.4	0	0	0	112.7	D604 Q605 W607 L624 Y627	L602-D604 PolarHBondContact O-N 2.78Å; L602-Q605 PolarHBondContact O-N 2.79Å; L602-W607 HydrophobicContact CD2-CZ2 3.84Å; L602-L624 HydrophobicContact CD1-CB 4.38Å; L602-L624 HydrophobicContact CD1-CD1 4.35Å; L602-L624 HydrophobicContact CD1-CD2 4.26Å; L602-Y627 HydrophobicContact CD1-CE1 3.95Å; L602-Y627 HydrophobicContact CG-CE1 4.3Å
603	A	37.9	Very low	40.4	Very low	80 Å²	80	95.1 Å²	95.1	66%	0.661	55%	0.549	S	S	*	.	G	3₁₀ helix	trans	-68.4	-22.7	177.7	0	0	0	0	0	112.6	S601	S601-A603 PolarHBondContact O-N 2.85Å; S601-A603 WeakPolarHBondContact OG-CB 3.41Å; S601-A603 PolarHBondContact OG-N 3.26Å
604	D	36.9	Very low	41.3	Very low	115 Å²	115	91.9 Å²	91.9	62%	0.615	54%	0.537	S	S	*	.	G	3₁₀ helix	trans	-104	2.3	-179.5	-60.7	-45.2	0	0	0	112.8	S601 L602 E606	S601-D604 PolarHBondContact O-N 2.86Å; L602-D604 PolarHBondContact O-N 2.78Å; D604-E606 VanDerWaalsContact C-N 3.33Å; D604-E606 PolarHBondContact O-N 3Å
605	Q	47.3	Very low	42	Very low	55 Å²	55	85.7 Å²	85.7	26%	0.257	54%	0.537	S	S	.	.			trans	-79.8	87.1	175	-158.8	158.8	24.4	0	0	108.5	L602 W607	L602-Q605 PolarHBondContact O-N 2.79Å; Q605-W607 VanDerWaalsContact C-N 3.32Å; Q605-W607 HydrophobicContact CG-CZ2 4.41Å; Q605-W607 PolarHBondContact O-N 2.91Å; Q605-W607 PolarHBondContact O-NE1 2.98Å
606	E	45.6	Very low	43.2	Very low	184 Å²	184	83.5 Å²	83.5	86%	0.86	52%	0.523	S	S	*	.			trans	-60.4	97.2	166.2	-69.3	-172.8	165.5	0	0	107.9	D604 G608	D604-E606 VanDerWaalsContact C-N 3.33Å; D604-E606 PolarHBondContact O-N 3Å; E606-G608 PolarHBondContact O-N 3.42Å
607	W	50.8	Low	44.5	Very low	24 Å²	24	84.1 Å²	84.1	9%	0.091	52%	0.519	C	S	.	.			trans	-62.3	14.6	177.4	-62.1	92.5	0	0	0	114	D359 F564 G567 L602 Q605 L609	D359-W607 HydrophobicContact CB-CH2 3.86Å; D359-W607 HydrophobicContact CB-CZ2 4.19Å; D359-W607 HydrophobicContact CB-CZ3 4.4Å; D359-W607 WeakPolarHBondContact OD1-CH2 3.39Å; D359-W607 VanDerWaalsContact OD1-CZ2 3.27Å; D359-W607 WeakPolarHBondContact OD1-CZ2 3.46Å; D359-W607 VanDerWaalsContact OD2-CH2 3.3Å; D359-W607 WeakPolarHBondContact OD2-CH2 3.43Å; F564-W607 AromaticContact CE2-CE3 3.67Å; F564-W607 HydrophobicContact CE2-CE3 3.67Å; F564-W607 AromaticContact CE2-CZ3 3.74Å; F564-W607 HydrophobicContact CE2-CZ3 3.74Å; F564-W607 HydrophobicContact CZ-CE3 4.08Å; F564-W607 HydrophobicContact CZ-CH2 4.35Å; F564-W607 AromaticContact CZ-CZ3 3.68Å; F564-W607 HydrophobicContact CZ-CZ3 3.68Å; G567-W607 WeakPolarHBondContact O-CZ3 3.42Å; L602-W607 HydrophobicContact CD2-CZ2 3.84Å; Q605-W607 VanDerWaalsContact C-N 3.32Å; Q605-W607 HydrophobicContact CG-CZ2 4.41Å; Q605-W607 PolarHBondContact O-N 2.91Å; Q605-W607 PolarHBondContact O-NE1 2.98Å; W607-L609 HydrophobicContact CB-CD2 3.92Å; W607-L609 HydrophobicContact CB-CG 3.98Å; W607-L609 PolarHBondContact O-N 2.73Å
608	G	43.1	Very low	45.8	Very low	56 Å²	56	81.9 Å²	81.9	58%	0.577	51%	0.508	S	S	*	.			trans	55.7	35.4	-161.8	0	0	0	0	0	110.8	E606	E606-G608 PolarHBondContact O-N 3.42Å
609	L	49.8	Very low	47.2	Very low	75 Å²	75	78.5 Å²	78.5	39%	0.393	48%	0.483	S	S	.	.			trans	-53.4	128.4	177.3	-62.2	172.9	0	0	0	107.3	L569 W607 S611 W613	L569-L609 HydrophobicContact CD1-CD2 3.69Å; W607-L609 HydrophobicContact CB-CD2 3.92Å; W607-L609 HydrophobicContact CB-CG 3.98Å; W607-L609 PolarHBondContact O-N 2.73Å; L609-S611 PolarHBondContact O-N 2.97Å; L609-W613 HydrophobicContact CB-CB 4.31Å; L609-W613 HydrophobicContact CB-CE3 4.11Å; L609-W613 HydrophobicContact CD2-CE3 3.61Å; L609-W613 HydrophobicContact CD2-CZ3 3.89Å; L609-W613 HydrophobicContact CG-CE3 4.41Å
610	P	47	Very low	48.5	Very low	21 Å²	21	79.2 Å²	79.2	14%	0.136	49%	0.486	C	S	.	.			trans	-45	137	175.4	-31.5	34.6	0	0	0	111.1	W562 H612 W613	W562-P610 HydrophobicContact CE3-CG 4.42Å; W562-P610 HydrophobicContact CH2-CB 4.18Å; W562-P610 HydrophobicContact CH2-CG 3.14Å; W562-P610 HydrophobicContact CZ2-CB 4.37Å; W562-P610 HydrophobicContact CZ2-CG 3.41Å; W562-P610 VanDerWaalsContact CZ2-CG 3.41Å; W562-P610 HydrophobicContact CZ3-CG 3.67Å; P610-H612 WeakPolarHBondContact CB-CE1 3.33Å; P610-H612 VanDerWaalsContact CB-ND1 3.26Å; P610-H612 WeakPolarHBondContact CB-ND1 3.33Å; P610-H612 PolarHBondContact O-N 3.39Å; P610-W613 HydrophobicContact CB-CD2 4.16Å; P610-W613 HydrophobicContact CB-CG 4.12Å; P610-W613 VanDerWaalsContact CD-CE3 3.44Å; P610-W613 HydrophobicContact CG-CD2 3.86Å; P610-W613 HydrophobicContact CG-CE3 4.17Å; P610-W613 HydrophobicContact CG-CG 4.34Å; P610-W613 HydrophobicContact CG-CH2 4.19Å; P610-W613 HydrophobicContact CG-CZ2 3.95Å; P610-W613 HydrophobicContact CG-CZ3 4.32Å; P610-W613 WeakPolarHBondContact O-CA 3.43Å; P610-W613 VanDerWaalsContact O-CB 3.23Å; P610-W613 WeakPolarHBondContact O-CB 3.35Å; P610-W613 PolarHBondContact O-N 3.22Å
611	S	41.2	Very low	50.4	Low	128 Å²	128	71 Å²	71	90%	0.895	45%	0.453	S	S	*	.	G	3₁₀ helix	trans	-56.5	-22.4	-175	51	0	0	0	0	114.2	L609 W613	L609-S611 PolarHBondContact O-N 2.97Å; S611-W613 PolarHBondContact O-N 3.43Å
612	H	49.8	Very low	52.7	Low	115 Å²	115	69.8 Å²	69.8	53%	0.532	44%	0.442	S	S	.	.	G	3₁₀ helix	trans	-77.4	-2.9	172.8	69.9	-82.5	0	0	0	114.3	R367 P610	R367-H612 PolarHBondContact NH2-O 2.86Å; R367-H612 VanDerWaalsContact NH2-O 3.17Å; P610-H612 WeakPolarHBondContact CB-CE1 3.33Å; P610-H612 VanDerWaalsContact CB-ND1 3.26Å; P610-H612 WeakPolarHBondContact CB-ND1 3.33Å; P610-H612 PolarHBondContact O-N 3.39Å
613	W	51.4	Low	55	Low	5 Å²	5	68.9 Å²	68.9	2%	0.019	44%	0.438	C	S	.	.	G	3₁₀ helix	trans	-86.4	-17.4	-179.4	-71.4	5.8	0	0	0	114.4	R367 W562 L569 L609 P610 S611	R367-W613 VanDerWaalsContact CZ-CA 3.48Å; R367-W613 VanDerWaalsContact CZ-O 3.25Å; R367-W613 PolarHBondContact NE-O 3.37Å; R367-W613 VanDerWaalsContact NH1-CD1 3.28Å; R367-W613 PolarHBondContact NH2-O 2.99Å; W562-W613 AromaticContact CD1-CH2 3.69Å; W562-W613 AromaticContact CD1-CZ2 3.72Å; W562-W613 AromaticContact CD2-CH2 3.81Å; W562-W613 HydrophobicContact CD2-CH2 3.81Å; W562-W613 HydrophobicContact CD2-CZ2 4.07Å; W562-W613 AromaticContact CE2-CH2 3.72Å; W562-W613 AromaticContact CE2-CZ2 3.47Å; W562-W613 VanDerWaalsContact CE2-CZ2 3.47Å; W562-W613 AromaticContact CG-CH2 3.84Å; W562-W613 HydrophobicContact CG-CH2 3.84Å; W562-W613 HydrophobicContact CG-CZ2 4.24Å; W562-W613 HydrophobicContact CZ2-CH2 4.41Å; W562-W613 AromaticContact CZ2-CZ2 3.95Å; W562-W613 HydrophobicContact CZ2-CZ2 3.95Å; W562-W613 AromaticContact NE1-CH2 3.62Å; W562-W613 AromaticContact NE1-CZ2 3.22Å; L569-W613 HydrophobicContact CD1-CH2 4.29Å; L569-W613 HydrophobicContact CD1-CZ3 3.62Å; L609-W613 HydrophobicContact CB-CB 4.31Å; L609-W613 HydrophobicContact CB-CE3 4.11Å; L609-W613 HydrophobicContact CD2-CE3 3.61Å; L609-W613 HydrophobicContact CD2-CZ3 3.89Å; L609-W613 HydrophobicContact CG-CE3 4.41Å; P610-W613 HydrophobicContact CB-CD2 4.16Å; P610-W613 HydrophobicContact CB-CG 4.12Å; P610-W613 VanDerWaalsContact CD-CE3 3.44Å; P610-W613 HydrophobicContact CG-CD2 3.86Å; P610-W613 HydrophobicContact CG-CE3 4.17Å; P610-W613 HydrophobicContact CG-CG 4.34Å; P610-W613 HydrophobicContact CG-CH2 4.19Å; P610-W613 HydrophobicContact CG-CZ2 3.95Å; P610-W613 HydrophobicContact CG-CZ3 4.32Å; P610-W613 WeakPolarHBondContact O-CA 3.43Å; P610-W613 VanDerWaalsContact O-CB 3.23Å; P610-W613 WeakPolarHBondContact O-CB 3.35Å; P610-W613 PolarHBondContact O-N 3.22Å; S611-W613 PolarHBondContact O-N 3.43Å
614	G	45.8	Very low	57.4	Low	51 Å²	51	67.5 Å²	67.5	53%	0.526	42%	0.419	S	S	.	.			trans	58.4	168	174.2	0	0	0	0	0	114.5
615	A	48.2	Very low	60	Low	108 Å²	108	62.2 Å²	62.2	89%	0.893	39%	0.391	S	S	*	.			trans	-77.6	122.4	168.8	0	0	0	0	0	109.1
616	C	55	Low	61.7	Low	57 Å²	57	60.3 Å²	60.3	39%	0.385	39%	0.386	S	S	.	.			trans	-113.5	123.1	170.9	-73.2	0	0	0	0	108	L618	C616-L618 PolarHBondContact O-N 3.36Å
617	P	58.7	Low	63.5	Low	112 Å²	112	53 Å²	53	73%	0.727	35%	0.351	S	S	*	.	P	Polyproline II helix	trans	-62.2	133	175	25.6	-31.7	0	0	0	109.2
618	L	66.4	Low	64.9	Low	74 Å²	74	55.4 Å²	55.4	39%	0.387	37%	0.365	S	S	.	.	P	Polyproline II helix	trans	-58.6	136.3	173.2	-65.2	169	0	0	0	108.7	V362 C616 L622 L624	V362-L618 HydrophobicContact CG1-CD2 4.18Å; V362-L618 HydrophobicContact CG2-CD2 4.09Å; C616-L618 PolarHBondContact O-N 3.36Å; L618-L622 HydrophobicContact CD2-CD2 4.12Å; L618-L624 HydrophobicContact CD1-CD1 3.67Å
619	P	66.8	Low	66.3	Low	49 Å²	49	54.6 Å²	54.6	32%	0.318	36%	0.356	S	S	.	.	P	Polyproline II helix	trans	-74.4	150.8	-175.8	28	-30.9	0	0	0	111.7	T365 G621 L622	T365-P619 HydrophobicContact CG2-CB 4.37Å; T365-P619 HydrophobicContact CG2-CG 2.94Å; P619-G621 PolarHBondContact O-N 3.39Å; P619-L622 PolarHBondContact O-N 2.91Å
620	P	63.8	Low	67.6	Low	79 Å²	79	57 Å²	57	51%	0.513	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.7	134	169	23.2	-35.3	0	0	0	111.6	P541 S543	P541-P620 HydrophobicContact CB-CB 4.18Å; P541-P620 HydrophobicContact CG-CB 3.9Å; S543-P620 WeakPolarHBondContact OG-CB 3.45Å; S543-P620 WeakPolarHBondContact OG-CG 3.47Å
621	G	74.3	Confident	69.2	Low	19 Å²	19	60.3 Å²	60.3	20%	0.196	39%	0.39	C	S	.	.	T	Hydrogen-bonded Turn	trans	97.5	-11.2	177.2	0	0	0	0	0	116.1	R398 P619 L623	R398-G621 PolarHBondContact NH2-O 3.18Å; P619-G621 PolarHBondContact O-N 3.39Å; G621-L623 PolarHBondContact O-N 3.34Å
622	L	86.1	Confident	71.5	Confident	26 Å²	26	54.9 Å²	54.9	14%	0.136	35%	0.351	C	S	.	.			trans	-72.6	119.4	170.1	174.6	62.6	0	0	0	110	T365 L392 L618 P619 L624	T365-L622 HydrophobicContact CG2-CD2 4.44Å; L392-L622 HydrophobicContact CB-CD1 4.43Å; L618-L622 HydrophobicContact CD2-CD2 4.12Å; P619-L622 PolarHBondContact O-N 2.91Å; L622-L624 HydrophobicContact CD2-CD2 4.18Å; L622-L624 HydrophobicContact CG-CD2 4.25Å; L622-L624 HydrophobicContact CG-CG 4.46Å
623	L	89.9	Confident	73.5	Confident	14 Å²	14	55.8 Å²	55.8	7%	0.073	35%	0.35	C	S	.	.			trans	-83.3	131.7	173.6	-58	179.9	0	0	0	110.2	L392 F448 D451 F452 G621	L392-L623 HydrophobicContact CD2-CB 4.04Å; L392-L623 PolarHBondContact O-N 3.21Å; F448-L623 HydrophobicContact CB-CD1 4.08Å; F448-L623 HydrophobicContact CB-CD2 4.47Å; F448-L623 HydrophobicContact CD1-CD2 3.78Å; F448-L623 HydrophobicContact CD2-CB 4.23Å; F448-L623 HydrophobicContact CD2-CD1 3.9Å; F448-L623 HydrophobicContact CD2-CD2 4.44Å; F448-L623 HydrophobicContact CD2-CG 4.41Å; F448-L623 HydrophobicContact CE1-CD2 4.07Å; F448-L623 HydrophobicContact CE2-CB 4.01Å; F448-L623 HydrophobicContact CG-CD1 3.93Å; F448-L623 HydrophobicContact CG-CD2 3.98Å; F448-L623 HydrophobicContact CG-CG 4.38Å; F448-L623 HydrophobicContact CZ-CB 4.18Å; D451-L623 HydrophobicContact CB-CD1 4.14Å; F452-L623 HydrophobicContact CE2-CD1 4.05Å; G621-L623 PolarHBondContact O-N 3.34Å
624	L	88.4	Confident	75.5	Confident	51 Å²	51	56.8 Å²	56.8	27%	0.267	35%	0.354	S	S	.	.			trans	-118.6	97.3	173.3	-68.5	-177	0	0	0	109.4	V362 L602 L618 L622	V362-L624 HydrophobicContact CG2-CD2 4.14Å; L602-L624 HydrophobicContact CD1-CB 4.38Å; L602-L624 HydrophobicContact CD1-CD1 4.35Å; L602-L624 HydrophobicContact CD1-CD2 4.26Å; L618-L624 HydrophobicContact CD1-CD1 3.67Å; L622-L624 HydrophobicContact CD2-CD2 4.18Å; L622-L624 HydrophobicContact CG-CD2 4.25Å; L622-L624 HydrophobicContact CG-CG 4.46Å
625	P	89.9	Confident	77.7	Confident	3 Å²	3	54.4 Å²	54.4	2%	0.019	33%	0.329	C	S	.	.			trans	-68.6	144.4	-176.8	27.9	-36.7	0	0	0	112.1	L354 S358 L392 L444 F448 Y627	L354-P625 HydrophobicContact CB-CG 4.44Å; L354-P625 HydrophobicContact CD2-CG 4.46Å; S358-P625 VanDerWaalsContact OG-CD 3.29Å; S358-P625 WeakPolarHBondContact OG-CD 3.47Å; S358-P625 WeakPolarHBondContact OG-CG 3.5Å; L392-P625 HydrophobicContact CD2-CG 4.01Å; L444-P625 HydrophobicContact CD2-CB 3.55Å; L444-P625 HydrophobicContact CD2-CG 3.77Å; F448-P625 HydrophobicContact CE2-CB 4.15Å; P625-Y627 WeakPolarHBondContact O-CD1 3.31Å; P625-Y627 PolarHBondContact O-N 3.15Å
626	G	84.8	Confident	79.7	Confident	15 Å²	15	56 Å²	56	16%	0.155	31%	0.312	C	S	.	.			trans	-69.5	114.8	162.7	0	0	0	0	0	111.5	Q447	Q447-G626 PolarHBondContact NE2-O 3.36Å; Q447-G626 PolarHBondContact OE1-O 3.35Å
627	Y	81.4	Confident	81.1	Confident	32 Å²	32	54.8 Å²	54.8	13%	0.125	30%	0.299	C	S	.	.			trans	-112.3	16.7	178.8	55.2	-101.1	0	0	0	112.6	R351 R355 L602 P625	R351-Y627 WeakPolarHBondContact CD-O 3.35Å; R351-Y627 VanDerWaalsContact CG-O 3.27Å; R351-Y627 WeakPolarHBondContact CG-O 3.24Å; R351-Y627 PolarHBondContact NE-O 2.89Å; R355-Y627 HydrophobicContact CB-CD1 3.99Å; R355-Y627 HydrophobicContact CB-CD2 3.94Å; R355-Y627 HydrophobicContact CB-CE1 4.16Å; R355-Y627 HydrophobicContact CB-CE2 4.13Å; R355-Y627 HydrophobicContact CB-CG 3.87Å; R355-Y627 HydrophobicContact CG-CD1 4.38Å; R355-Y627 HydrophobicContact CG-CD2 4.17Å; R355-Y627 HydrophobicContact CG-CE1 4.04Å; R355-Y627 HydrophobicContact CG-CE2 3.84Å; R355-Y627 HydrophobicContact CG-CG 4.44Å; L602-Y627 HydrophobicContact CD1-CE1 3.95Å; L602-Y627 HydrophobicContact CG-CE1 4.3Å; P625-Y627 WeakPolarHBondContact O-CD1 3.31Å; P625-Y627 PolarHBondContact O-N 3.15Å
628	L	80.5	Confident	82.6	Confident	74 Å²	74	49.4 Å²	49.4	39%	0.387	27%	0.265	S	S	.	.	S	Bend	trans	-79	156.5	171	-63.8	179.8	0	0	0	110.5	Q631 I632	L628-Q631 PolarHBondContact O-N 3.32Å; L628-I632 PolarHBondContact O-N 3.35Å
629	G	73.4	Confident	83.8	Confident	38 Å²	38	46 Å²	46	39%	0.392	25%	0.246	S	C	.	.	G	3₁₀ helix	trans	-46.9	-49.3	-175.2	0	0	0	0	0	114.7	Q631 I632	G629-Q631 PolarHBondContact O-N 2.88Å; G629-I632 PolarHBondContact O-N 2.99Å
630	P	75.9	Confident	84.7	Confident	127 Å²	127	44.1 Å²	44.1	83%	0.825	23%	0.234	S	C	*	.	G	3₁₀ helix	trans	-65.7	-20.7	-180	-23.3	34.5	0	0	0	115.3
631	Q	80.8	Confident	85.6	Confident	89 Å²	89	42.1 Å²	42.1	42%	0.416	22%	0.216	S	C	.	.	G	3₁₀ helix	trans	-91.4	-21.4	-177.1	-68.3	166.5	-24.4	0	0	112.4	Q447 L628 G629	Q447-Q631 PolarHBondContact NE2-O 3.41Å; L628-Q631 PolarHBondContact O-N 3.32Å; G629-Q631 PolarHBondContact O-N 2.88Å
632	I	91	Very high	85.6	Confident	15 Å²	15	41.6 Å²	41.6	8%	0.077	21%	0.21	C	C	.	.	P	Polyproline II helix	trans	-84.3	122.4	173.7	-62	-49.1	0	0	0	109.7	L347 R351 L354 Q443 L628 G629	L347-I632 HydrophobicContact CB-CG2 4.24Å; L347-I632 HydrophobicContact CD2-CG2 4.13Å; R351-I632 HydrophobicContact CG-CB 4.37Å; R351-I632 HydrophobicContact CG-CD1 4.38Å; R351-I632 HydrophobicContact CG-CG1 3.46Å; R351-I632 VanDerWaalsContact CG-CG1 3.46Å; L354-I632 HydrophobicContact CD1-CD1 3.74Å; Q443-I632 HydrophobicContact CG-CD1 4.27Å; L628-I632 PolarHBondContact O-N 3.35Å; G629-I632 PolarHBondContact O-N 2.99Å
633	R	91.5	Very high	85	Confident	134 Å²	134	42.9 Å²	42.9	51%	0.506	21%	0.213	S	C	.	.	P	Polyproline II helix	trans	-100.1	159.6	-177.8	-63.8	-177.3	179	176.9	1	110.6	W442 Q443 Q446	W442-R633 HydrophobicContact CH2-CB 3.65Å; W442-R633 HydrophobicContact CZ3-CB 3.69Å; Q443-R633 PolarHBondContact NE2-O 2.99Å; Q443-R633 PolarHBondContact OE1-O 3.5Å; Q446-R633 VanDerWaalsContact OE1-NH1 3.14Å
634	F	92.6	Very high	83.8	Confident	26 Å²	26	45.1 Å²	45.1	11%	0.114	23%	0.229	C	C	.	.	P	Polyproline II helix	trans	-90.4	123.9	173.5	-177	-112	0	0	0	110.5	L322 W337 L341 W442 R636 Y639 L640	L322-F634 HydrophobicContact CD1-CE2 3.78Å; L322-F634 HydrophobicContact CD1-CZ 4.26Å; W337-F634 AromaticContact CH2-CD1 3.82Å; W337-F634 HydrophobicContact CH2-CD1 3.82Å; W337-F634 AromaticContact CH2-CE1 3.67Å; W337-F634 HydrophobicContact CH2-CE1 3.67Å; W337-F634 HydrophobicContact CH2-CE2 4.42Å; W337-F634 HydrophobicContact CH2-CG 4.27Å; W337-F634 AromaticContact CH2-CZ 3.99Å; W337-F634 HydrophobicContact CH2-CZ 3.99Å; W337-F634 HydrophobicContact CZ2-CE1 4.03Å; W337-F634 HydrophobicContact CZ2-CZ 4.14Å; L341-F634 HydrophobicContact CD1-CD2 3.9Å; L341-F634 HydrophobicContact CD1-CE2 3.65Å; L341-F634 HydrophobicContact CD1-CZ 4.48Å; L341-F634 HydrophobicContact CD2-CD2 3.86Å; L341-F634 HydrophobicContact CD2-CE2 4.34Å; L341-F634 HydrophobicContact CD2-CG 4.24Å; W442-F634 WeakPolarHBondContact CH2-O 3.08Å; F634-R636 VanDerWaalsContact C-N 3.26Å; F634-R636 HydrophobicContact CD1-CG 3.69Å; F634-R636 HydrophobicContact CE1-CG 4.29Å; F634-R636 PolarHBondContact O-N 3.38Å; F634-Y639 HydrophobicContact CD2-CD2 4.16Å; F634-Y639 AromaticContact CE2-CD2 3.55Å; F634-Y639 HydrophobicContact CE2-CD2 3.55Å; F634-Y639 HydrophobicContact CE2-CE2 4.42Å; F634-Y639 HydrophobicContact CE2-CG 4.22Å; F634-Y639 AromaticContact CZ-CD2 3.82Å; F634-Y639 HydrophobicContact CZ-CD2 3.82Å; F634-Y639 HydrophobicContact CZ-CG 4.11Å; F634-L640 HydrophobicContact CE1-CD1 3.95Å; F634-L640 HydrophobicContact CE1-CD2 4.19Å; F634-L640 HydrophobicContact CE1-CG 3.85Å
635	W	92.9	Very high	82.7	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	24%	0.239	C	C	.	.			trans	-75	73.9	-178.9	-167.9	7.5	0	0	0	112.3	L438 D439 W442 L459 L460 R637 C638 Y639	L438-W635 HydrophobicContact CB-CH2 4.27Å; L438-W635 HydrophobicContact CB-CZ3 4.07Å; D439-W635 HydrophobicContact CB-CE3 4.03Å; D439-W635 HydrophobicContact CB-CZ3 4.34Å; W442-W635 HydrophobicContact CB-CD2 4.01Å; W442-W635 HydrophobicContact CB-CE3 4.02Å; W442-W635 HydrophobicContact CB-CH2 4.31Å; W442-W635 HydrophobicContact CB-CZ2 4.29Å; W442-W635 HydrophobicContact CB-CZ3 4.17Å; W442-W635 AromaticContact CD1-CD1 3.73Å; W442-W635 AromaticContact CD1-CD2 3.97Å; W442-W635 AromaticContact CD1-CE2 3.51Å; W442-W635 AromaticContact CD1-CZ2 3.98Å; W442-W635 AromaticContact CD1-NE1 3.34Å; W442-W635 VanDerWaalsContact CD1-NE1 3.34Å; W442-W635 HydrophobicContact CD2-CB 3.91Å; W442-W635 AromaticContact CD2-CD1 3.72Å; W442-W635 AromaticContact CD2-CD2 3.97Å; W442-W635 HydrophobicContact CD2-CD2 3.97Å; W442-W635 AromaticContact CD2-CG 3.62Å; W442-W635 HydrophobicContact CD2-CG 3.62Å; W442-W635 AromaticContact CE2-CD1 3.37Å; W442-W635 AromaticContact CE2-CG 3.76Å; W442-W635 AromaticContact CE2-NE1 3.82Å; W442-W635 HydrophobicContact CE3-CB 3.75Å; W442-W635 AromaticContact CE3-CG 4Å; W442-W635 HydrophobicContact CE3-CG 4Å; W442-W635 AromaticContact CG-CD1 3.95Å; W442-W635 AromaticContact CG-CD2 3.71Å; W442-W635 HydrophobicContact CG-CD2 3.71Å; W442-W635 AromaticContact CG-CE2 3.71Å; W442-W635 HydrophobicContact CG-CE3 4.22Å; W442-W635 AromaticContact CG-CG 3.89Å; W442-W635 HydrophobicContact CG-CG 3.89Å; W442-W635 HydrophobicContact CG-CZ2 4.23Å; W442-W635 AromaticContact CG-NE1 3.85Å; W442-W635 HydrophobicContact CH2-CB 4.17Å; W442-W635 HydrophobicContact CZ2-CB 4.31Å; W442-W635 AromaticContact CZ2-CD1 3.84Å; W442-W635 HydrophobicContact CZ2-CG 4.26Å; W442-W635 HydrophobicContact CZ3-CB 3.89Å; W442-W635 HydrophobicContact CZ3-CG 4.47Å; W442-W635 AromaticContact NE1-CD1 3.35Å; W442-W635 AromaticContact NE1-CE2 3.95Å; W442-W635 AromaticContact NE1-NE1 3.3Å; L459-W635 HydrophobicContact CB-CH2 3.79Å; L459-W635 HydrophobicContact CB-CZ2 3.91Å; L459-W635 HydrophobicContact CD1-CH2 4.48Å; L460-W635 HydrophobicContact CD2-CH2 4.33Å; L460-W635 HydrophobicContact CD2-CZ2 3.58Å; L460-W635 HydrophobicContact CG-CZ2 3.91Å; W635-R637 VanDerWaalsContact C-N 3.33Å; W635-R637 PolarHBondContact O-N 3.38Å; W635-C638 HydrophobicContact CB-CB 4.23Å; W635-C638 HydrophobicContact CD2-CB 3.35Å; W635-C638 HydrophobicContact CE3-CB 3.74Å; W635-C638 HydrophobicContact CG-CB 3.55Å; W635-C638 HydrophobicContact CZ2-CB 4.24Å; W635-C638 HydrophobicContact CZ3-CB 4.31Å; W635-C638 PolarHBondContact O-N 3.03Å; W635-Y639 HydrophobicContact CB-CD2 4.08Å; W635-Y639 HydrophobicContact CB-CE2 3.92Å; W635-Y639 WeakPolarHBondContact O-CD2 3.45Å; W635-Y639 PolarHBondContact O-N 3.04Å
636	R	88.8	Confident	81.4	Confident	141 Å²	141	50.5 Å²	50.5	53%	0.532	26%	0.257	S	S	.	.	H	α-helix	trans	-53.3	-44.6	-174.4	-69.9	177.8	179.8	174.9	-0.4	113.2	F634 C638 Y639 L640 L650	F634-R636 VanDerWaalsContact C-N 3.26Å; F634-R636 HydrophobicContact CD1-CG 3.69Å; F634-R636 HydrophobicContact CE1-CG 4.29Å; F634-R636 PolarHBondContact O-N 3.38Å; R636-C638 VanDerWaalsContact C-N 3.26Å; R636-C638 PolarHBondContact O-N 3.01Å; R636-Y639 PolarHBondContact O-N 3.17Å; R636-L640 HydrophobicContact CB-CD1 4.39Å; R636-L640 HydrophobicContact CG-CD1 4.24Å; R636-L640 WeakPolarHBondContact O-CB 3.28Å; R636-L640 PolarHBondContact O-N 3.16Å; R636-L650 HydrophobicContact CB-CD1 3.96Å
637	R	85.3	Confident	80.4	Confident	32 Å²	32	52.5 Å²	52.5	12%	0.121	26%	0.262	C	S	.	.	H	α-helix	trans	-68.2	-19.7	-179.6	-79.3	171.8	164.6	-142.5	0.5	114.2	E456 F457 L460 W635 R641 L650 S651	E456-R637 VanDerWaalsContact CD-CD 3.44Å; E456-R637 WeakPolarHBondContact OE1-CD 3.27Å; E456-R637 IonicContact OE1-CZ 3.25Å; E456-R637 IonicContact OE1-NE 3.14Å; E456-R637 PolarHBondContact OE1-NE 2.91Å; E456-R637 VanDerWaalsContact OE1-NE 3.09Å; E456-R637 IonicContact OE1-NH1 2.77Å; E456-R637 PolarHBondContact OE1-NH1 3.45Å; E456-R637 IonicContact OE1-NH2 2.74Å; F457-R637 VanDerWaalsContact CE1-NH1 3.34Å; L460-R637 HydrophobicContact CD1-CB 4.2Å; W635-R637 VanDerWaalsContact C-N 3.33Å; W635-R637 PolarHBondContact O-N 3.38Å; R637-R641 WeakPolarHBondContact O-CD 3.35Å; R637-R641 WeakPolarHBondContact O-CG 3.31Å; R637-R641 PolarHBondContact O-NE 2.78Å; R637-L650 PolarHBondContact NE-O 3Å; R637-L650 PolarHBondContact NH2-O 3.47Å; R637-S651 VanDerWaalsContact NH2-C 3.28Å; R637-S651 PolarHBondContact NH2-O 3.24Å
638	C	90.2	Very high	78.9	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-87.3	-50.9	170.4	-174.9	0	0	0	0	110.8	F138 L460 W635 R636 R641	F138-C638 WeakPolarHBondContact CB-O 3.46Å; L460-C638 HydrophobicContact CD2-CB 3.77Å; W635-C638 HydrophobicContact CB-CB 4.23Å; W635-C638 HydrophobicContact CD2-CB 3.35Å; W635-C638 HydrophobicContact CE3-CB 3.74Å; W635-C638 HydrophobicContact CG-CB 3.55Å; W635-C638 HydrophobicContact CZ2-CB 4.24Å; W635-C638 HydrophobicContact CZ3-CB 4.31Å; W635-C638 PolarHBondContact O-N 3.03Å; R636-C638 VanDerWaalsContact C-N 3.26Å; R636-C638 PolarHBondContact O-N 3.01Å; C638-R641 VanDerWaalsContact O-CD 3.24Å; C638-R641 WeakPolarHBondContact O-CD 3.45Å; C638-R641 VanDerWaalsContact O-CG 3.32Å; C638-R641 WeakPolarHBondContact O-CG 3.48Å
639	Y	91.6	Very high	77.4	Confident	1 Å²	1	54.1 Å²	54.1	0%	0.004	29%	0.286	C	S	.	.	H	α-helix	trans	-88.6	-25	-166.1	-60.4	-42.7	0	0	0	115.4	F138 L322 C326 W346 L435 D439 F634 W635 R636	F138-Y639 HydrophobicContact CD1-CD1 4.09Å; F138-Y639 WeakPolarHBondContact CD1-O 3.38Å; F138-Y639 AromaticContact CD2-CD1 3.87Å; F138-Y639 HydrophobicContact CD2-CD1 3.87Å; F138-Y639 HydrophobicContact CD2-CE1 4.4Å; F138-Y639 AromaticContact CE1-CD1 3.67Å; F138-Y639 HydrophobicContact CE1-CD1 3.67Å; F138-Y639 HydrophobicContact CE1-CE1 4.45Å; F138-Y639 HydrophobicContact CE1-CG 4.38Å; F138-Y639 AromaticContact CE2-CD1 3.45Å; F138-Y639 HydrophobicContact CE2-CD1 3.45Å; F138-Y639 VanDerWaalsContact CE2-CD1 3.45Å; F138-Y639 AromaticContact CE2-CE1 3.67Å; F138-Y639 HydrophobicContact CE2-CE1 3.67Å; F138-Y639 HydrophobicContact CG-CD1 4.19Å; F138-Y639 AromaticContact CZ-CD1 3.35Å; F138-Y639 HydrophobicContact CZ-CD1 3.35Å; F138-Y639 AromaticContact CZ-CE1 3.71Å; F138-Y639 HydrophobicContact CZ-CE1 3.71Å; F138-Y639 HydrophobicContact CZ-CG 4.42Å; L322-Y639 HydrophobicContact CD2-CD1 3.98Å; L322-Y639 HydrophobicContact CD2-CD2 4.11Å; L322-Y639 HydrophobicContact CD2-CE1 3.91Å; L322-Y639 HydrophobicContact CD2-CE2 4Å; L322-Y639 HydrophobicContact CD2-CG 4.1Å; C326-Y639 VanDerWaalsContact CB-O 3.25Å; C326-Y639 WeakPolarHBondContact CB-O 3.36Å; W346-Y639 AromaticContact NE1-CE2 3.84Å; W346-Y639 AromaticContact NE1-CZ 3.56Å; W346-Y639 PolarHBondContact NE1-OH 3.33Å; L435-Y639 HydrophobicContact CD1-CE1 4.28Å; L435-Y639 HydrophobicContact CD2-CE1 4.22Å; D439-Y639 VanDerWaalsContact OD2-CE2 3.24Å; D439-Y639 WeakPolarHBondContact OD2-CE2 3.35Å; D439-Y639 PolarHBondContact OD2-OH 2.77Å; F634-Y639 HydrophobicContact CD2-CD2 4.16Å; F634-Y639 AromaticContact CE2-CD2 3.55Å; F634-Y639 HydrophobicContact CE2-CD2 3.55Å; F634-Y639 HydrophobicContact CE2-CE2 4.42Å; F634-Y639 HydrophobicContact CE2-CG 4.22Å; F634-Y639 AromaticContact CZ-CD2 3.82Å; F634-Y639 HydrophobicContact CZ-CD2 3.82Å; F634-Y639 HydrophobicContact CZ-CG 4.11Å; W635-Y639 HydrophobicContact CB-CD2 4.08Å; W635-Y639 HydrophobicContact CB-CE2 3.92Å; W635-Y639 WeakPolarHBondContact O-CD2 3.45Å; W635-Y639 PolarHBondContact O-N 3.04Å; R636-Y639 PolarHBondContact O-N 3.17Å
640	L	86.6	Confident	76.5	Confident	10 Å²	10	54.9 Å²	54.9	5%	0.052	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.2	23.5	-179.1	-56.4	179.5	0	0	0	112.9	C326 F634 R636 G642 R643 V646	C326-L640 HydrophobicContact CB-CD2 3.93Å; F634-L640 HydrophobicContact CE1-CD1 3.95Å; F634-L640 HydrophobicContact CE1-CD2 4.19Å; F634-L640 HydrophobicContact CE1-CG 3.85Å; R636-L640 HydrophobicContact CB-CD1 4.39Å; R636-L640 HydrophobicContact CG-CD1 4.24Å; R636-L640 WeakPolarHBondContact O-CB 3.28Å; R636-L640 PolarHBondContact O-N 3.16Å; L640-G642 PolarHBondContact O-N 3.41Å; L640-R643 PolarHBondContact O-N 3.35Å; L640-V646 HydrophobicContact CD1-CB 4.43Å; L640-V646 HydrophobicContact CD1-CG1 3.64Å
641	R	81.9	Confident	75.2	Confident	38 Å²	38	51.9 Å²	51.9	14%	0.143	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-28	178.6	-69.5	173.2	165.5	-163.4	-14.5	114.5	R139 D464 R637 C638 R643	R139-R641 HydrophobicContact CG-CB 4.02Å; D464-R641 IonicContact OD1-CZ 2.63Å; D464-R641 IonicContact OD1-NH1 2.96Å; D464-R641 PolarHBondContact OD1-NH1 3.27Å; D464-R641 IonicContact OD1-NH2 3.41Å; D464-R641 IonicContact OD2-CZ 3.72Å; D464-R641 IonicContact OD2-NH1 2.77Å; D464-R641 PolarHBondContact OD2-NH1 2.81Å; D464-R641 IonicContact OD2-NH2 3.91Å; D464-R641 PolarHBondContact OD2-NH2 3.08Å; R637-R641 WeakPolarHBondContact O-CD 3.35Å; R637-R641 WeakPolarHBondContact O-CG 3.31Å; R637-R641 PolarHBondContact O-NE 2.78Å; C638-R641 VanDerWaalsContact O-CD 3.24Å; C638-R641 WeakPolarHBondContact O-CD 3.45Å; C638-R641 VanDerWaalsContact O-CG 3.32Å; C638-R641 WeakPolarHBondContact O-CG 3.48Å; R641-R643 PolarHBondContact O-N 3.3Å
642	G	75	Confident	73.4	Confident	7 Å²	7	48.7 Å²	48.7	7%	0.072	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.9	0.6	174.1	0	0	0	0	0	114.4	F138 P328 L640	F138-G642 WeakPolarHBondContact O-CA 3.47Å; F138-G642 PolarHBondContact O-N 3.42Å; P328-G642 WeakPolarHBondContact CG-O 3.35Å; L640-G642 PolarHBondContact O-N 3.41Å
643	R	73.7	Confident	71.3	Confident	53 Å²	53	50 Å²	50	20%	0.2	26%	0.261	C	S	.	.			trans	-125.1	77.9	-179.8	-65.7	-174.4	-177.5	-145.6	-5.2	110.2	C326 L327 P328 L640 R641 E645 V646 Q647	C326-R643 PolarHBondContact O-NE 2.8Å; L327-R643 PolarHBondContact O-NH2 3.22Å; P328-R643 HydrophobicContact CG-CG 4.03Å; L640-R643 PolarHBondContact O-N 3.35Å; R641-R643 PolarHBondContact O-N 3.3Å; R643-E645 PolarHBondContact O-N 2.68Å; R643-E645 VanDerWaalsContact O-N 3.15Å; R643-V646 HydrophobicContact CB-CB 4.24Å; R643-V646 HydrophobicContact CB-CG2 3.95Å; R643-V646 PolarHBondContact O-N 3.04Å; R643-Q647 PolarHBondContact O-N 3.27Å
644	P	64.6	Low	69.1	Low	61 Å²	61	46 Å²	46	40%	0.396	25%	0.252	S	S	.	.	H	α-helix	trans	-58	-27.7	-177	23.4	-32.4	0	0	0	113.1	V646 Q647 T648	P644-V646 PolarHBondContact O-N 2.89Å; P644-Q647 PolarHBondContact O-N 2.79Å; P644-Q647 VanDerWaalsContact O-N 3.08Å; P644-T648 PolarHBondContact O-N 2.83Å
645	E	63.6	Low	67	Low	103 Å²	103	51.3 Å²	51.3	48%	0.481	28%	0.28	S	S	.	.	H	α-helix	trans	-63.2	-29.1	176.5	-49.5	79.9	-174.3	0	0	112.1	R643 T648	R643-E645 PolarHBondContact O-N 2.68Å; R643-E645 VanDerWaalsContact O-N 3.15Å; E645-T648 PolarHBondContact O-OG1 2.9Å
646	V	64.3	Low	64.8	Low	65 Å²	65	54.9 Å²	54.9	39%	0.394	31%	0.305	S	S	.	.	H	α-helix	trans	-90.6	-10.2	179.2	-170.6	0	0	0	0	111.5	L640 R643 P644 L650	L640-V646 HydrophobicContact CD1-CB 4.43Å; L640-V646 HydrophobicContact CD1-CG1 3.64Å; R643-V646 HydrophobicContact CB-CB 4.24Å; R643-V646 HydrophobicContact CB-CG2 3.95Å; R643-V646 PolarHBondContact O-N 3.04Å; P644-V646 PolarHBondContact O-N 2.89Å; V646-L650 WeakPolarHBondContact O-CD1 3.31Å
647	Q	62.3	Low	62.9	Low	57 Å²	57	48.7 Å²	48.7	27%	0.266	29%	0.285	S	S	.	.	H	α-helix	trans	-92.5	-14.3	177.7	-60.7	-152.2	-31	0	0	113.6	R643 P644 G649 L650	R643-Q647 PolarHBondContact O-N 3.27Å; P644-Q647 PolarHBondContact O-N 2.79Å; P644-Q647 VanDerWaalsContact O-N 3.08Å; Q647-G649 PolarHBondContact O-N 3.25Å; Q647-L650 PolarHBondContact O-N 3.01Å
648	T	51.3	Low	61.4	Low	100 Å²	100	51.6 Å²	51.6	61%	0.613	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	129.5	174.3	38.4	0	0	0	0	110.7	P644 E645	P644-T648 PolarHBondContact O-N 2.83Å; E645-T648 PolarHBondContact O-OG1 2.9Å
649	G	49	Very low	59.6	Low	39 Å²	39	57.1 Å²	57.1	40%	0.402	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	79	16.1	-177.7	0	0	0	0	0	115.3	Q647 E661	Q647-G649 PolarHBondContact O-N 3.25Å; G649-E661 WeakPolarHBondContact CA-OE1 3.42Å
650	L	54.1	Low	57.9	Low	55 Å²	55	62.2 Å²	62.2	29%	0.288	36%	0.356	S	S	.	.			trans	-103	8.5	167.9	-65.9	178.2	0	0	0	111.2	R636 R637 V646 Q647	R636-L650 HydrophobicContact CB-CD1 3.96Å; R637-L650 PolarHBondContact NE-O 3Å; R637-L650 PolarHBondContact NH2-O 3.47Å; V646-L650 WeakPolarHBondContact O-CD1 3.31Å; Q647-L650 PolarHBondContact O-N 3.01Å
651	S	47.4	Very low	56.6	Low	63 Å²	63	63.6 Å²	63.6	44%	0.441	36%	0.362	S	S	.	.			trans	-94.4	-0.6	-145	-69.2	0	0	0	0	116	R637 P653 E661	R637-S651 VanDerWaalsContact NH2-C 3.28Å; R637-S651 PolarHBondContact NH2-O 3.24Å; S651-P653 WeakPolarHBondContact O-CD 3.45Å; S651-E661 WeakPolarHBondContact CA-OE2 3.25Å; S651-E661 PolarHBondContact N-OE2 3.5Å
652	A	44.4	Very low	55.6	Low	22 Å²	22	66.2 Å²	66.2	18%	0.182	38%	0.378	C	S	.	.			trans	-118.2	72.5	-159.6	0	0	0	0	0	116.5	G657 L658 E661	A652-G657 VanDerWaalsContact CB-C 3.41Å; A652-G657 WeakPolarHBondContact CB-O 3.24Å; A652-L658 HydrophobicContact CB-CB 4.01Å; A652-L658 HydrophobicContact CB-CD2 3.35Å; A652-L658 HydrophobicContact CB-CG 3.54Å; A652-L658 VanDerWaalsContact CB-N 3.28Å; A652-L658 WeakPolarHBondContact O-CD2 3.32Å; A652-L658 WeakPolarHBondContact O-CG 3.33Å; A652-E661 HydrophobicContact CB-CB 4.26Å; A652-E661 WeakPolarHBondContact CB-OE2 3.45Å; A652-E661 PolarHBondContact N-OE2 3.1Å
653	P	46.7	Very low	55.3	Low	43 Å²	43	68.7 Å²	68.7	28%	0.279	40%	0.395	S	S	.	.	S	Bend	trans	-92	-5.7	167.3	37.2	-33.5	0	0	0	112.5	F457 P533 S651	F457-P653 HydrophobicContact CD2-CG 4.26Å; F457-P653 HydrophobicContact CE2-CB 4.5Å; F457-P653 HydrophobicContact CE2-CG 3.28Å; F457-P653 HydrophobicContact CZ-CG 3.86Å; P533-P653 VanDerWaalsContact CG-O 3.25Å; P533-P653 WeakPolarHBondContact CG-O 3.43Å; S651-P653 WeakPolarHBondContact O-CD 3.45Å
654	T	44.2	Very low	54.6	Low	51 Å²	51	70.7 Å²	70.7	31%	0.313	41%	0.406	S	S	.	.	S	Bend	trans	-112.1	151.5	171.8	56	0	0	0	0	109.9	S656 G657 L658	T654-S656 PolarHBondContact O-N 3.4Å; T654-G657 PolarHBondContact O-N 2.9Å; T654-G657 VanDerWaalsContact O-N 3.07Å; T654-G657 PolarHBondContact OG1-N 2.86Å; T654-L658 PolarHBondContact O-N 2.92Å
655	I	48.8	Very low	54.4	Low	136 Å²	136	72.4 Å²	72.4	70%	0.697	41%	0.411	S	S	*	.	H	α-helix	trans	-56.9	-37.2	178.5	-64.6	172.8	0	0	0	111.1	L658 Q659	I655-L658 PolarHBondContact O-N 2.75Å; I655-Q659 WeakPolarHBondContact O-CB 3.49Å; I655-Q659 PolarHBondContact O-N 2.97Å
656	S	46.3	Very low	54.8	Low	76 Å²	76	73 Å²	73	53%	0.531	41%	0.414	S	S	.	.	H	α-helix	trans	-70.7	-39.2	176.4	93.1	0	0	0	0	112.5	T654 L658 Q659 D660	T654-S656 PolarHBondContact O-N 3.4Å; S656-L658 VanDerWaalsContact C-N 3.29Å; S656-L658 PolarHBondContact O-N 3.34Å; S656-Q659 CarbonylContact O-C 3.58Å; S656-Q659 WeakPolarHBondContact O-CA 3.38Å; S656-Q659 VanDerWaalsContact O-CB 3.31Å; S656-Q659 WeakPolarHBondContact O-CB 3.21Å; S656-Q659 PolarHBondContact O-N 3.41Å; S656-Q659 VanDerWaalsContact O-N 3.1Å; S656-D660 VanDerWaalsContact O-CG 3.25Å; S656-D660 PolarHBondContact O-N 3.16Å
657	G	48.7	Very low	55.3	Low	11 Å²	11	73.6 Å²	73.6	11%	0.113	41%	0.412	C	S	.	.	H	α-helix	trans	-63.8	-36.9	174.2	0	0	0	0	0	111.9	A652 T654 Q659 D660 E661	A652-G657 VanDerWaalsContact CB-C 3.41Å; A652-G657 WeakPolarHBondContact CB-O 3.24Å; T654-G657 PolarHBondContact O-N 2.9Å; T654-G657 VanDerWaalsContact O-N 3.07Å; T654-G657 PolarHBondContact OG1-N 2.86Å; G657-Q659 VanDerWaalsContact C-N 3.35Å; G657-D660 PolarHBondContact O-N 3.24Å; G657-E661 WeakPolarHBondContact O-CB 3.44Å; G657-E661 PolarHBondContact O-N 3.19Å
658	L	53.8	Low	55.5	Low	92 Å²	92	74.9 Å²	74.9	48%	0.482	42%	0.421	S	S	.	.	H	α-helix	trans	-63.4	-42.8	170.7	-76.6	169.9	0	0	0	110.5	A652 T654 I655 S656 E661 L662	A652-L658 HydrophobicContact CB-CB 4.01Å; A652-L658 HydrophobicContact CB-CD2 3.35Å; A652-L658 HydrophobicContact CB-CG 3.54Å; A652-L658 VanDerWaalsContact CB-N 3.28Å; A652-L658 WeakPolarHBondContact O-CD2 3.32Å; A652-L658 WeakPolarHBondContact O-CG 3.33Å; T654-L658 PolarHBondContact O-N 2.92Å; I655-L658 PolarHBondContact O-N 2.75Å; S656-L658 VanDerWaalsContact C-N 3.29Å; S656-L658 PolarHBondContact O-N 3.34Å; L658-E661 PolarHBondContact O-N 3.49Å; L658-L662 WeakPolarHBondContact O-CB 3.44Å; L658-L662 PolarHBondContact O-N 3.15Å
659	Q	53.4	Low	56.5	Low	116 Å²	116	76.2 Å²	76.2	54%	0.542	42%	0.424	S	S	.	.	H	α-helix	trans	-63.2	-44.1	178	-146.5	85.1	18.9	0	0	112.1	I655 S656 G657 L662 S663	I655-Q659 WeakPolarHBondContact O-CB 3.49Å; I655-Q659 PolarHBondContact O-N 2.97Å; S656-Q659 CarbonylContact O-C 3.58Å; S656-Q659 WeakPolarHBondContact O-CA 3.38Å; S656-Q659 VanDerWaalsContact O-CB 3.31Å; S656-Q659 WeakPolarHBondContact O-CB 3.21Å; S656-Q659 PolarHBondContact O-N 3.41Å; S656-Q659 VanDerWaalsContact O-N 3.1Å; G657-Q659 VanDerWaalsContact C-N 3.35Å; Q659-L662 PolarHBondContact O-N 3.44Å; Q659-S663 VanDerWaalsContact O-CB 3.3Å; Q659-S663 WeakPolarHBondContact O-CB 3.45Å; Q659-S663 PolarHBondContact O-N 2.9Å; Q659-S663 PolarHBondContact O-OG 2.9Å
660	D	55.2	Low	57.7	Low	109 Å²	109	83.6 Å²	83.6	58%	0.583	44%	0.439	S	S	*	.	H	α-helix	trans	-66.8	-41.5	179	-67.9	-25.4	0	0	0	110.8	S656 G657 S663 H664	S656-D660 VanDerWaalsContact O-CG 3.25Å; S656-D660 PolarHBondContact O-N 3.16Å; G657-D660 PolarHBondContact O-N 3.24Å; D660-S663 PolarHBondContact O-N 3.06Å; D660-H664 VanDerWaalsContact O-CB 3.32Å; D660-H664 WeakPolarHBondContact O-CB 3.43Å; D660-H664 PolarHBondContact O-N 2.68Å
661	E	60.4	Low	58.7	Low	38 Å²	38	87.7 Å²	87.7	18%	0.178	46%	0.455	C	S	.	.	H	α-helix	trans	-68.6	-40.7	176.9	-166.5	170	155.6	0	0	111.8	G649 S651 A652 G657 L658 H664 L665	G649-E661 WeakPolarHBondContact CA-OE1 3.42Å; S651-E661 WeakPolarHBondContact CA-OE2 3.25Å; S651-E661 PolarHBondContact N-OE2 3.5Å; A652-E661 HydrophobicContact CB-CB 4.26Å; A652-E661 WeakPolarHBondContact CB-OE2 3.45Å; A652-E661 PolarHBondContact N-OE2 3.1Å; G657-E661 WeakPolarHBondContact O-CB 3.44Å; G657-E661 PolarHBondContact O-N 3.19Å; L658-E661 PolarHBondContact O-N 3.49Å; E661-H664 PolarHBondContact O-N 3.09Å; E661-L665 HydrophobicContact CG-CD1 4.42Å; E661-L665 WeakPolarHBondContact O-CB 3.47Å; E661-L665 VanDerWaalsContact O-CG 3.27Å; E661-L665 WeakPolarHBondContact O-CG 3.46Å; E661-L665 PolarHBondContact O-N 2.7Å
662	L	60.9	Low	59.4	Low	93 Å²	93	93.2 Å²	93.2	49%	0.487	47%	0.466	S	S	.	.	H	α-helix	trans	-65.6	-40.8	175.2	-160.2	159.2	0	0	0	110.5	L658 Q659 H664 L665 Q666	L658-L662 WeakPolarHBondContact O-CB 3.44Å; L658-L662 PolarHBondContact O-N 3.15Å; Q659-L662 PolarHBondContact O-N 3.44Å; L662-H664 VanDerWaalsContact C-N 3.35Å; L662-L665 PolarHBondContact O-N 3.49Å; L662-Q666 HydrophobicContact CD2-CG 4.08Å; L662-Q666 WeakPolarHBondContact O-CB 3.22Å; L662-Q666 WeakPolarHBondContact O-CG 3.37Å; L662-Q666 PolarHBondContact O-N 2.61Å
663	S	67.6	Low	59.4	Low	60 Å²	60	97.8 Å²	97.8	42%	0.42	49%	0.492	S	S	.	.	H	α-helix	trans	-63	-41.4	173.6	-57.8	0	0	0	0	111.6	Q659 D660 Q666 E667	Q659-S663 VanDerWaalsContact O-CB 3.3Å; Q659-S663 WeakPolarHBondContact O-CB 3.45Å; Q659-S663 PolarHBondContact O-N 2.9Å; Q659-S663 PolarHBondContact O-OG 2.9Å; D660-S663 PolarHBondContact O-N 3.06Å; S663-Q666 PolarHBondContact O-N 2.89Å; S663-E667 PolarHBondContact O-N 3Å
664	H	59.3	Low	59.4	Low	95 Å²	95	99 Å²	99	44%	0.44	50%	0.499	S	S	.	.	H	α-helix	trans	-67.1	-43.6	176.1	-176.2	71.2	0	0	0	112.5	D660 E661 L662 Q666 E667 L668	D660-H664 VanDerWaalsContact O-CB 3.32Å; D660-H664 WeakPolarHBondContact O-CB 3.43Å; D660-H664 PolarHBondContact O-N 2.68Å; E661-H664 PolarHBondContact O-N 3.09Å; L662-H664 VanDerWaalsContact C-N 3.35Å; H664-Q666 VanDerWaalsContact C-N 3.31Å; H664-Q666 PolarHBondContact O-N 3.2Å; H664-E667 WeakPolarHBondContact O-CB 3.25Å; H664-E667 PolarHBondContact O-N 2.97Å; H664-E667 VanDerWaalsContact O-N 3.15Å; H664-L668 WeakPolarHBondContact NE2-CD1 3.39Å; H664-L668 WeakPolarHBondContact O-CG 3.44Å; H664-L668 PolarHBondContact O-N 2.67Å
665	L	61.6	Low	59.1	Low	96 Å²	96	108.6 Å²	108.6	50%	0.503	53%	0.53	S	S	.	.	H	α-helix	trans	-63.5	-37.4	174.9	-73.6	172.5	0	0	0	111.5	E661 L662 L668 L669	E661-L665 HydrophobicContact CG-CD1 4.42Å; E661-L665 WeakPolarHBondContact O-CB 3.47Å; E661-L665 VanDerWaalsContact O-CG 3.27Å; E661-L665 WeakPolarHBondContact O-CG 3.46Å; E661-L665 PolarHBondContact O-N 2.7Å; L662-L665 PolarHBondContact O-N 3.49Å; L665-L668 HydrophobicContact CD2-CD1 4.44Å; L665-L668 PolarHBondContact O-N 3.46Å; L665-L669 VanDerWaalsContact O-CB 3.28Å; L665-L669 WeakPolarHBondContact O-CB 3.5Å; L665-L669 PolarHBondContact O-N 2.96Å
666	Q	71.3	Confident	58.6	Low	117 Å²	117	108.6 Å²	108.6	55%	0.547	53%	0.53	S	S	.	.	H	α-helix	trans	-63.7	-40.5	171.8	-76.5	173.7	-14	0	0	111.8	L662 S663 H664 L669 R670	L662-Q666 HydrophobicContact CD2-CG 4.08Å; L662-Q666 WeakPolarHBondContact O-CB 3.22Å; L662-Q666 WeakPolarHBondContact O-CG 3.37Å; L662-Q666 PolarHBondContact O-N 2.61Å; S663-Q666 PolarHBondContact O-N 2.89Å; H664-Q666 VanDerWaalsContact C-N 3.31Å; H664-Q666 PolarHBondContact O-N 3.2Å; Q666-L669 PolarHBondContact O-N 3.17Å; Q666-R670 WeakPolarHBondContact O-CB 3.45Å; Q666-R670 PolarHBondContact O-N 3.01Å
667	E	73.6	Confident	58	Low	76 Å²	76	109.5 Å²	109.5	36%	0.355	54%	0.537	S	S	.	.	H	α-helix	trans	-63.5	-43.2	174.2	-168.8	84.6	-132.7	0	0	111.4	S663 H664 R670 K671	S663-E667 PolarHBondContact O-N 3Å; H664-E667 WeakPolarHBondContact O-CB 3.25Å; H664-E667 PolarHBondContact O-N 2.97Å; H664-E667 VanDerWaalsContact O-N 3.15Å; E667-R670 PolarHBondContact O-N 3.32Å; E667-R670 IonicContact OE1-CZ 3.67Å; E667-R670 IonicContact OE1-NE 3.8Å; E667-R670 IonicContact OE1-NH2 2.79Å; E667-R670 PolarHBondContact OE1-NH2 2.95Å; E667-K671 HydrophobicContact CG-CD 4.44Å; E667-K671 WeakPolarHBondContact O-CG 3.41Å; E667-K671 PolarHBondContact O-N 3.24Å
668	L	67.6	Low	57.2	Low	84 Å²	84	115.2 Å²	115.2	44%	0.44	57%	0.571	S	S	.	*	H	α-helix	trans	-65.1	-43.4	175.8	-74	176.2	0	0	0	111.7	H664 L665 R670 K671 W672	H664-L668 WeakPolarHBondContact NE2-CD1 3.39Å; H664-L668 WeakPolarHBondContact O-CG 3.44Å; H664-L668 PolarHBondContact O-N 2.67Å; L665-L668 HydrophobicContact CD2-CD1 4.44Å; L665-L668 PolarHBondContact O-N 3.46Å; L668-R670 VanDerWaalsContact C-N 3.29Å; L668-R670 PolarHBondContact O-N 3.48Å; L668-K671 CarbonylContact O-C 3.33Å; L668-K671 PolarHBondContact O-N 3.16Å; L668-K671 VanDerWaalsContact O-N 3.15Å; L668-W672 WeakPolarHBondContact O-CB 3.23Å; L668-W672 PolarHBondContact O-N 3.01Å
669	L	72.8	Confident	56.3	Low	129 Å²	129	119.3 Å²	119.3	68%	0.675	59%	0.588	S	S	*	*	H	α-helix	trans	-61.8	-39	175.2	-166.7	81.6	0	0	0	111.1	L665 Q666 K671 W672	L665-L669 VanDerWaalsContact O-CB 3.28Å; L665-L669 WeakPolarHBondContact O-CB 3.5Å; L665-L669 PolarHBondContact O-N 2.96Å; Q666-L669 PolarHBondContact O-N 3.17Å; L669-K671 VanDerWaalsContact C-N 3.31Å; L669-K671 PolarHBondContact O-N 3Å; L669-W672 WeakPolarHBondContact O-CB 3.43Å; L669-W672 PolarHBondContact O-N 3.39Å
670	R	74	Confident	55.2	Low	194 Å²	194	120.7 Å²	120.7	73%	0.732	60%	0.604	S	S	*	*	H	α-helix	trans	-66.4	-33.5	175.9	-167.1	177.3	73.3	151.8	-2.1	112.3	Q666 E667 L668	Q666-R670 WeakPolarHBondContact O-CB 3.45Å; Q666-R670 PolarHBondContact O-N 3.01Å; E667-R670 PolarHBondContact O-N 3.32Å; E667-R670 IonicContact OE1-CZ 3.67Å; E667-R670 IonicContact OE1-NE 3.8Å; E667-R670 IonicContact OE1-NH2 2.79Å; E667-R670 PolarHBondContact OE1-NH2 2.95Å; L668-R670 VanDerWaalsContact C-N 3.29Å; L668-R670 PolarHBondContact O-N 3.48Å
671	K	75	Confident	54	Low	140 Å²	140	123.9 Å²	123.9	61%	0.609	62%	0.615	S	S	*	*	H	α-helix	trans	-82.7	-17.1	175.5	-70.5	172.4	-177.6	175.3	0	112.9	E667 L668 L669 T673	E667-K671 HydrophobicContact CG-CD 4.44Å; E667-K671 WeakPolarHBondContact O-CG 3.41Å; E667-K671 PolarHBondContact O-N 3.24Å; L668-K671 CarbonylContact O-C 3.33Å; L668-K671 PolarHBondContact O-N 3.16Å; L668-K671 VanDerWaalsContact O-N 3.15Å; L669-K671 VanDerWaalsContact C-N 3.31Å; L669-K671 PolarHBondContact O-N 3Å; K671-T673 PolarHBondContact O-N 2.85Å; K671-T673 VanDerWaalsContact O-N 3.1Å
672	W	62.6	Low	52.7	Low	180 Å²	180	127.1 Å²	127.1	68%	0.682	64%	0.642	S	S	*	*			trans	-73.6	103.4	-179.5	-166.6	81.5	0	0	0	109.8	L668 L669 P674	L668-W672 WeakPolarHBondContact O-CB 3.23Å; L668-W672 PolarHBondContact O-N 3.01Å; L669-W672 WeakPolarHBondContact O-CB 3.43Å; L669-W672 PolarHBondContact O-N 3.39Å; W672-P674 HydrophobicContact CE3-CB 4.43Å; W672-P674 HydrophobicContact CH2-CB 3.99Å; W672-P674 HydrophobicContact CZ3-CB 3.75Å
673	T	44.1	Very low	51.3	Low	118 Å²	118	132.1 Å²	132.1	72%	0.724	66%	0.66	S	S	*	*			trans	-89.1	124.2	168.8	32.4	0	0	0	0	108.4	K671 R675	K671-T673 PolarHBondContact O-N 2.85Å; K671-T673 VanDerWaalsContact O-N 3.1Å; T673-R675 PolarHBondContact O-N 3.15Å
674	P	45.2	Very low	49.9	Very low	67 Å²	67	139.8 Å²	139.8	44%	0.435	69%	0.686	S	S	.	*			trans	-65.7	128	177	28.4	-33.3	0	0	0	108	W672 I676	W672-P674 HydrophobicContact CE3-CB 4.43Å; W672-P674 HydrophobicContact CH2-CB 3.99Å; W672-P674 HydrophobicContact CZ3-CB 3.75Å; P674-I676 HydrophobicContact CB-CD1 4.17Å; P674-I676 HydrophobicContact CB-CG1 3.94Å; P674-I676 HydrophobicContact CG-CD1 3.9Å; P674-I676 HydrophobicContact CG-CG1 4.13Å; P674-I676 PolarHBondContact O-N 3.22Å
675	R	38.2	Very low	48.7	Very low	254 Å²	254	146.7 Å²	146.7	96%	0.958	71%	0.708	S	S	*	*			trans	-68.3	81.4	164.9	-73.2	-170.8	-175.6	-173.2	3	107.9	T673	T673-R675 PolarHBondContact O-N 3.15Å
676	I	39.4	Very low	47.5	Very low	135 Å²	135	148.6 Å²	148.6	69%	0.692	72%	0.719	S	S	*	*			trans	-89.6	108.9	166.7	-59.9	173.4	0	0	0	105.5	P674	P674-I676 HydrophobicContact CB-CD1 4.17Å; P674-I676 HydrophobicContact CB-CG1 3.94Å; P674-I676 HydrophobicContact CG-CD1 3.9Å; P674-I676 HydrophobicContact CG-CG1 4.13Å; P674-I676 PolarHBondContact O-N 3.22Å
677	S	32.6	Very low	46	Very low	96 Å²	96	148.5 Å²	148.5	67%	0.671	73%	0.728	S	S	*	*			trans	-53.4	133.2	163.1	32.8	0	0	0	0	109	E679	S677-E679 VanDerWaalsContact C-N 3.29Å; S677-E679 PolarHBondContact O-N 3.23Å
678	P	33.5	Very low	44.1	Very low	130 Å²	130	153.1 Å²	153.1	84%	0.844	75%	0.749	S	S	*	*	S	Bend	trans	-81.9	73	-168.4	33.9	-34.9	0	0	0	110.9
679	E	34.3	Very low	42.6	Very low	179 Å²	179	154.5 Å²	154.5	84%	0.836	76%	0.761	S	S	*	*			trans	-138.6	116.3	158.3	-73.9	-166.5	166.1	0	0	110.7	S677	S677-E679 VanDerWaalsContact C-N 3.29Å; S677-E679 PolarHBondContact O-N 3.23Å
680	V	30.4	Very low	40.9	Very low	144 Å²	144	156.3 Å²	156.3	87%	0.873	77%	0.77	S	S	*	*			trans	127.6	109.1	156.5	-174.1	0	0	0	0	112.2
681	H	30.6	Very low	39.4	Very low	177 Å²	177	152.1 Å²	152.1	82%	0.819	76%	0.761	S	S	*	*			trans	-71.3	147.1	-176.7	-85.9	7.3	0	0	0	115.1
682	S	31.4	Very low	37.5	Very low	106 Å²	106	150.6 Å²	150.6	74%	0.741	76%	0.76	S	S	*	*			trans	77.6	108.9	144.1	86	0	0	0	0	119
683	K	31.3	Very low	36.4	Very low	198 Å²	198	146.5 Å²	146.5	86%	0.861	76%	0.756	S	S	*	*				-168	121	107.3	-97.6	167.9	-174.9	178.8	0	108.4	R685	K683-R685 PolarHBondContact O-N 3.35Å
684	K	39.2	Very low	36.2	Very low	221 Å²	221	146 Å²	146	96%	0.961	75%	0.753	S	S	*	*			trans	-56.1	127.2	172.3	-79.8	179	172.2	-179.8	0	109.3
685	R	34.7	Very low	35.9	Very low	240 Å²	240	148.3 Å²	148.3	91%	0.906	76%	0.759	S	S	*	*			trans	-127.9	140	157.6	-81.4	-170.8	-169	178.3	4	108.9	K683	K683-R685 PolarHBondContact O-N 3.35Å
686	D	36.1	Very low	36.3	Very low	136 Å²	136	140.4 Å²	140.4	73%	0.727	73%	0.734	S	S	*	*			trans	-63.9	145.1	-172.4	-83.1	-43.9	0	0	0	113.7	H688	D686-H688 PolarHBondContact O-N 3.23Å; D686-H688 VanDerWaalsContact O-N 3.14Å
687	P	40	Very low	36.4	Very low	115 Å²	115	138.4 Å²	138.4	75%	0.747	73%	0.728	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.8	10.2	-175.7	30.5	-34.7	0	0	0	115.6
688	H	33.7	Very low	36.8	Very low	173 Å²	173	136.1 Å²	136.1	80%	0.801	72%	0.719	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.9	16.5	-174.5	-70.2	-53.6	0	0	0	115.7	D686 I690	D686-H688 PolarHBondContact O-N 3.23Å; D686-H688 VanDerWaalsContact O-N 3.14Å; H688-I690 PolarHBondContact O-N 3.37Å
689	T	34.8	Very low	37.3	Very low	113 Å²	113	136 Å²	136	69%	0.693	71%	0.71	S	S	*	*			trans	-90.4	108.8	175.9	-38.6	0	0	0	0	110	L691	T689-L691 PolarHBondContact O-N 2.91Å
690	I	38	Very low	37.6	Very low	167 Å²	167	133.6 Å²	133.6	86%	0.856	70%	0.703	S	S	*	*	P	Polyproline II helix	trans	-65.7	116.5	168.7	-61.6	171.6	0	0	0	107.2	H688	H688-I690 PolarHBondContact O-N 3.37Å
691	L	42	Very low	38	Very low	105 Å²	105	134.4 Å²	134.4	55%	0.55	69%	0.694	S	S	.	*	P	Polyproline II helix	trans	-72	132.4	179.6	-76.7	163.4	0	0	0	110.5	T689 E695	T689-L691 PolarHBondContact O-N 2.91Å; L691-E695 WeakPolarHBondContact CD2-OE2 3.45Å
692	N	35.4	Very low	38.4	Very low	109 Å²	109	128.9 Å²	128.9	58%	0.583	69%	0.685	S	S	*	*	P	Polyproline II helix	trans	-73.6	143.3	177.1	-119.8	-16.1	0	0	0	110.1	T694 E695	N692-T694 PolarHBondContact O-N 3.15Å; N692-E695 PolarHBondContact O-N 3.45Å
693	P	39.7	Very low	38.6	Very low	93 Å²	93	133.7 Å²	133.7	60%	0.604	69%	0.687	S	S	*	*	H	α-helix	trans	-56.9	-26.4	-176.9	-24.4	32.6	0	0	0	114.4
694	T	39.3	Very low	38.9	Very low	108 Å²	108	128 Å²	128	66%	0.663	68%	0.677	S	S	*	*	H	α-helix	trans	-73	-25.4	179	36.3	0	0	0	0	114	N692	N692-T694 PolarHBondContact O-N 3.15Å
695	E	39.6	Very low	38.8	Very low	116 Å²	116	126 Å²	126	54%	0.542	67%	0.671	S	S	.	*	H	α-helix	trans	-79.9	-29.1	176.7	-70	-175.4	152	0	0	112.1	L691 N692 V697 G698 I699	L691-E695 WeakPolarHBondContact CD2-OE2 3.45Å; N692-E695 PolarHBondContact O-N 3.45Å; E695-V697 VanDerWaalsContact C-N 3.33Å; E695-V697 PolarHBondContact O-N 3.21Å; E695-G698 PolarHBondContact O-N 2.75Å; E695-I699 PolarHBondContact O-N 2.71Å
696	I	45.9	Very low	39.1	Very low	88 Å²	88	117.3 Å²	117.3	45%	0.451	66%	0.656	S	S	.	*	H	α-helix	trans	-66.5	-37.1	176.5	-61.2	175.3	0	0	0	110.8	G698 I699 L700	I696-G698 VanDerWaalsContact C-N 3.31Å; I696-G698 PolarHBondContact O-N 3.1Å; I696-I699 PolarHBondContact O-N 2.78Å; I696-L700 HydrophobicContact CG2-CD1 4.22Å; I696-L700 PolarHBondContact O-N 3.21Å
697	V	43	Very low	39	Very low	93 Å²	93	118.1 Å²	118.1	56%	0.564	66%	0.66	S	S	*	*	H	α-helix	trans	-66.7	-32.8	176	177.5	0	0	0	0	111.7	E695 K701	E695-V697 VanDerWaalsContact C-N 3.33Å; E695-V697 PolarHBondContact O-N 3.21Å; V697-K701 PolarHBondContact O-N 2.78Å
698	G	39.2	Very low	39	Very low	47 Å²	47	120.8 Å²	120.8	49%	0.485	67%	0.667	S	S	.	*	H	α-helix	trans	-68.3	-38	176.9	0	0	0	0	0	113.6	E695 I696 G702	E695-G698 PolarHBondContact O-N 2.75Å; I696-G698 VanDerWaalsContact C-N 3.31Å; I696-G698 PolarHBondContact O-N 3.1Å; G698-G702 PolarHBondContact O-N 3.04Å
699	I	45.2	Very low	38.9	Very low	128 Å²	128	119.6 Å²	119.6	66%	0.656	70%	0.701	S	S	*	*	H	α-helix	trans	-73.9	-34.1	-179.4	-63.5	170.6	0	0	0	111.4	E695 I696	E695-I699 PolarHBondContact O-N 2.71Å; I696-I699 PolarHBondContact O-N 2.78Å
700	L	39.2	Very low	39.1	Very low	128 Å²	128	119.9 Å²	119.9	67%	0.67	70%	0.702	S	S	*	*	H	α-helix	trans	-72.7	-32.2	175.9	-71.3	168.7	0	0	0	112.6	I696	I696-L700 HydrophobicContact CG2-CD1 4.22Å; I696-L700 PolarHBondContact O-N 3.21Å
701	K	38.9	Very low	39.2	Very low	162 Å²	162	117.4 Å²	117.4	70%	0.704	69%	0.694	S	S	*	*	H	α-helix	trans	-70.4	-36.3	176.3	-117.7	-179.9	177.1	-176.8	0	113.2	V697 R703	V697-K701 PolarHBondContact O-N 2.78Å; K701-R703 PolarHBondContact O-N 3.34Å
702	G	39.7	Very low	39	Very low	60 Å²	60	118.1 Å²	118.1	62%	0.619	70%	0.702	S	S	*	*	H	α-helix	trans	-71.5	-10.4	-179.3	0	0	0	0	0	115.5	G698	G698-G702 PolarHBondContact O-N 3.04Å
703	R	36.5	Very low	39.3	Very low	207 Å²	207	118.6 Å²	118.6	78%	0.781	71%	0.709	S	S	*	*	H	α-helix	trans	-102	-16.9	-178.8	-137	175.3	-173	174.7	1.3	113.8	K701 E705	K701-R703 PolarHBondContact O-N 3.34Å; R703-E705 VanDerWaalsContact C-N 3.34Å
704	A	36.5	Very low	39.2	Very low	79 Å²	79	120.3 Å²	120.3	65%	0.653	72%	0.715	S	S	*	*	H	α-helix	trans	-79.1	-16.1	176.4	0	0	0	0	0	113.4
705	E	38	Very low	39.2	Very low	180 Å²	180	121.1 Å²	121.1	84%	0.841	72%	0.719	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93	2	176.5	-69.9	-177.1	164.6	0	0	113.5	R703	R703-E705 VanDerWaalsContact C-N 3.34Å
706	G	39.9	Very low	39.2	Very low	57 Å²	57	121.4 Å²	121.4	59%	0.588	73%	0.731	S	S	*	*	S	Bend	trans	-101.3	-15.2	-177.6	0	0	0	0	0	116.6
707	D	35.4	Very low	38.7	Very low	152 Å²	152	124 Å²	124	81%	0.813	75%	0.753	S	S	*	*	S	Bend	trans	-111.7	31.7	-175.3	-73.8	-23.8	0	0	0	112.8
708	L	38.8	Very low	38.3	Very low	172 Å²	172	126.6 Å²	126.6	90%	0.901	77%	0.769	S	S	*	*			trans	-114.9	75.6	157.7	-87	160.6	0	0	0	107.7
709	G	32.8	Very low	38.2	Very low	147 Å²	147	133.8 Å²	133.8	100%	1.515	80%	0.795	S	S	*	*			trans	-155.7	0	175.8	0	0	0	0	0	110.7

Retrieved 709 of 709 residues in 155.3 ms (Link to these results)

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