A0A077YW42_TRITR Loading...

BTB domain containing protein

AlphaFold DB , UniProt , Accession A0A077YW42, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 385 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	38.2	Very low	29.4	Very low	240 Å²	240	154.6 Å²	154.6	100%	1.182	81%	0.807	S	S	*	*				0	116.6	0	-151.3	167	79	0	0	106.4	L3	M1-L3 PolarHBondContact O-N 3.26Å
2	M	30.7	Very low	29.2	Very low	193 Å²	193	156.5 Å²	156.5	95%	0.951	80%	0.804	S	S	*	*			trans	-56.9	123.9	-163.5	-81.1	-121.6	-165.4	0	0	112.8	Q4	M2-Q4 PolarHBondContact O-N 2.66Å
3	L	27.9	Very low	28.9	Very low	155 Å²	155	152.7 Å²	152.7	81%	0.812	80%	0.8	S	S	*	*			trans	-74.1	104.9	173.2	-140.6	82.8	0	0	0	107.9	M1 I5	M1-L3 PolarHBondContact O-N 3.26Å; L3-I5 HydrophobicContact CD2-CG1 4.48Å; L3-I5 PolarHBondContact O-N 3.4Å
4	Q	29.9	Very low	29	Very low	188 Å²	188	154 Å²	154	88%	0.879	81%	0.807	S	S	*	*			trans	-79	100.7	168	-85.4	-169.2	-30.8	0	0	108.7	M2 V6	M2-Q4 PolarHBondContact O-N 2.66Å; Q4-V6 PolarHBondContact O-N 3.28Å
5	I	27.7	Very low	28.8	Very low	141 Å²	141	149.4 Å²	149.4	72%	0.723	81%	0.811	S	S	*	*			trans	-70.9	105.2	175	-63.6	167.4	0	0	0	107.5	L3 S7	L3-I5 HydrophobicContact CD2-CG1 4.48Å; L3-I5 PolarHBondContact O-N 3.4Å; I5-S7 PolarHBondContact O-N 3.15Å
6	V	32.2	Very low	28.7	Very low	122 Å²	122	145.1 Å²	145.1	74%	0.739	81%	0.812	S	S	*	*			trans	-71.1	107.8	165.8	179.2	0	0	0	0	106.7	Q4 T8	Q4-V6 PolarHBondContact O-N 3.28Å; V6-T8 VanDerWaalsContact C-N 3.29Å; V6-T8 PolarHBondContact O-N 2.94Å; V6-T8 PolarHBondContact O-OG1 3.48Å
7	S	25.4	Very low	28.4	Very low	99 Å²	99	146.6 Å²	146.6	69%	0.692	82%	0.819	S	S	*	*			trans	-73.9	82.2	179.2	-169	0	0	0	0	110	I5 I9	I5-S7 PolarHBondContact O-N 3.15Å; S7-I9 PolarHBondContact O-N 3.47Å
8	T	27.8	Very low	28.3	Very low	104 Å²	104	144 Å²	144	64%	0.638	82%	0.819	S	S	*	*			trans	-70	100.9	166.3	2	0	0	0	0	108.9	V6 F10	V6-T8 VanDerWaalsContact C-N 3.29Å; V6-T8 PolarHBondContact O-N 2.94Å; V6-T8 PolarHBondContact O-OG1 3.48Å; T8-F10 HydrophobicContact CG2-CE2 4.29Å; T8-F10 PolarHBondContact O-N 3.05Å; T8-F10 VanDerWaalsContact O-N 3.11Å
9	I	28.8	Very low	28.1	Very low	138 Å²	138	141.8 Å²	141.8	71%	0.708	82%	0.82	S	S	*	*			trans	-75.8	97.3	173.2	-62	175.1	0	0	0	107.8	S7 L11	S7-I9 PolarHBondContact O-N 3.47Å; I9-L11 HydrophobicContact CG2-CG 4.27Å; I9-L11 PolarHBondContact O-N 3.11Å
10	F	26.1	Very low	28.1	Very low	153 Å²	153	142.6 Å²	142.6	67%	0.671	82%	0.82	S	S	*	*			trans	-81.5	105.8	165.5	-82.4	-85	0	0	0	109	T8 F12	T8-F10 HydrophobicContact CG2-CE2 4.29Å; T8-F10 PolarHBondContact O-N 3.05Å; T8-F10 VanDerWaalsContact O-N 3.11Å; F10-F12 HydrophobicContact CB-CD2 3.99Å; F10-F12 HydrophobicContact CB-CE2 4.11Å; F10-F12 AromaticContact CD1-CE2 3.94Å; F10-F12 HydrophobicContact CD1-CE2 3.94Å; F10-F12 HydrophobicContact CG-CE2 4.23Å; F10-F12 PolarHBondContact O-N 3.01Å
11	L	28.3	Very low	27.9	Very low	168 Å²	168	143.3 Å²	143.3	88%	0.88	82%	0.821	S	S	*	*			trans	-83.1	86.8	164.5	-82.6	158.3	0	0	0	108.3	I9 S13	I9-L11 HydrophobicContact CG2-CG 4.27Å; I9-L11 PolarHBondContact O-N 3.11Å; L11-S13 PolarHBondContact O-N 3.11Å
12	F	27.5	Very low	27.1	Very low	177 Å²	177	143.4 Å²	143.4	78%	0.776	81%	0.808	S	S	*	*			trans	-73	116.1	164.6	-88.1	-78.6	0	0	0	109.3	F10	F10-F12 HydrophobicContact CB-CD2 3.99Å; F10-F12 HydrophobicContact CB-CE2 4.11Å; F10-F12 AromaticContact CD1-CE2 3.94Å; F10-F12 HydrophobicContact CD1-CE2 3.94Å; F10-F12 HydrophobicContact CG-CE2 4.23Å; F10-F12 PolarHBondContact O-N 3.01Å
13	S	25.7	Very low	26.7	Very low	107 Å²	107	144.5 Å²	144.5	75%	0.748	80%	0.803	S	S	*	*			trans	-74.2	117.4	166.9	109.3	0	0	0	0	108.4	L11	L11-S13 PolarHBondContact O-N 3.11Å
14	L	29.9	Very low	26.5	Very low	171 Å²	171	145.9 Å²	145.9	90%	0.895	81%	0.805	S	S	*	*			trans	-161.9	113	147.2	-139.3	75.8	0	0	0	111.9
15	G	26.4	Very low	26.3	Very low	85 Å²	85	142 Å²	142	88%	0.876	79%	0.794	S	S	*	*			trans	69.5	115.4	139.2	0	0	0	0	0	119.8
16	G	26.3	Very low	26.2	Very low	80 Å²	80	142.7 Å²	142.7	83%	0.825	80%	0.798	S	S	*	*			trans	146.6	102.6	151.4	0	0	0	0	0	115
17	N	23.8	Very low	25.9	Very low	172 Å²	172	144.5 Å²	144.5	92%	0.92	80%	0.798	S	S	*	*			trans	-59.7	131.1	176.2	-63.5	-48.1	0	0	0	113.1
18	A	27.8	Very low	25.8	Very low	99 Å²	99	151.3 Å²	151.3	82%	0.818	81%	0.809	S	S	*	*			trans	-179.3	135.6	130.4	0	0	0	0	0	110	L20	A18-L20 PolarHBondContact O-N 3.27Å
19	A	24.4	Very low	26.2	Very low	103 Å²	103	150.9 Å²	150.9	85%	0.851	81%	0.806	S	S	*	*			trans	-59.6	126.8	-174.2	0	0	0	0	0	113.6
20	L	27.7	Very low	26.3	Very low	156 Å²	156	146 Å²	146	82%	0.817	79%	0.789	S	S	*	*			trans	-149.2	103.9	157	-102.1	164	0	0	0	109.9	A18	A18-L20 PolarHBondContact O-N 3.27Å
21	L	23.8	Very low	26.8	Very low	159 Å²	159	143.9 Å²	143.9	83%	0.832	79%	0.785	S	S	*	*			trans	38.9	102.1	149.4	-68.8	161.2	0	0	0	118.5	Y23	L21-Y23 PolarHBondContact O-N 2.89Å
22	R	21.6	Very low	27.3	Very low	242 Å²	242	137.5 Å²	137.5	91%	0.913	75%	0.752	S	S	*	*			trans	-32.2	110.3	157.9	-66.5	175.1	175.6	177.8	-1.8	113
23	Y	21.8	Very low	27.6	Very low	216 Å²	216	137.9 Å²	137.9	85%	0.847	76%	0.756	S	S	*	*			trans	-138.3	48.8	151.4	-121.6	-87.9	0	0	0	109.8	L21 V25	L21-Y23 PolarHBondContact O-N 2.89Å; Y23-V25 HydrophobicContact CD1-CG2 4.31Å; Y23-V25 HydrophobicContact CE1-CG2 4.45Å; Y23-V25 PolarHBondContact O-N 3.23Å
24	E	24.6	Very low	28	Very low	184 Å²	184	138 Å²	138	86%	0.86	75%	0.754	S	S	*	*			trans	-87.9	87	165.7	-75.1	-174.2	165.1	0	0	108.8	L26	E24-L26 PolarHBondContact O-N 3.23Å
25	V	24.6	Very low	28.3	Very low	106 Å²	106	136 Å²	136	64%	0.642	75%	0.749	S	S	*	*			trans	-79.7	68.4	159.8	-176.6	0	0	0	0	107.2	Y23 H27	Y23-V25 HydrophobicContact CD1-CG2 4.31Å; Y23-V25 HydrophobicContact CE1-CG2 4.45Å; Y23-V25 PolarHBondContact O-N 3.23Å; V25-H27 VanDerWaalsContact CG1-CD2 3.47Å; V25-H27 WeakPolarHBondContact CG1-CD2 3.29Å; V25-H27 PolarHBondContact O-N 3.45Å
26	L	25.1	Very low	28.5	Very low	155 Å²	155	140.9 Å²	140.9	81%	0.812	75%	0.746	S	S	*	*			trans	-92.3	85.5	166.3	-160.2	81.4	0	0	0	107.1	E24 R28	E24-L26 PolarHBondContact O-N 3.23Å; L26-R28 PolarHBondContact O-N 3.1Å
27	H	26.6	Very low	28.9	Very low	161 Å²	161	147.1 Å²	147.1	75%	0.745	75%	0.75	S	S	*	*			trans	-62.6	110.5	171.2	-85.2	-74.4	0	0	0	108.9	V25 V29	V25-H27 VanDerWaalsContact CG1-CD2 3.47Å; V25-H27 WeakPolarHBondContact CG1-CD2 3.29Å; V25-H27 PolarHBondContact O-N 3.45Å; H27-V29 PolarHBondContact O-N 3.09Å; H27-V29 VanDerWaalsContact O-N 3.07Å
28	R	24.3	Very low	29.3	Very low	241 Å²	241	145.6 Å²	145.6	91%	0.909	74%	0.742	S	S	*	*			trans	-49.2	112.9	165.5	-87	-178.2	177.9	177.5	-0.5	109	L26 G30	L26-R28 PolarHBondContact O-N 3.1Å; R28-G30 PolarHBondContact O-N 2.81Å
29	V	35.8	Very low	29.6	Very low	95 Å²	95	144.4 Å²	144.4	58%	0.576	74%	0.739	S	S	*	*			trans	-70.6	75.1	159.4	-178.2	0	0	0	0	106.7	H27	H27-V29 PolarHBondContact O-N 3.09Å; H27-V29 VanDerWaalsContact O-N 3.07Å
30	G	30	Very low	30.3	Very low	35 Å²	35	147.6 Å²	147.6	36%	0.361	74%	0.742	S	S	.	*			trans	-81.2	126.5	176	0	0	0	0	0	110.4	R28	R28-G30 PolarHBondContact O-N 2.81Å
31	D	36.5	Very low	31.1	Very low	110 Å²	110	142.7 Å²	142.7	59%	0.588	73%	0.729	S	S	*	*			trans	81.7	46.9	162.6	-42.4	-30.7	0	0	0	118.3	K159	D31-K159 IonicContact OD2-NZ 2.75Å; D31-K159 PolarHBondContact OD2-NZ 3.1Å
32	L	38.2	Very low	32.4	Very low	33 Å²	33	141.2 Å²	141.2	17%	0.173	73%	0.729	C	S	.	*	S	Bend	trans	-75.2	124.6	139.2	-76.7	167.5	0	0	0	106.1	P34 I52 I197	L32-P34 WeakPolarHBondContact O-CD 3.42Å; L32-I52 HydrophobicContact CD1-CD1 4.22Å; L32-I197 HydrophobicContact CB-CD1 4.05Å; L32-I197 HydrophobicContact CB-CG1 4.26Å; L32-I197 HydrophobicContact CD1-CD1 3.66Å; L32-I197 HydrophobicContact CD1-CG1 3.63Å; L32-I197 HydrophobicContact CG-CD1 4.41Å
33	Q	35.4	Very low	34.3	Very low	186 Å²	186	135.3 Å²	135.3	87%	0.869	72%	0.72	S	S	*	*			trans	-49.1	112.2	-169.6	-77.7	-169.7	-17	0	0	111.1	V35	Q33-V35 PolarHBondContact O-N 2.99Å
34	P	34.4	Very low	36.4	Very low	109 Å²	109	127.4 Å²	127.4	71%	0.708	70%	0.696	S	S	*	*			trans	-66.1	133.7	166.5	26.3	-30.1	0	0	0	107.7	L32 K36	L32-P34 WeakPolarHBondContact O-CD 3.42Å; P34-K36 PolarHBondContact O-N 3.1Å
35	V	35.9	Very low	38.8	Very low	129 Å²	129	125.6 Å²	125.6	78%	0.782	69%	0.692	S	S	*	*			trans	-46.2	127.9	168.6	176.9	0	0	0	0	108.1	Q33 K37	Q33-V35 PolarHBondContact O-N 2.99Å; V35-K37 PolarHBondContact O-N 2.92Å
36	K	30.7	Very low	41.1	Very low	187 Å²	187	129 Å²	129	81%	0.813	70%	0.701	S	S	*	*			trans	-39.5	120.2	-171.9	-72.2	176.2	175.6	176.8	0	112.1	P34 N38	P34-K36 PolarHBondContact O-N 3.1Å; K36-N38 VanDerWaalsContact C-N 3.26Å; K36-N38 PolarHBondContact O-N 3.43Å
37	K	33.6	Very low	43.6	Very low	212 Å²	212	125.7 Å²	125.7	92%	0.922	69%	0.687	S	S	*	*			trans	-63.8	85.6	163.2	-90.4	-173.9	172.1	-179	0	109.2	V35	V35-K37 PolarHBondContact O-N 2.92Å
38	N	32.3	Very low	46.2	Very low	139 Å²	139	121.3 Å²	121.3	74%	0.743	68%	0.675	S	S	*	*			trans	-80	130.9	153	-91.9	0.6	0	0	0	107.4	K36	K36-N38 VanDerWaalsContact C-N 3.26Å; K36-N38 PolarHBondContact O-N 3.43Å
39	G	34.9	Very low	48.7	Very low	74 Å²	74	115.4 Å²	115.4	76%	0.763	65%	0.653	S	S	*	*	S	Bend	trans	-53.4	139.1	176.1	0	0	0	0	0	110.8
40	N	38.6	Very low	51	Low	171 Å²	171	114.6 Å²	114.6	91%	0.914	65%	0.651	S	S	*	*			trans	79	44.6	-175.5	-55.7	-3.9	0	0	0	116.1
41	G	44.3	Very low	53.5	Low	53 Å²	53	116.4 Å²	116.4	55%	0.546	66%	0.655	S	S	.	*	P	Polyproline II helix	trans	-69.5	146.7	160	0	0	0	0	0	111.1	T43	G41-T43 PolarHBondContact O-N 2.79Å
42	P	51.1	Low	55.9	Low	128 Å²	128	114.5 Å²	114.5	83%	0.831	64%	0.644	S	S	*	*	P	Polyproline II helix	trans	-55.6	130.8	178.4	22.3	-31.7	0	0	0	110.5
43	T	61.1	Low	58.3	Low	117 Å²	117	118.8 Å²	118.8	72%	0.718	66%	0.662	S	S	*	*	P	Polyproline II helix	trans	-69.5	128.9	171.2	42.1	0	0	0	0	108.8	G41	G41-T43 PolarHBondContact O-N 2.79Å
44	C	65.7	Low	61	Low	50 Å²	50	112.6 Å²	112.6	34%	0.338	64%	0.639	S	S	.	*			trans	-96	92.6	175.9	-152.9	0	0	0	0	107.2	E46 C201	C44-E46 VanDerWaalsContact C-N 3.26Å; C44-E46 PolarHBondContact O-N 2.83Å; C44-C201 HydrophobicContact CB-CB 4.44Å; C44-C201 WeakPolarHBondContact CB-SG 3.41Å; C44-C201 VanDerWaalsContact SG-CA 3.52Å; C44-C201 WeakPolarHBondContact SG-CB 3.1Å; C44-C201 CovalentContact SG-SG 2.04Å; C44-C201 PolarHBondContact SG-SG 2.99Å
45	D	75.6	Confident	63.8	Low	146 Å²	146	109.2 Å²	109.2	78%	0.781	62%	0.616	S	S	*	*			trans	-78.3	-11.6	-172.3	-63.6	-23.3	0	0	0	113.1
46	E	74	Confident	66.5	Low	178 Å²	178	108.5 Å²	108.5	83%	0.832	60%	0.604	S	S	*	*	S	Bend	trans	-109.5	-110.6	-177.8	-61	-173.3	176.2	0	0	112.1	C44	C44-E46 VanDerWaalsContact C-N 3.26Å; C44-E46 PolarHBondContact O-N 2.83Å
47	T	77.4	Confident	69.5	Low	85 Å²	85	100 Å²	100	52%	0.521	57%	0.569	S	S	.	*			trans	-117.7	132.5	-176.1	-59.2	0	0	0	0	110.4	D202	T47-D202 PolarHBondContact O-N 3.42Å
48	S	79.6	Confident	72.5	Confident	69 Å²	69	95.2 Å²	95.2	48%	0.483	55%	0.549	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	141.9	169	58.4	0	0	0	0	110	V200	S48-V200 CarbonylContact C-O 3.57Å; S48-V200 VanDerWaalsContact CA-O 3.3Å; S48-V200 WeakPolarHBondContact CA-O 3.27Å
49	R	78.6	Confident	75.6	Confident	117 Å²	117	90.1 Å²	90.1	44%	0.442	52%	0.521	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	121.3	173.6	-173.6	174.6	-67	99.1	17.5	109.6	T199 V200 D202	R49-T199 WeakPolarHBondContact O-CA 3.46Å; R49-V200 HydrophobicContact CB-CG2 4.44Å; R49-V200 PolarHBondContact N-O 3.27Å; R49-V200 PolarHBondContact O-N 2.85Å; R49-D202 IonicContact CZ-OD1 3.49Å; R49-D202 IonicContact CZ-OD2 3.44Å; R49-D202 IonicContact NH1-OD1 3.55Å; R49-D202 PolarHBondContact NH1-OD1 3.37Å; R49-D202 IonicContact NH1-OD2 3.5Å; R49-D202 PolarHBondContact NH1-OD2 2.85Å; R49-D202 IonicContact NH2-OD1 3.37Å; R49-D202 IonicContact NH2-OD2 2.64Å; R49-D202 PolarHBondContact NH2-OD2 3.05Å
50	S	82.8	Confident	78.6	Confident	78 Å²	78	93.8 Å²	93.8	55%	0.545	51%	0.512	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	125.3	170.5	-62.4	0	0	0	0	109.7	S198 T199	S50-S198 CarbonylContact C-O 3.57Å; S50-S198 VanDerWaalsContact CA-O 3.29Å; S50-S198 WeakPolarHBondContact CA-O 3.24Å; S50-T199 WeakPolarHBondContact OG-CG2 3.29Å; S50-T199 PolarHBondContact OG-OG1 3.16Å
51	T	82.5	Confident	81.4	Confident	73 Å²	73	87 Å²	87	45%	0.448	47%	0.473	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	146	176.3	-53.2	0	0	0	0	109.3	I197 S198	T51-I197 WeakPolarHBondContact O-CA 3.41Å; T51-S198 PolarHBondContact N-O 3.42Å; T51-S198 PolarHBondContact O-N 2.84Å
52	I	86.7	Confident	84	Confident	70 Å²	70	88.7 Å²	88.7	36%	0.359	47%	0.469	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	119.9	174.1	-169.2	164.6	0	0	0	109.4	L32 Y194 E196 I197	L32-I52 HydrophobicContact CD1-CD1 4.22Å; I52-Y194 HydrophobicContact CD1-CD1 3.33Å; I52-Y194 HydrophobicContact CD1-CD2 4.47Å; I52-Y194 HydrophobicContact CD1-CE1 3.92Å; I52-Y194 HydrophobicContact CD1-CG 3.66Å; I52-Y194 HydrophobicContact CG1-CD1 3.86Å; I52-Y194 HydrophobicContact CG1-CG 4.39Å; I52-E196 CarbonylContact C-O 3.54Å; I52-E196 WeakPolarHBondContact CA-O 3.3Å; I52-I197 HydrophobicContact CB-CG1 4.26Å; I52-I197 HydrophobicContact CD1-CD1 4.31Å; I52-I197 HydrophobicContact CD1-CG1 3.97Å; I52-I197 HydrophobicContact CG1-CG1 3.92Å
53	K	88.6	Confident	86.1	Confident	123 Å²	123	82.7 Å²	82.7	54%	0.535	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	128.9	170.7	-171.5	-178.7	177.7	-159.1	0	108.5	E195 E196	K53-E195 HydrophobicContact CB-CB 4.46Å; K53-E195 WeakPolarHBondContact CD-OE2 3.2Å; K53-E195 WeakPolarHBondContact CE-OE2 3.13Å; K53-E195 HydrophobicContact CG-CB 4.47Å; K53-E195 IonicContact NZ-OE2 3.23Å; K53-E195 PolarHBondContact NZ-OE2 3.08Å; K53-E195 VanDerWaalsContact NZ-OE2 3.08Å; K53-E195 PolarHBondContact O-N 3Å; K53-E196 HydrophobicContact CB-CB 4.45Å; K53-E196 PolarHBondContact N-O 2.76Å
54	S	92.3	Very high	87.7	Confident	57 Å²	57	83 Å²	83	40%	0.399	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	151.9	178.1	70.1	0	0	0	0	112.2	I193	S54-I193 CarbonylContact C-O 3.53Å; S54-I193 WeakPolarHBondContact CA-O 3.28Å; S54-I193 VanDerWaalsContact CB-O 3.27Å; S54-I193 WeakPolarHBondContact CB-O 3.38Å
55	T	92.7	Very high	89.1	Confident	37 Å²	37	84.8 Å²	84.8	23%	0.227	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	129.3	174.4	-70.9	0	0	0	0	108.8	P88 I193 E195	T55-P88 HydrophobicContact CG2-CG 3.82Å; T55-I193 PolarHBondContact N-O 3.14Å; T55-I193 PolarHBondContact O-N 2.72Å; T55-E195 WeakPolarHBondContact CB-OE1 3.35Å; T55-E195 PolarHBondContact OG1-OE1 3.07Å
56	Q	93.8	Very high	90	Very high	114 Å²	114	78 Å²	78	53%	0.533	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	136.9	178.9	-167.6	175.2	98.7	0	0	111.2	V190 V191	Q56-V190 VanDerWaalsContact CD-CG1 3.48Å; Q56-V190 HydrophobicContact CG-CG1 3.57Å; Q56-V191 CarbonylContact C-O 3.55Å; Q56-V191 WeakPolarHBondContact CA-O 3.32Å
57	V	93.7	Very high	90.9	Very high	10 Å²	10	73.5 Å²	73.5	6%	0.061	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	128.1	173.2	-169.6	0	0	0	0	107.6	F85 R86 V190 V191 I193	V57-F85 HydrophobicContact CG1-CD2 3.84Å; V57-F85 HydrophobicContact CG1-CE2 4.27Å; V57-R86 WeakPolarHBondContact CG1-O 3.23Å; V57-V190 CarbonylContact O-C 3.58Å; V57-V190 WeakPolarHBondContact O-CA 3.39Å; V57-V191 HydrophobicContact CB-CB 4.41Å; V57-V191 PolarHBondContact N-O 2.86Å; V57-V191 PolarHBondContact O-N 3.12Å; V57-I193 HydrophobicContact CG2-CD1 3.93Å
58	Q	96.3	Very high	91.6	Very high	110 Å²	110	75.6 Å²	75.6	51%	0.514	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	134.3	175.1	-177.3	174	-54.4	0	0	110	I188 C189 V190	Q58-I188 HydrophobicContact CG-CG2 3.82Å; Q58-C189 CarbonylContact C-O 3.48Å; Q58-C189 WeakPolarHBondContact CA-O 3.27Å; Q58-V190 HydrophobicContact CB-CG2 4.47Å; Q58-V190 HydrophobicContact CG-CG2 4.1Å
59	H	97.6	Very high	92.2	Very high	32 Å²	32	76 Å²	76	15%	0.148	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	132.6	174.1	-173.9	67.1	0	0	0	110.1	F85 I188 C189	H59-F85 HydrophobicContact CB-CB 4.26Å; H59-F85 HydrophobicContact CB-CD1 3.77Å; H59-F85 HydrophobicContact CB-CD2 3.69Å; H59-F85 HydrophobicContact CB-CE1 3.92Å; H59-F85 HydrophobicContact CB-CE2 3.82Å; H59-F85 HydrophobicContact CB-CG 3.64Å; H59-F85 HydrophobicContact CB-CZ 3.93Å; H59-F85 AromaticContact CD2-CD1 3.61Å; H59-F85 AromaticContact CD2-CE1 3.85Å; H59-F85 AromaticContact CG-CD1 3.48Å; H59-F85 VanDerWaalsContact CG-CD1 3.48Å; H59-F85 AromaticContact CG-CE1 3.93Å; H59-F85 AromaticContact CG-CG 3.65Å; H59-F85 AromaticContact ND1-CD1 3.92Å; H59-F85 AromaticContact ND1-CG 3.87Å; H59-I188 CarbonylContact O-C 3.57Å; H59-I188 WeakPolarHBondContact O-CA 3.3Å; H59-C189 PolarHBondContact N-O 2.84Å; H59-C189 PolarHBondContact O-N 2.91Å
60	R	97.7	Very high	92.7	Very high	152 Å²	152	71 Å²	71	57%	0.574	35%	0.351	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.4	120.2	174.7	-175.1	-179.8	-61.3	179.3	1.9	108.7	I62 T186 V187 I188	R60-I62 HydrophobicContact CG-CG1 4.23Å; R60-T186 HydrophobicContact CG-CG2 3.84Å; R60-V187 WeakPolarHBondContact CA-O 3.4Å; R60-I188 HydrophobicContact CG-CG1 4.34Å
61	W	98.1	Very high	93	Very high	27 Å²	27	70.6 Å²	70.6	10%	0.102	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	115.7	177.2	179.4	24.7	0	0	0	109	I63 M80 Q81 I96 L98 L119 V187	W61-I63 HydrophobicContact CD2-CD1 3.99Å; W61-I63 HydrophobicContact CD2-CG1 3.95Å; W61-I63 HydrophobicContact CE3-CD1 4.11Å; W61-I63 HydrophobicContact CG-CG1 4.3Å; W61-I63 HydrophobicContact CH2-CD1 3.75Å; W61-I63 HydrophobicContact CH2-CG1 4.45Å; W61-I63 HydrophobicContact CZ2-CD1 3.6Å; W61-I63 HydrophobicContact CZ2-CG1 3.81Å; W61-I63 HydrophobicContact CZ3-CD1 4Å; W61-M80 HydrophobicContact CH2-CB 3.89Å; W61-M80 HydrophobicContact CZ2-CB 4.01Å; W61-Q81 VanDerWaalsContact CZ2-C 3.47Å; W61-I96 HydrophobicContact CE3-CB 3.99Å; W61-I96 HydrophobicContact CE3-CD1 4.45Å; W61-I96 HydrophobicContact CE3-CG2 3.84Å; W61-I96 HydrophobicContact CZ3-CB 4.11Å; W61-I96 HydrophobicContact CZ3-CG2 3.72Å; W61-L98 HydrophobicContact CH2-CB 3.86Å; W61-L98 HydrophobicContact CZ3-CB 4.01Å; W61-L119 HydrophobicContact CZ3-CD2 4.33Å; W61-V187 HydrophobicContact CB-CB 4.44Å; W61-V187 HydrophobicContact CE3-CB 4.42Å; W61-V187 HydrophobicContact CE3-CG2 4.46Å; W61-V187 PolarHBondContact N-O 3.32Å; W61-V187 PolarHBondContact O-N 3.34Å
62	I	97.2	Very high	93.2	Very high	90 Å²	90	71.3 Å²	71.3	46%	0.462	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	124.3	179.1	-58.2	174	0	0	0	107.2	R60 E64 T184 T186	R60-I62 HydrophobicContact CG-CG1 4.23Å; I62-E64 HydrophobicContact CG2-CG 4.14Å; I62-T184 HydrophobicContact CG2-CG2 3.4Å; I62-T186 HydrophobicContact CG1-CG2 4.19Å
63	I	96	Very high	93.1	Very high	1 Å²	1	68.6 Å²	68.6	1%	0.005	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	94.5	179.3	-51.1	171.7	0	0	0	107.5	W61 Y66 M80 L98 T184 L185	W61-I63 HydrophobicContact CD2-CD1 3.99Å; W61-I63 HydrophobicContact CD2-CG1 3.95Å; W61-I63 HydrophobicContact CE3-CD1 4.11Å; W61-I63 HydrophobicContact CG-CG1 4.3Å; W61-I63 HydrophobicContact CH2-CD1 3.75Å; W61-I63 HydrophobicContact CH2-CG1 4.45Å; W61-I63 HydrophobicContact CZ2-CD1 3.6Å; W61-I63 HydrophobicContact CZ2-CG1 3.81Å; W61-I63 HydrophobicContact CZ3-CD1 4Å; I63-Y66 HydrophobicContact CG2-CD2 4.05Å; I63-M80 HydrophobicContact CG2-SD 4Å; I63-L98 HydrophobicContact CD1-CD2 4.03Å; I63-T184 WeakPolarHBondContact O-CA 3.26Å; I63-L185 HydrophobicContact CB-CB 4.33Å; I63-L185 HydrophobicContact CD1-CD2 4.26Å; I63-L185 PolarHBondContact N-O 3.43Å; I63-L185 PolarHBondContact O-N 3.06Å
64	E	95.4	Very high	92.7	Very high	124 Å²	124	68.2 Å²	68.2	58%	0.579	33%	0.333	S	S	*	.	S	Bend	trans	-77.7	153.1	174.7	-60.8	178.6	154.7	0	0	111	I62 Y66 Q69 T184	I62-E64 HydrophobicContact CG2-CG 4.14Å; E64-Y66 PolarHBondContact O-N 2.75Å; E64-Q69 PolarHBondContact O-NE2 2.89Å; E64-T184 HydrophobicContact CG-CG2 4.37Å
65	N	95.3	Very high	92.3	Very high	88 Å²	88	72.2 Å²	72.2	47%	0.471	35%	0.35	S	S	.	.	S	Bend	trans	52.9	44.3	-174.9	-51.2	-49.4	0	0	0	111.4	H67 E68 Q69 D183	N65-H67 VanDerWaalsContact C-N 3.3Å; N65-H67 PolarHBondContact O-N 2.88Å; N65-E68 HydrophobicContact CB-CB 4.32Å; N65-E68 PolarHBondContact O-N 2.99Å; N65-E68 VanDerWaalsContact O-N 3.11Å; N65-Q69 PolarHBondContact O-N 3.34Å; N65-D183 VanDerWaalsContact CA-OD2 3.29Å; N65-D183 WeakPolarHBondContact CA-OD2 3.32Å; N65-D183 PolarHBondContact N-O 3.36Å; N65-D183 VanDerWaalsContact N-O 3.11Å
66	Y	93.9	Very high	91.8	Very high	2 Å²	2	77.4 Å²	77.4	1%	0.008	37%	0.369	C	S	.	.	H	α-helix	trans	-54.1	-44.6	-170.6	171	-103.1	0	0	0	112.3	I63 E64 E68 Q69 E70 M80 L98 R117 I180 D183 L185	I63-Y66 HydrophobicContact CG2-CD2 4.05Å; E64-Y66 PolarHBondContact O-N 2.75Å; Y66-E68 VanDerWaalsContact C-N 3.34Å; Y66-E68 PolarHBondContact O-N 3.44Å; Y66-Q69 PolarHBondContact O-N 2.89Å; Y66-E70 WeakPolarHBondContact O-CB 3.46Å; Y66-E70 PolarHBondContact O-N 3.39Å; Y66-E70 PolarHBondContact OH-OE1 3.47Å; Y66-M80 HydrophobicContact CE2-CE 4.07Å; Y66-L98 HydrophobicContact CE2-CD2 3.77Å; Y66-R117 WeakPolarHBondContact OH-CD 3.49Å; Y66-R117 PolarHBondContact OH-NE 3.05Å; Y66-I180 HydrophobicContact CD1-CD1 3.5Å; Y66-I180 VanDerWaalsContact CD1-CD1 3.5Å; Y66-I180 HydrophobicContact CD1-CG1 4.16Å; Y66-I180 HydrophobicContact CE1-CD1 3.59Å; Y66-I180 HydrophobicContact CE1-CG1 4.45Å; Y66-D183 PolarHBondContact N-O 3.48Å; Y66-D183 PolarHBondContact N-OD1 3.2Å; Y66-D183 VanDerWaalsContact N-OD1 3.1Å; Y66-L185 HydrophobicContact CD2-CB 3.77Å; Y66-L185 HydrophobicContact CD2-CD2 3.85Å; Y66-L185 HydrophobicContact CD2-CG 4.47Å; Y66-L185 HydrophobicContact CE2-CB 4.31Å; Y66-L185 HydrophobicContact CE2-CD2 3.51Å; Y66-L185 HydrophobicContact CG-CB 4Å
67	H	92	Very high	91.1	Very high	85 Å²	85	75 Å²	75	39%	0.394	36%	0.364	S	S	.	.	H	α-helix	trans	-64.5	-36.8	-179.3	-68.2	91.6	0	0	0	112.7	N65 S71 D183	N65-H67 VanDerWaalsContact C-N 3.3Å; N65-H67 PolarHBondContact O-N 2.88Å; H67-S71 WeakPolarHBondContact O-CB 3.48Å; H67-S71 PolarHBondContact O-N 2.85Å; H67-S71 PolarHBondContact O-OG 3.27Å; H67-D183 IonicContact CE1-OD1 3.12Å; H67-D183 IonicContact CG-OD1 2.68Å; H67-D183 PolarHBondContact N-OD1 3.03Å; H67-D183 IonicContact ND1-OD1 2.66Å; H67-D183 PolarHBondContact ND1-OD1 3.08Å
68	E	92.2	Very high	90.5	Very high	128 Å²	128	80.9 Å²	80.9	60%	0.598	39%	0.393	S	S	*	.	H	α-helix	trans	-67.7	-44.5	174.5	-67.5	-168.9	168.1	0	0	111.1	N65 Y66 E70 S71 L72	N65-E68 HydrophobicContact CB-CB 4.32Å; N65-E68 PolarHBondContact O-N 2.99Å; N65-E68 VanDerWaalsContact O-N 3.11Å; Y66-E68 VanDerWaalsContact C-N 3.34Å; Y66-E68 PolarHBondContact O-N 3.44Å; E68-E70 VanDerWaalsContact C-N 3.33Å; E68-E70 PolarHBondContact O-N 3.32Å; E68-S71 PolarHBondContact O-N 2.95Å; E68-L72 WeakPolarHBondContact O-CG 3.48Å; E68-L72 PolarHBondContact O-N 3.27Å
69	Q	92.5	Very high	90	Very high	78 Å²	78	76.4 Å²	76.4	36%	0.364	38%	0.375	S	S	.	.	H	α-helix	trans	-62.5	-40.2	176.6	-65.3	-160.7	47	0	0	112	E64 N65 Y66 S71 L72 Q73 M80	E64-Q69 PolarHBondContact O-NE2 2.89Å; N65-Q69 PolarHBondContact O-N 3.34Å; Y66-Q69 PolarHBondContact O-N 2.89Å; Q69-S71 VanDerWaalsContact C-N 3.35Å; Q69-L72 PolarHBondContact O-N 3.21Å; Q69-Q73 WeakPolarHBondContact O-CB 3.38Å; Q69-Q73 PolarHBondContact O-N 3.33Å; Q69-M80 HydrophobicContact CB-CG 4.38Å; Q69-M80 HydrophobicContact CB-SD 3.64Å
70	E	89.6	Confident	89.8	Confident	11 Å²	11	75.5 Å²	75.5	5%	0.051	37%	0.371	C	S	.	.	H	α-helix	trans	-63.4	-41.6	175.2	-164.8	-164.9	-129.1	0	0	111.3	Y66 E68 Q73 K74 R117	Y66-E70 WeakPolarHBondContact O-CB 3.46Å; Y66-E70 PolarHBondContact O-N 3.39Å; Y66-E70 PolarHBondContact OH-OE1 3.47Å; E68-E70 VanDerWaalsContact C-N 3.33Å; E68-E70 PolarHBondContact O-N 3.32Å; E70-Q73 WeakPolarHBondContact O-CB 3.42Å; E70-Q73 PolarHBondContact O-N 2.82Å; E70-K74 WeakPolarHBondContact O-CG 3.37Å; E70-K74 PolarHBondContact O-N 2.85Å; E70-K74 IonicContact OE2-NZ 3.68Å; E70-K74 PolarHBondContact OE2-NZ 3.23Å; E70-R117 IonicContact OE1-CZ 3.95Å; E70-R117 VanDerWaalsContact OE1-CZ 3.24Å; E70-R117 IonicContact OE1-NE 2.9Å; E70-R117 PolarHBondContact OE1-NE 3.33Å; E70-R117 IonicContact OE1-NH2 2.97Å; E70-R117 PolarHBondContact OE1-NH2 2.86Å; E70-R117 IonicContact OE2-NH2 3.08Å
71	S	88.3	Confident	89.7	Confident	70 Å²	70	73.3 Å²	73.3	49%	0.49	37%	0.367	S	S	.	.	H	α-helix	trans	-64.8	-42.9	177.1	-60.6	0	0	0	0	111.7	H67 E68 Q69 Q73 K74 L75	H67-S71 WeakPolarHBondContact O-CB 3.48Å; H67-S71 PolarHBondContact O-N 2.85Å; H67-S71 PolarHBondContact O-OG 3.27Å; E68-S71 PolarHBondContact O-N 2.95Å; Q69-S71 VanDerWaalsContact C-N 3.35Å; S71-Q73 VanDerWaalsContact C-N 3.35Å; S71-K74 PolarHBondContact O-N 2.79Å; S71-L75 PolarHBondContact O-N 3.2Å; S71-L75 VanDerWaalsContact O-N 3.08Å
72	L	86.9	Confident	89.7	Confident	88 Å²	88	72.2 Å²	72.2	46%	0.461	36%	0.364	S	S	.	.	H	α-helix	trans	-64.6	-38.6	174.8	-75.3	174.2	0	0	0	112.4	E68 Q69 L75 K76	E68-L72 WeakPolarHBondContact O-CG 3.48Å; E68-L72 PolarHBondContact O-N 3.27Å; Q69-L72 PolarHBondContact O-N 3.21Å; L72-L75 PolarHBondContact O-N 3.22Å; L72-K76 WeakPolarHBondContact O-CB 3.41Å; L72-K76 PolarHBondContact O-N 2.85Å
73	Q	84.6	Confident	89.7	Confident	13 Å²	13	71.3 Å²	71.3	6%	0.061	37%	0.369	C	S	.	.	H	α-helix	trans	-60.2	-45.5	174.7	162.2	169.2	79.4	0	0	111.3	Q69 E70 S71 L75 S77 M78 L98	Q69-Q73 WeakPolarHBondContact O-CB 3.38Å; Q69-Q73 PolarHBondContact O-N 3.33Å; E70-Q73 WeakPolarHBondContact O-CB 3.42Å; E70-Q73 PolarHBondContact O-N 2.82Å; S71-Q73 VanDerWaalsContact C-N 3.35Å; Q73-L75 VanDerWaalsContact C-N 3.3Å; Q73-L75 PolarHBondContact O-N 3.49Å; Q73-S77 VanDerWaalsContact O-CA 3.23Å; Q73-S77 WeakPolarHBondContact O-CA 3.35Å; Q73-S77 PolarHBondContact O-N 2.77Å; Q73-M78 WeakPolarHBondContact CB-O 3.47Å; Q73-M78 VanDerWaalsContact CG-O 3.24Å; Q73-M78 WeakPolarHBondContact CG-O 3.24Å; Q73-M78 PolarHBondContact NE2-O 2.78Å; Q73-M78 PolarHBondContact O-N 3.02Å; Q73-L98 PolarHBondContact NE2-O 2.91Å
74	K	81.5	Confident	89.7	Confident	115 Å²	115	76 Å²	76	50%	0.5	39%	0.391	S	S	.	.	H	α-helix	trans	-61.5	-38.9	176.2	-70.1	167.4	-174.6	160.7	0	111.9	E70 S71	E70-K74 WeakPolarHBondContact O-CG 3.37Å; E70-K74 PolarHBondContact O-N 2.85Å; E70-K74 IonicContact OE2-NZ 3.68Å; E70-K74 PolarHBondContact OE2-NZ 3.23Å; S71-K74 PolarHBondContact O-N 2.79Å
75	L	82.9	Confident	89.8	Confident	142 Å²	142	70.9 Å²	70.9	74%	0.743	37%	0.367	S	S	*	.	H	α-helix	trans	-74.6	-42.8	-178.9	-175.3	64.8	0	0	0	113.4	S71 L72 Q73	S71-L75 PolarHBondContact O-N 3.2Å; S71-L75 VanDerWaalsContact O-N 3.08Å; L72-L75 PolarHBondContact O-N 3.22Å; Q73-L75 VanDerWaalsContact C-N 3.3Å; Q73-L75 PolarHBondContact O-N 3.49Å
76	K	81.9	Confident	89.7	Confident	146 Å²	146	72.8 Å²	72.8	64%	0.635	37%	0.368	S	S	*	.	H	α-helix	trans	-97.8	-4.6	-174.1	-65.4	-175.7	178.3	178	0	113.8	L72 M78	L72-K76 WeakPolarHBondContact O-CB 3.41Å; L72-K76 PolarHBondContact O-N 2.85Å; K76-M78 HydrophobicContact CB-CB 4.27Å; K76-M78 PolarHBondContact O-N 2.78Å
77	S	79.4	Confident	89.6	Confident	62 Å²	62	72.8 Å²	72.8	43%	0.434	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.9	35	-172.8	-170.9	0	0	0	0	112.8	Q73 I107	Q73-S77 VanDerWaalsContact O-CA 3.23Å; Q73-S77 WeakPolarHBondContact O-CA 3.35Å; Q73-S77 PolarHBondContact O-N 2.77Å; S77-I107 WeakPolarHBondContact OG-CG2 3.37Å
78	M	80.8	Confident	89.5	Confident	135 Å²	135	73.3 Å²	73.3	67%	0.665	38%	0.379	S	S	*	.			trans	-108.1	127.3	-176.2	-175.6	175.5	140.8	0	0	110.9	Q73 K76	Q73-M78 WeakPolarHBondContact CB-O 3.47Å; Q73-M78 VanDerWaalsContact CG-O 3.24Å; Q73-M78 WeakPolarHBondContact CG-O 3.24Å; Q73-M78 PolarHBondContact NE2-O 2.78Å; Q73-M78 PolarHBondContact O-N 3.02Å; K76-M78 HydrophobicContact CB-CB 4.27Å; K76-M78 PolarHBondContact O-N 2.78Å
79	A	86.3	Confident	89.2	Confident	15 Å²	15	70.2 Å²	70.2	12%	0.124	37%	0.367	C	S	.	.			trans	-65.4	135.1	176	0	0	0	0	0	111.8	Q81 E99	A79-Q81 HydrophobicContact CB-CG 4.34Å; A79-E99 HydrophobicContact CB-CG 3.42Å; A79-E99 VanDerWaalsContact CB-CG 3.42Å; A79-E99 VanDerWaalsContact CB-OE1 3.26Å; A79-E99 WeakPolarHBondContact CB-OE1 3.46Å
80	M	93.9	Very high	89.1	Confident	13 Å²	13	74.1 Å²	74.1	6%	0.064	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	140.4	163.5	-75.3	179.2	-83.6	0	0	108.5	W61 I63 Y66 Q69 S97 L98	W61-M80 HydrophobicContact CH2-CB 3.89Å; W61-M80 HydrophobicContact CZ2-CB 4.01Å; I63-M80 HydrophobicContact CG2-SD 4Å; Y66-M80 HydrophobicContact CE2-CE 4.07Å; Q69-M80 HydrophobicContact CB-CG 4.38Å; Q69-M80 HydrophobicContact CB-SD 3.64Å; M80-S97 CarbonylContact O-C 3.57Å; M80-S97 WeakPolarHBondContact O-CA 3.39Å; M80-L98 HydrophobicContact CB-CB 4.25Å; M80-L98 HydrophobicContact CE-CB 4.42Å; M80-L98 HydrophobicContact CE-CD2 3.72Å; M80-L98 HydrophobicContact CE-CG 3.95Å; M80-L98 PolarHBondContact N-O 2.64Å; M80-L98 PolarHBondContact O-N 3.37Å
81	Q	95.5	Very high	89.1	Confident	106 Å²	106	78.9 Å²	78.9	50%	0.495	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	135.5	-170.7	-78.6	-176	8.1	0	0	111.7	W61 A79 K95 I96	W61-Q81 VanDerWaalsContact CZ2-C 3.47Å; A79-Q81 HydrophobicContact CB-CG 4.34Å; Q81-K95 VanDerWaalsContact CB-CE 3.42Å; Q81-I96 WeakPolarHBondContact CA-O 3.22Å
82	S	97.5	Very high	89.2	Confident	5 Å²	5	76.3 Å²	76.3	4%	0.035	38%	0.38	C	S	.	.	P	Polyproline II helix	trans	-73.6	166.4	174.7	78.3	0	0	0	0	111.8	K95 I96	S82-K95 VanDerWaalsContact O-CE 3.24Å; S82-K95 WeakPolarHBondContact O-CE 3.34Å; S82-I96 PolarHBondContact N-O 2.66Å; S82-I96 PolarHBondContact OG-N 2.85Å
83	A	97.2	Very high	89.5	Confident	70 Å²	70	73.9 Å²	73.9	58%	0.579	37%	0.365	S	S	*	.	P	Polyproline II helix	trans	-60.5	157.3	159.6	0	0	0	0	0	110.5
84	E	96.5	Very high	90.1	Very high	100 Å²	100	73.2 Å²	73.2	47%	0.467	36%	0.362	S	S	.	.	P	Polyproline II helix	trans	-77.4	138.1	175	-54.9	172.7	133.3	0	0	110	K93 F94 K95 L124	E84-K93 HydrophobicContact CB-CG 4.5Å; E84-K93 VanDerWaalsContact OE1-CE 3.31Å; E84-K93 WeakPolarHBondContact OE1-CE 3.29Å; E84-K93 IonicContact OE1-NZ 2.72Å; E84-K93 PolarHBondContact OE1-NZ 2.94Å; E84-K93 WeakPolarHBondContact OE2-CE 3.42Å; E84-K93 IonicContact OE2-NZ 2.76Å; E84-K93 PolarHBondContact OE2-NZ 3.21Å; E84-F94 VanDerWaalsContact CA-O 3.29Å; E84-F94 WeakPolarHBondContact CA-O 3.49Å; E84-K95 HydrophobicContact CG-CD 4.28Å; E84-L124 HydrophobicContact CB-CD1 4.36Å; E84-L124 HydrophobicContact CG-CD1 3.77Å; E84-L124 WeakPolarHBondContact OE1-CD1 3.35Å
85	F	96.8	Very high	90.8	Very high	17 Å²	17	70 Å²	70	8%	0.075	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	160.8	176.9	61	-80.7	0	0	0	110.7	V57 H59 K93 F94 I96 L121 C189 V191	V57-F85 HydrophobicContact CG1-CD2 3.84Å; V57-F85 HydrophobicContact CG1-CE2 4.27Å; H59-F85 HydrophobicContact CB-CB 4.26Å; H59-F85 HydrophobicContact CB-CD1 3.77Å; H59-F85 HydrophobicContact CB-CD2 3.69Å; H59-F85 HydrophobicContact CB-CE1 3.92Å; H59-F85 HydrophobicContact CB-CE2 3.82Å; H59-F85 HydrophobicContact CB-CG 3.64Å; H59-F85 HydrophobicContact CB-CZ 3.93Å; H59-F85 AromaticContact CD2-CD1 3.61Å; H59-F85 AromaticContact CD2-CE1 3.85Å; H59-F85 AromaticContact CG-CD1 3.48Å; H59-F85 VanDerWaalsContact CG-CD1 3.48Å; H59-F85 AromaticContact CG-CE1 3.93Å; H59-F85 AromaticContact CG-CG 3.65Å; H59-F85 AromaticContact ND1-CD1 3.92Å; H59-F85 AromaticContact ND1-CG 3.87Å; F85-K93 CarbonylContact O-C 3.54Å; F85-K93 WeakPolarHBondContact O-CA 3.49Å; F85-F94 HydrophobicContact CD1-CB 4.17Å; F85-F94 HydrophobicContact CD2-CB 4.03Å; F85-F94 HydrophobicContact CD2-CD2 4.15Å; F85-F94 HydrophobicContact CE1-CB 3.7Å; F85-F94 HydrophobicContact CE2-CB 3.57Å; F85-F94 AromaticContact CE2-CD2 3.87Å; F85-F94 HydrophobicContact CE2-CD2 3.87Å; F85-F94 HydrophobicContact CE2-CG 4.05Å; F85-F94 HydrophobicContact CG-CB 4.33Å; F85-F94 HydrophobicContact CZ-CB 3.4Å; F85-F94 HydrophobicContact CZ-CG 4.24Å; F85-F94 PolarHBondContact N-O 3.44Å; F85-F94 PolarHBondContact O-N 3.49Å; F85-I96 HydrophobicContact CE1-CD1 4.25Å; F85-I96 HydrophobicContact CE1-CG1 4.01Å; F85-I96 HydrophobicContact CZ-CG1 4.4Å; F85-L121 HydrophobicContact CE1-CD1 4.4Å; F85-L121 HydrophobicContact CZ-CD1 3.82Å; F85-C189 HydrophobicContact CZ-CB 4.45Å; F85-V191 HydrophobicContact CE2-CG2 4.38Å
86	R	94.4	Very high	91.5	Very high	127 Å²	127	63.3 Å²	63.3	48%	0.479	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	154.6	-168.7	-64.2	174.3	-171.7	-102.4	6.2	111.7	V57 Y92 K93	V57-R86 WeakPolarHBondContact CG1-O 3.23Å; R86-Y92 CarbonylContact C-O 3.57Å; R86-Y92 WeakPolarHBondContact CA-O 3.24Å; R86-K93 HydrophobicContact CG-CB 4.21Å; R86-K93 HydrophobicContact CG-CG 3.96Å
87	S	91.5	Very high	92.1	Very high	3 Å²	3	56.4 Å²	56.4	2%	0.021	28%	0.283	C	S	.	.			trans	-62.3	153.6	163.6	54.2	0	0	0	0	111.1	D89 K90 R91 Y92	S87-D89 VanDerWaalsContact CB-OD1 3.25Å; S87-D89 WeakPolarHBondContact CB-OD1 3.37Å; S87-D89 PolarHBondContact O-N 2.78Å; S87-D89 PolarHBondContact OG-OD1 3Å; S87-K90 VanDerWaalsContact O-CA 3.31Å; S87-K90 WeakPolarHBondContact O-CA 3.44Å; S87-K90 PolarHBondContact O-N 2.96Å; S87-R91 PolarHBondContact OG-N 3.41Å; S87-Y92 PolarHBondContact N-O 2.79Å; S87-Y92 PolarHBondContact OG-N 3.48Å; S87-Y92 PolarHBondContact OG-O 3.04Å
88	P	89.1	Confident	92.9	Very high	95 Å²	95	53.5 Å²	53.5	62%	0.617	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.2	-38.6	178.7	-30	35	0	0	0	114	T55 K90	T55-P88 HydrophobicContact CG2-CG 3.82Å; P88-K90 PolarHBondContact O-N 3.15Å
89	D	87	Confident	93.3	Very high	64 Å²	64	48.1 Å²	48.1	34%	0.342	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76	-1.7	175.5	63.9	12.6	0	0	0	114	S87 R91	S87-D89 VanDerWaalsContact CB-OD1 3.25Å; S87-D89 WeakPolarHBondContact CB-OD1 3.37Å; S87-D89 PolarHBondContact O-N 2.78Å; S87-D89 PolarHBondContact OG-OD1 3Å; D89-R91 HydrophobicContact CB-CG 4.38Å; D89-R91 PolarHBondContact O-N 2.85Å; D89-R91 VanDerWaalsContact O-N 3.12Å; D89-R91 WeakPolarHBondContact OD1-CB 3.48Å; D89-R91 PolarHBondContact OD1-N 2.9Å; D89-R91 IonicContact OD1-NE 2.88Å; D89-R91 IonicContact OD2-CZ 3.35Å; D89-R91 IonicContact OD2-NE 3.02Å; D89-R91 PolarHBondContact OD2-NE 3.19Å; D89-R91 IonicContact OD2-NH2 2.7Å; D89-R91 PolarHBondContact OD2-NH2 2.87Å
90	K	89.6	Confident	93.3	Very high	159 Å²	159	48.1 Å²	48.1	69%	0.691	23%	0.234	S	C	*	.	S	Bend	trans	61.3	10.2	-178.7	-53.1	175.2	-176.3	174.4	0	115.2	S87 P88	S87-K90 VanDerWaalsContact O-CA 3.31Å; S87-K90 WeakPolarHBondContact O-CA 3.44Å; S87-K90 PolarHBondContact O-N 2.96Å; P88-K90 PolarHBondContact O-N 3.15Å
91	R	88.7	Confident	92.6	Very high	112 Å²	112	48.5 Å²	48.5	42%	0.423	24%	0.235	S	C	.	.			trans	-68.7	-42.2	178.3	-70.5	-167.2	-69	-165.9	-5.9	112.7	S87 D89 S125	S87-R91 PolarHBondContact OG-N 3.41Å; D89-R91 HydrophobicContact CB-CG 4.38Å; D89-R91 PolarHBondContact O-N 2.85Å; D89-R91 VanDerWaalsContact O-N 3.12Å; D89-R91 WeakPolarHBondContact OD1-CB 3.48Å; D89-R91 PolarHBondContact OD1-N 2.9Å; D89-R91 IonicContact OD1-NE 2.88Å; D89-R91 IonicContact OD2-CZ 3.35Å; D89-R91 IonicContact OD2-NE 3.02Å; D89-R91 PolarHBondContact OD2-NE 3.19Å; D89-R91 IonicContact OD2-NH2 2.7Å; D89-R91 PolarHBondContact OD2-NH2 2.87Å; R91-S125 PolarHBondContact O-OG 3.36Å
92	Y	91.6	Very high	91.4	Very high	16 Å²	16	45.2 Å²	45.2	6%	0.063	22%	0.221	C	C	.	.			trans	-108	138.4	-176.7	-54.9	-74.5	0	0	0	110.9	R86 S87 F94 S125 D128 P129 L130 I193	R86-Y92 CarbonylContact C-O 3.57Å; R86-Y92 WeakPolarHBondContact CA-O 3.24Å; S87-Y92 PolarHBondContact N-O 2.79Å; S87-Y92 PolarHBondContact OG-N 3.48Å; S87-Y92 PolarHBondContact OG-O 3.04Å; Y92-F94 HydrophobicContact CG-CZ 4.34Å; Y92-S125 WeakPolarHBondContact CA-OG 3.29Å; Y92-D128 HydrophobicContact CE1-CB 3.8Å; Y92-P129 PolarHBondContact OH-O 2.87Å; Y92-L130 HydrophobicContact CD1-CB 4.23Å; Y92-L130 HydrophobicContact CD1-CD1 3.82Å; Y92-L130 HydrophobicContact CD1-CD2 4.27Å; Y92-L130 HydrophobicContact CD1-CG 4.32Å; Y92-L130 HydrophobicContact CD2-CD1 4.27Å; Y92-L130 HydrophobicContact CE1-CB 3.82Å; Y92-L130 HydrophobicContact CE1-CD1 3.75Å; Y92-L130 HydrophobicContact CE1-CG 4.26Å; Y92-L130 HydrophobicContact CE2-CD1 4.2Å; Y92-L130 HydrophobicContact CG-CD1 4.06Å; Y92-I193 HydrophobicContact CD2-CD1 3.67Å; Y92-I193 HydrophobicContact CD2-CG2 4.13Å; Y92-I193 HydrophobicContact CE2-CD1 4.41Å; Y92-I193 HydrophobicContact CE2-CG2 3.81Å; Y92-I193 HydrophobicContact CG-CD1 4.19Å
93	K	93.9	Very high	89.5	Confident	36 Å²	36	49.4 Å²	49.4	16%	0.157	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	133.6	179.5	-170.9	-170.9	-173.1	-164.7	0	109.1	E84 F85 R86 L124 S125	E84-K93 HydrophobicContact CB-CG 4.5Å; E84-K93 VanDerWaalsContact OE1-CE 3.31Å; E84-K93 WeakPolarHBondContact OE1-CE 3.29Å; E84-K93 IonicContact OE1-NZ 2.72Å; E84-K93 PolarHBondContact OE1-NZ 2.94Å; E84-K93 WeakPolarHBondContact OE2-CE 3.42Å; E84-K93 IonicContact OE2-NZ 2.76Å; E84-K93 PolarHBondContact OE2-NZ 3.21Å; F85-K93 CarbonylContact O-C 3.54Å; F85-K93 WeakPolarHBondContact O-CA 3.49Å; R86-K93 HydrophobicContact CG-CB 4.21Å; R86-K93 HydrophobicContact CG-CG 3.96Å; K93-L124 HydrophobicContact CB-CB 4.09Å; K93-L124 HydrophobicContact CD-CB 3.94Å; K93-L124 HydrophobicContact CD-CD1 3.87Å; K93-L124 HydrophobicContact CD-CG 4.49Å; K93-L124 HydrophobicContact CG-CB 4.07Å; K93-L124 HydrophobicContact CG-CD1 4Å; K93-L124 HydrophobicContact CG-CG 4.42Å; K93-L124 PolarHBondContact O-N 3.49Å; K93-S125 PolarHBondContact N-OG 3.03Å
94	F	95.4	Very high	87.7	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	161.4	-172.1	-56	-73	0	0	0	111.9	E84 F85 Y92 L121 H122 L130 I167 V191 I193	E84-F94 VanDerWaalsContact CA-O 3.29Å; E84-F94 WeakPolarHBondContact CA-O 3.49Å; F85-F94 HydrophobicContact CD1-CB 4.17Å; F85-F94 HydrophobicContact CD2-CB 4.03Å; F85-F94 HydrophobicContact CD2-CD2 4.15Å; F85-F94 HydrophobicContact CE1-CB 3.7Å; F85-F94 HydrophobicContact CE2-CB 3.57Å; F85-F94 AromaticContact CE2-CD2 3.87Å; F85-F94 HydrophobicContact CE2-CD2 3.87Å; F85-F94 HydrophobicContact CE2-CG 4.05Å; F85-F94 HydrophobicContact CG-CB 4.33Å; F85-F94 HydrophobicContact CZ-CB 3.4Å; F85-F94 HydrophobicContact CZ-CG 4.24Å; F85-F94 PolarHBondContact N-O 3.44Å; F85-F94 PolarHBondContact O-N 3.49Å; Y92-F94 HydrophobicContact CG-CZ 4.34Å; F94-L121 HydrophobicContact CB-CD1 4.02Å; F94-L121 HydrophobicContact CD1-CD2 4.37Å; F94-L121 HydrophobicContact CD1-CG 4.46Å; F94-H122 VanDerWaalsContact CA-O 3.26Å; F94-H122 WeakPolarHBondContact CA-O 3.3Å; F94-L130 HydrophobicContact CE1-CD2 3.71Å; F94-L130 HydrophobicContact CZ-CD2 3.96Å; F94-I167 HydrophobicContact CD1-CD1 4.17Å; F94-I167 HydrophobicContact CE1-CD1 3.96Å; F94-V191 HydrophobicContact CE1-CG1 4.49Å; F94-V191 HydrophobicContact CE2-CG1 4.29Å; F94-V191 HydrophobicContact CZ-CG1 3.99Å; F94-I193 HydrophobicContact CE2-CD1 4.14Å; F94-I193 HydrophobicContact CZ-CD1 4.21Å
95	K	96.6	Very high	85.8	Confident	48 Å²	48	49.7 Å²	49.7	21%	0.209	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	147.1	173.5	-177.4	167.7	175.5	171.7	0	109.7	Q81 S82 E84 H122 L124	Q81-K95 VanDerWaalsContact CB-CE 3.42Å; S82-K95 VanDerWaalsContact O-CE 3.24Å; S82-K95 WeakPolarHBondContact O-CE 3.34Å; E84-K95 HydrophobicContact CG-CD 4.28Å; K95-H122 PolarHBondContact N-O 2.88Å; K95-H122 VanDerWaalsContact N-O 3.08Å; K95-H122 PolarHBondContact O-N 3.31Å; K95-L124 HydrophobicContact CB-CD1 4.18Å; K95-L124 HydrophobicContact CB-CD2 4.47Å; K95-L124 HydrophobicContact CB-CG 4.47Å
96	I	97.5	Very high	84	Confident	0 Å²	0	56 Å²	56	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	139.9	177.4	-52.4	162.8	0	0	0	108.2	W61 Q81 S82 F85 L119 T120 L121 F136 C189	W61-I96 HydrophobicContact CE3-CB 3.99Å; W61-I96 HydrophobicContact CE3-CD1 4.45Å; W61-I96 HydrophobicContact CE3-CG2 3.84Å; W61-I96 HydrophobicContact CZ3-CB 4.11Å; W61-I96 HydrophobicContact CZ3-CG2 3.72Å; Q81-I96 WeakPolarHBondContact CA-O 3.22Å; S82-I96 PolarHBondContact N-O 2.66Å; S82-I96 PolarHBondContact OG-N 2.85Å; F85-I96 HydrophobicContact CE1-CD1 4.25Å; F85-I96 HydrophobicContact CE1-CG1 4.01Å; F85-I96 HydrophobicContact CZ-CG1 4.4Å; I96-L119 HydrophobicContact CG2-CD2 4Å; I96-T120 CarbonylContact C-O 3.58Å; I96-T120 WeakPolarHBondContact CA-O 3.42Å; I96-L121 HydrophobicContact CG1-CD1 4.15Å; I96-F136 HydrophobicContact CD1-CE1 4.16Å; I96-F136 HydrophobicContact CG1-CE1 4.12Å; I96-F136 HydrophobicContact CG2-CE1 3.91Å; I96-F136 HydrophobicContact CG2-CZ 4.39Å; I96-C189 HydrophobicContact CD1-CB 3.51Å; I96-C189 HydrophobicContact CG1-CB 4.26Å
97	S	95.6	Very high	82.2	Confident	1 Å²	1	53.9 Å²	53.9	1%	0.007	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	148.6	162.1	70.8	0	0	0	0	111.3	M80 E99 L119 T120 H122	M80-S97 CarbonylContact O-C 3.57Å; M80-S97 WeakPolarHBondContact O-CA 3.39Å; S97-E99 WeakPolarHBondContact CB-OE1 3.42Å; S97-E99 PolarHBondContact OG-OE1 3.22Å; S97-L119 WeakPolarHBondContact O-CA 3.37Å; S97-T120 PolarHBondContact N-O 3.08Å; S97-T120 PolarHBondContact O-N 2.91Å; S97-H122 PolarHBondContact OG-NE2 2.94Å
98	L	94.7	Very high	80.2	Confident	1 Å²	1	54.7 Å²	54.7	1%	0.005	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	120.5	170.6	176	58.5	0	0	0	108.1	W61 I63 Y66 Q73 M80 R117 T118 L119 L172 L185	W61-L98 HydrophobicContact CH2-CB 3.86Å; W61-L98 HydrophobicContact CZ3-CB 4.01Å; I63-L98 HydrophobicContact CD1-CD2 4.03Å; Y66-L98 HydrophobicContact CE2-CD2 3.77Å; Q73-L98 PolarHBondContact NE2-O 2.91Å; M80-L98 HydrophobicContact CB-CB 4.25Å; M80-L98 HydrophobicContact CE-CB 4.42Å; M80-L98 HydrophobicContact CE-CD2 3.72Å; M80-L98 HydrophobicContact CE-CG 3.95Å; M80-L98 PolarHBondContact N-O 2.64Å; M80-L98 PolarHBondContact O-N 3.37Å; L98-R117 HydrophobicContact CD1-CB 4.4Å; L98-T118 WeakPolarHBondContact CA-O 3.46Å; L98-L119 HydrophobicContact CB-CD2 3.94Å; L98-L119 HydrophobicContact CD1-CD2 3.87Å; L98-L119 HydrophobicContact CD1-CG 4.19Å; L98-L119 HydrophobicContact CG-CD2 4.35Å; L98-L172 HydrophobicContact CD1-CD1 3.79Å; L98-L185 HydrophobicContact CD2-CD2 3.85Å
99	E	90.5	Very high	78.5	Confident	22 Å²	22	54.2 Å²	54.2	10%	0.103	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	153.6	-172.4	-69.6	169.5	-146.1	0	0	111.5	A79 S97 T118	A79-E99 HydrophobicContact CB-CG 3.42Å; A79-E99 VanDerWaalsContact CB-CG 3.42Å; A79-E99 VanDerWaalsContact CB-OE1 3.26Å; A79-E99 WeakPolarHBondContact CB-OE1 3.46Å; S97-E99 WeakPolarHBondContact CB-OE1 3.42Å; S97-E99 PolarHBondContact OG-OE1 3.22Å; E99-T118 PolarHBondContact N-O 2.93Å; E99-T118 PolarHBondContact O-N 3.48Å
100	N	86.6	Confident	76.6	Confident	16 Å²	16	59.4 Å²	59.4	9%	0.086	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	103.6	170.6	-73.1	-34.3	0	0	0	109.1	S108 A115 Q116 R117	N100-S108 PolarHBondContact O-N 2.88Å; N100-S108 VanDerWaalsContact O-N 3.15Å; N100-A115 HydrophobicContact CB-CB 4.31Å; N100-Q116 WeakPolarHBondContact CA-O 3.24Å; N100-R117 VanDerWaalsContact OD1-CG 3.22Å; N100-R117 WeakPolarHBondContact OD1-CG 3.22Å
101	K	78.8	Confident	74.6	Confident	20 Å²	20	56.2 Å²	56.2	9%	0.087	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	137.8	178.1	-63.8	-170.2	-179.1	-174.2	0	110.2	K106 A115 Q116 T118 E166 E169	K101-K106 CarbonylContact C-O 3.57Å; K101-K106 WeakPolarHBondContact CA-O 3.4Å; K101-A115 CarbonylContact O-C 3.5Å; K101-A115 WeakPolarHBondContact O-CA 3.27Å; K101-Q116 PolarHBondContact N-O 3.11Å; K101-Q116 PolarHBondContact O-N 3.48Å; K101-T118 HydrophobicContact CD-CG2 4.17Å; K101-E166 IonicContact NZ-OE1 3.5Å; K101-E166 PolarHBondContact NZ-OE1 2.85Å; K101-E166 IonicContact NZ-OE2 3.24Å; K101-E169 IonicContact NZ-OE2 2.84Å; K101-E169 PolarHBondContact NZ-OE2 2.86Å
102	D	70.4	Confident	72.8	Confident	37 Å²	37	56.8 Å²	56.8	20%	0.198	32%	0.317	C	S	.	.			trans	-74.2	175.7	167.7	65	17.8	0	0	0	111.4	N104 G105 K106	D102-N104 PolarHBondContact O-N 2.88Å; D102-N104 VanDerWaalsContact OD1-C 3.24Å; D102-N104 VanDerWaalsContact OD1-CA 3.27Å; D102-N104 WeakPolarHBondContact OD1-CA 3.23Å; D102-N104 WeakPolarHBondContact OD1-CB 3.49Å; D102-N104 PolarHBondContact OD1-N 2.83Å; D102-G105 PolarHBondContact O-N 3.46Å; D102-G105 PolarHBondContact OD1-N 2.87Å; D102-K106 PolarHBondContact N-O 3.28Å; D102-K106 PolarHBondContact OD1-N 2.91Å
103	T	57.6	Low	71	Confident	93 Å²	93	65.4 Å²	65.4	57%	0.571	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-16	176	54.3	0	0	0	0	114.1	Q114	T103-Q114 HydrophobicContact CG2-CB 4.28Å; T103-Q114 VanDerWaalsContact CG2-CD 3.44Å; T103-Q114 HydrophobicContact CG2-CG 3.62Å
104	N	59	Low	69.4	Low	129 Å²	129	69.8 Å²	69.8	69%	0.69	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.5	6.7	177.5	-65.9	-24.3	0	0	0	112.3	D102 K106	D102-N104 PolarHBondContact O-N 2.88Å; D102-N104 VanDerWaalsContact OD1-C 3.24Å; D102-N104 VanDerWaalsContact OD1-CA 3.27Å; D102-N104 WeakPolarHBondContact OD1-CA 3.23Å; D102-N104 WeakPolarHBondContact OD1-CB 3.49Å; D102-N104 PolarHBondContact OD1-N 2.83Å; N104-K106 PolarHBondContact O-N 2.88Å
105	G	56.5	Low	68.2	Low	48 Å²	48	71.5 Å²	71.5	50%	0.495	39%	0.393	S	S	.	.	S	Bend	trans	70.9	9.5	-179.5	0	0	0	0	0	114.2	D102	D102-G105 PolarHBondContact O-N 3.46Å; D102-G105 PolarHBondContact OD1-N 2.87Å
106	K	59.5	Low	67.6	Low	150 Å²	150	73.8 Å²	73.8	65%	0.652	40%	0.404	S	S	*	.	S	Bend	trans	-89.1	152.5	174.4	-68.4	-177	179.6	178.6	0	109.4	K101 D102 N104 S108	K101-K106 CarbonylContact C-O 3.57Å; K101-K106 WeakPolarHBondContact CA-O 3.4Å; D102-K106 PolarHBondContact N-O 3.28Å; D102-K106 PolarHBondContact OD1-N 2.91Å; N104-K106 PolarHBondContact O-N 2.88Å; K106-S108 PolarHBondContact O-N 2.87Å
107	I	55.8	Low	67.3	Low	81 Å²	81	76.6 Å²	76.6	42%	0.415	42%	0.415	S	S	.	.	B	Isolated β-bridge	trans	-60.7	111.4	171.4	-60.5	170	0	0	0	106.9	S77 S109	S77-I107 WeakPolarHBondContact OG-CG2 3.37Å; I107-S109 PolarHBondContact O-N 2.71Å
108	S	50.8	Low	67.1	Low	21 Å²	21	76.7 Å²	76.7	15%	0.147	42%	0.415	C	S	.	.			trans	-72	112.5	-177.5	-172.8	0	0	0	0	109	N100 K106 T111	N100-S108 PolarHBondContact O-N 2.88Å; N100-S108 VanDerWaalsContact O-N 3.15Å; K106-S108 PolarHBondContact O-N 2.87Å; S108-T111 PolarHBondContact OG-O 3.28Å
109	S	52.4	Low	67.2	Low	85 Å²	85	76.6 Å²	76.6	59%	0.594	42%	0.415	S	S	*	.	S	Bend	trans	-97.8	-13.9	172.1	56.3	0	0	0	0	113.4	I107	I107-S109 PolarHBondContact O-N 2.71Å
110	Q	47.7	Very low	67.4	Low	172 Å²	172	75.6 Å²	75.6	80%	0.804	41%	0.41	S	S	*	.	S	Bend	trans	-135.5	-7.9	-161.3	-69.9	-175.1	1.2	0	0	118
111	T	47.9	Very low	67.8	Low	92 Å²	92	74.8 Å²	74.8	56%	0.564	41%	0.406	S	S	*	.			trans	-135.8	108.4	175.6	40.3	0	0	0	0	112.9	S108 Q113	S108-T111 PolarHBondContact OG-O 3.28Å; T111-Q113 VanDerWaalsContact C-N 3.32Å; T111-Q113 PolarHBondContact O-N 2.76Å
112	P	51	Low	68.5	Low	124 Å²	124	75.4 Å²	75.4	81%	0.805	41%	0.409	S	S	*	.	G	3₁₀ helix	trans	-66	-25.7	-175.9	-22.1	31.5	0	0	0	115.4	Q114	P112-Q114 VanDerWaalsContact C-N 3.32Å; P112-Q114 PolarHBondContact O-N 3.18Å
113	Q	52.4	Low	69.6	Low	197 Å²	197	73.8 Å²	73.8	92%	0.921	40%	0.401	S	S	*	.	G	3₁₀ helix	trans	-81	-6.2	-164.1	-75.6	170.3	-7.1	0	0	114.9	T111	T111-Q113 VanDerWaalsContact C-N 3.32Å; T111-Q113 PolarHBondContact O-N 2.76Å
114	Q	60.7	Low	71.2	Confident	129 Å²	129	70.8 Å²	70.8	60%	0.603	38%	0.381	S	S	*	.	G	3₁₀ helix	trans	-137.3	8	-176.7	-131.6	171.5	-3	0	0	114.5	T103 P112	T103-Q114 HydrophobicContact CG2-CB 4.28Å; T103-Q114 VanDerWaalsContact CG2-CD 3.44Å; T103-Q114 HydrophobicContact CG2-CG 3.62Å; P112-Q114 VanDerWaalsContact C-N 3.32Å; P112-Q114 PolarHBondContact O-N 3.18Å
115	A	70	Confident	72.3	Confident	36 Å²	36	65.5 Å²	65.5	30%	0.298	35%	0.354	S	S	.	.			trans	-77.3	129.9	176.2	0	0	0	0	0	110.3	N100 K101	N100-A115 HydrophobicContact CB-CB 4.31Å; K101-A115 CarbonylContact O-C 3.5Å; K101-A115 WeakPolarHBondContact O-CA 3.27Å
116	Q	84.7	Confident	73.2	Confident	95 Å²	95	72 Å²	72	44%	0.444	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	137.7	176.6	-65.3	-174	-19.9	0	0	110	N100 K101 T118 T171	N100-Q116 WeakPolarHBondContact CA-O 3.24Å; K101-Q116 PolarHBondContact N-O 3.11Å; K101-Q116 PolarHBondContact O-N 3.48Å; Q116-T118 PolarHBondContact O-N 2.97Å; Q116-T118 PolarHBondContact O-OG1 3.21Å; Q116-T171 HydrophobicContact CB-CG2 3.7Å; Q116-T171 HydrophobicContact CG-CG2 4.29Å
117	R	90	Very high	73.7	Confident	59 Å²	59	69.1 Å²	69.1	22%	0.223	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	124.9	174.8	-70.2	171.3	-171.3	101.5	4.2	108.8	Y66 E70 L98 N100 T171 L172 Q174	Y66-R117 WeakPolarHBondContact OH-CD 3.49Å; Y66-R117 PolarHBondContact OH-NE 3.05Å; E70-R117 IonicContact OE1-CZ 3.95Å; E70-R117 VanDerWaalsContact OE1-CZ 3.24Å; E70-R117 IonicContact OE1-NE 2.9Å; E70-R117 PolarHBondContact OE1-NE 3.33Å; E70-R117 IonicContact OE1-NH2 2.97Å; E70-R117 PolarHBondContact OE1-NH2 2.86Å; E70-R117 IonicContact OE2-NH2 3.08Å; L98-R117 HydrophobicContact CD1-CB 4.4Å; N100-R117 VanDerWaalsContact OD1-CG 3.22Å; N100-R117 WeakPolarHBondContact OD1-CG 3.22Å; R117-T171 CarbonylContact O-C 3.59Å; R117-T171 WeakPolarHBondContact O-CA 3.35Å; R117-L172 HydrophobicContact CB-CB 3.92Å; R117-L172 HydrophobicContact CB-CD1 4.14Å; R117-L172 HydrophobicContact CB-CG 4.38Å; R117-L172 PolarHBondContact O-N 3.19Å; R117-Q174 PolarHBondContact NH1-O 3.46Å; R117-Q174 VanDerWaalsContact NH1-O 3.12Å
118	T	92.5	Very high	74.8	Confident	3 Å²	3	67.7 Å²	67.7	2%	0.018	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	123.3	-172.3	-65.4	0	0	0	0	109.8	L98 E99 K101 Q116 E169	L98-T118 WeakPolarHBondContact CA-O 3.46Å; E99-T118 PolarHBondContact N-O 2.93Å; E99-T118 PolarHBondContact O-N 3.48Å; K101-T118 HydrophobicContact CD-CG2 4.17Å; Q116-T118 PolarHBondContact O-N 2.97Å; Q116-T118 PolarHBondContact O-OG1 3.21Å; T118-E169 HydrophobicContact CG2-CG 3.15Å; T118-E169 WeakPolarHBondContact CG2-OE1 3.35Å
119	L	95.4	Very high	76.6	Confident	0 Å²	0	70.5 Å²	70.5	0%	0	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	126.9	168.6	-75.6	175.5	0	0	0	109.6	W61 I96 S97 L98 F136 I138 L151 E169 V170 L172 V187	W61-L119 HydrophobicContact CZ3-CD2 4.33Å; I96-L119 HydrophobicContact CG2-CD2 4Å; S97-L119 WeakPolarHBondContact O-CA 3.37Å; L98-L119 HydrophobicContact CB-CD2 3.94Å; L98-L119 HydrophobicContact CD1-CD2 3.87Å; L98-L119 HydrophobicContact CD1-CG 4.19Å; L98-L119 HydrophobicContact CG-CD2 4.35Å; L119-F136 HydrophobicContact CB-CE1 4.49Å; L119-F136 HydrophobicContact CB-CZ 4.41Å; L119-F136 HydrophobicContact CD1-CB 4.39Å; L119-F136 HydrophobicContact CD1-CD1 4.12Å; L119-F136 HydrophobicContact CD1-CG 4.28Å; L119-I138 HydrophobicContact CD1-CD1 4.24Å; L119-L151 HydrophobicContact CD1-CD1 4.27Å; L119-E169 CarbonylContact O-C 3.59Å; L119-E169 VanDerWaalsContact O-CA 3.32Å; L119-E169 WeakPolarHBondContact O-CA 3.32Å; L119-V170 HydrophobicContact CB-CG1 3.85Å; L119-V170 HydrophobicContact CD1-CG1 4.44Å; L119-V170 PolarHBondContact N-O 2.82Å; L119-V170 PolarHBondContact O-N 2.83Å; L119-L172 HydrophobicContact CD1-CD1 4.41Å; L119-L172 HydrophobicContact CD1-CD2 3.68Å; L119-L172 HydrophobicContact CD1-CG 4.26Å; L119-L172 HydrophobicContact CG-CD1 4.18Å; L119-L172 HydrophobicContact CG-CD2 4.13Å; L119-L172 HydrophobicContact CG-CG 4.16Å; L119-V187 HydrophobicContact CD1-CG1 3.78Å; L119-V187 HydrophobicContact CD1-CG2 4.28Å; L119-V187 HydrophobicContact CD2-CG1 4.3Å; L119-V187 HydrophobicContact CD2-CG2 4.23Å
120	T	94.9	Very high	78.3	Confident	0 Å²	0	66.5 Å²	66.5	0%	0	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	128.7	179.7	-58.4	0	0	0	0	110.4	I96 S97 H122 E166 A168	I96-T120 CarbonylContact C-O 3.58Å; I96-T120 WeakPolarHBondContact CA-O 3.42Å; S97-T120 PolarHBondContact N-O 3.08Å; S97-T120 PolarHBondContact O-N 2.91Å; T120-H122 PolarHBondContact O-CD2 2.79Å; T120-E166 HydrophobicContact CG2-CB 3.7Å; T120-E166 HydrophobicContact CG2-CG 3.54Å; T120-A168 CarbonylContact C-O 3.57Å; T120-A168 VanDerWaalsContact CA-O 3.3Å; T120-A168 WeakPolarHBondContact CA-O 3.43Å; T120-A168 WeakPolarHBondContact CG2-O 3.31Å
121	L	96.2	Very high	80.4	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	128.4	169.6	-173.4	66.3	0	0	0	109.3	F85 F94 I96 V134 F136 I167 A168 V191	F85-L121 HydrophobicContact CE1-CD1 4.4Å; F85-L121 HydrophobicContact CZ-CD1 3.82Å; F94-L121 HydrophobicContact CB-CD1 4.02Å; F94-L121 HydrophobicContact CD1-CD2 4.37Å; F94-L121 HydrophobicContact CD1-CG 4.46Å; I96-L121 HydrophobicContact CG1-CD1 4.15Å; L121-V134 HydrophobicContact CD2-CB 4.3Å; L121-V134 HydrophobicContact CD2-CG1 3.67Å; L121-V134 HydrophobicContact CD2-CG2 3.57Å; L121-F136 HydrophobicContact CB-CE2 4.41Å; L121-F136 HydrophobicContact CB-CZ 3.88Å; L121-I167 HydrophobicContact CB-CG1 4.09Å; L121-I167 HydrophobicContact CD2-CD1 3.62Å; L121-I167 HydrophobicContact CD2-CG1 3.96Å; L121-I167 HydrophobicContact CG-CD1 3.98Å; L121-I167 HydrophobicContact CG-CG1 3.91Å; L121-I167 VanDerWaalsContact O-CG1 3.26Å; L121-I167 WeakPolarHBondContact O-CG1 3.26Å; L121-I167 PolarHBondContact O-N 2.89Å; L121-A168 HydrophobicContact CB-CB 3.8Å; L121-A168 PolarHBondContact N-O 3.42Å; L121-A168 PolarHBondContact O-N 3.43Å; L121-V191 HydrophobicContact CD2-CG2 3.79Å
122	H	93.5	Very high	82.6	Confident	32 Å²	32	54.5 Å²	54.5	15%	0.148	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	133.4	176.5	-60.1	-96.4	0	0	0	110.1	F94 K95 S97 T120 L124 G165	F94-H122 VanDerWaalsContact CA-O 3.26Å; F94-H122 WeakPolarHBondContact CA-O 3.3Å; K95-H122 PolarHBondContact N-O 2.88Å; K95-H122 VanDerWaalsContact N-O 3.08Å; K95-H122 PolarHBondContact O-N 3.31Å; S97-H122 PolarHBondContact OG-NE2 2.94Å; T120-H122 PolarHBondContact O-CD2 2.79Å; H122-L124 HydrophobicContact CB-CD2 4.4Å; H122-G165 CarbonylContact C-O 3.6Å; H122-G165 VanDerWaalsContact CA-O 3.29Å; H122-G165 WeakPolarHBondContact CA-O 3.32Å
123	S	92.4	Very high	84.7	Confident	4 Å²	4	51.4 Å²	51.4	3%	0.028	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	128	166.1	179.7	0	0	0	0	109.4	V164 G165	S123-V164 VanDerWaalsContact O-CA 3.3Å; S123-V164 WeakPolarHBondContact O-CA 3.28Å; S123-G165 PolarHBondContact N-O 3.19Å; S123-G165 PolarHBondContact O-N 2.6Å; S123-G165 VanDerWaalsContact O-N 3.14Å
124	L	91.2	Very high	86.8	Confident	30 Å²	30	42.1 Å²	42.1	16%	0.157	22%	0.215	C	C	.	.			trans	-100.4	-8.6	179.2	-51.8	-172.8	0	0	0	112.8	E84 K93 K95 H122 V164	E84-L124 HydrophobicContact CB-CD1 4.36Å; E84-L124 HydrophobicContact CG-CD1 3.77Å; E84-L124 WeakPolarHBondContact OE1-CD1 3.35Å; K93-L124 HydrophobicContact CB-CB 4.09Å; K93-L124 HydrophobicContact CD-CB 3.94Å; K93-L124 HydrophobicContact CD-CD1 3.87Å; K93-L124 HydrophobicContact CD-CG 4.49Å; K93-L124 HydrophobicContact CG-CB 4.07Å; K93-L124 HydrophobicContact CG-CD1 4Å; K93-L124 HydrophobicContact CG-CG 4.42Å; K93-L124 PolarHBondContact O-N 3.49Å; K95-L124 HydrophobicContact CB-CD1 4.18Å; K95-L124 HydrophobicContact CB-CD2 4.47Å; K95-L124 HydrophobicContact CB-CG 4.47Å; H122-L124 HydrophobicContact CB-CD2 4.4Å; L124-V164 HydrophobicContact CD2-CB 4.45Å; L124-V164 HydrophobicContact CD2-CG1 3.34Å; L124-V164 HydrophobicContact CD2-CG2 4.36Å
125	S	83.6	Confident	88.5	Confident	17 Å²	17	39.2 Å²	39.2	12%	0.119	20%	0.198	C	C	.	.			trans	-82.7	138.7	-179.5	-67.8	0	0	0	0	111.8	R91 Y92 K93	R91-S125 PolarHBondContact O-OG 3.36Å; Y92-S125 WeakPolarHBondContact CA-OG 3.29Å; K93-S125 PolarHBondContact N-OG 3.03Å
126	R	74.4	Confident	89.8	Confident	186 Å²	186	37.7 Å²	37.7	70%	0.702	19%	0.185	S	C	*	.	S	Bend	trans	-108.3	-4.2	-168.8	-66.7	-173.9	177.5	-171.9	-1.7	116.1	P161	R126-P161 CarbonylContact C-O 3.59Å
127	S	69.3	Low	90.2	Very high	88 Å²	88	33.3 Å²	33.3	62%	0.615	16%	0.164	S	C	*	.	S	Bend	trans	-123.8	-43.9	-168.7	56.8	0	0	0	0	114.3
128	D	80.7	Confident	90.5	Very high	52 Å²	52	30.5 Å²	30.5	28%	0.278	15%	0.154	S	C	.	.	S	Bend	trans	-90	132.9	-163.8	-61.7	-4.8	0	0	0	110.8	Y92 L130	Y92-D128 HydrophobicContact CE1-CB 3.8Å; D128-L130 PolarHBondContact O-N 2.95Å
129	P	87	Confident	90.6	Very high	80 Å²	80	31.3 Å²	31.3	52%	0.519	16%	0.161	S	C	.	.			trans	-58.7	130.4	170.8	-20.9	31.4	0	0	0	110.6	Y92 L158	Y92-P129 PolarHBondContact OH-O 2.87Å; P129-L158 CarbonylContact C-O 3.57Å; P129-L158 WeakPolarHBondContact CA-O 3.39Å; P129-L158 WeakPolarHBondContact CB-O 3.47Å
130	L	88.9	Confident	90.3	Very high	1 Å²	1	34.2 Å²	34.2	1%	0.005	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	113.1	-176.6	175.5	62.3	0	0	0	110.3	Y92 F94 D128 C132 H157 L158 I167 I193	Y92-L130 HydrophobicContact CD1-CB 4.23Å; Y92-L130 HydrophobicContact CD1-CD1 3.82Å; Y92-L130 HydrophobicContact CD1-CD2 4.27Å; Y92-L130 HydrophobicContact CD1-CG 4.32Å; Y92-L130 HydrophobicContact CD2-CD1 4.27Å; Y92-L130 HydrophobicContact CE1-CB 3.82Å; Y92-L130 HydrophobicContact CE1-CD1 3.75Å; Y92-L130 HydrophobicContact CE1-CG 4.26Å; Y92-L130 HydrophobicContact CE2-CD1 4.2Å; Y92-L130 HydrophobicContact CG-CD1 4.06Å; F94-L130 HydrophobicContact CE1-CD2 3.71Å; F94-L130 HydrophobicContact CZ-CD2 3.96Å; D128-L130 PolarHBondContact O-N 2.95Å; L130-C132 HydrophobicContact CD1-CB 4.01Å; L130-C132 HydrophobicContact CG-CB 4.28Å; L130-H157 CarbonylContact O-C 3.59Å; L130-H157 WeakPolarHBondContact O-CA 3.49Å; L130-L158 HydrophobicContact CB-CB 4.21Å; L130-L158 HydrophobicContact CB-CD1 4.1Å; L130-L158 HydrophobicContact CB-CG 4.39Å; L130-L158 HydrophobicContact CD2-CD1 4.04Å; L130-L158 PolarHBondContact N-O 3.4Å; L130-L158 PolarHBondContact O-N 3.31Å; L130-I167 HydrophobicContact CD2-CD1 4.3Å; L130-I193 HydrophobicContact CD1-CG1 4.21Å; L130-I193 HydrophobicContact CD1-CG2 3.81Å
131	S	91.8	Very high	89.8	Confident	12 Å²	12	36.6 Å²	36.6	8%	0.084	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	118.1	163.5	-63.4	0	0	0	0	108.2	I156 H157 Y194	S131-I156 CarbonylContact C-O 3.35Å; S131-I156 WeakPolarHBondContact CA-O 3.34Å; S131-H157 PolarHBondContact OG-CE1 2.79Å; S131-H157 PolarHBondContact OG-ND1 3.41Å; S131-Y194 PolarHBondContact O-N 2.75Å
132	C	94.2	Very high	88.8	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	161.7	177.6	67.6	0	0	0	0	113.5	L130 V155 I156 V191 T192 I193	L130-C132 HydrophobicContact CD1-CB 4.01Å; L130-C132 HydrophobicContact CG-CB 4.28Å; C132-V155 WeakPolarHBondContact O-CA 3.26Å; C132-I156 PolarHBondContact N-O 3.18Å; C132-I156 PolarHBondContact O-N 2.9Å; C132-V191 HydrophobicContact CB-CG1 3.89Å; C132-T192 CarbonylContact C-O 3.55Å; C132-T192 WeakPolarHBondContact CA-O 3.45Å; C132-T192 VanDerWaalsContact CB-O 3.27Å; C132-T192 WeakPolarHBondContact CB-O 3.39Å; C132-I193 HydrophobicContact CB-CG1 4.38Å
133	K	95.9	Very high	88	Confident	58 Å²	58	43.5 Å²	43.5	25%	0.252	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	129	166.2	-175.6	171.2	77.1	149.7	0	109.2	E153 K154 V155 V191 T192 Y194	K133-E153 WeakPolarHBondContact CD-OE2 3.26Å; K133-E153 WeakPolarHBondContact CE-OE2 3.12Å; K133-E153 HydrophobicContact CG-CB 4.41Å; K133-E153 IonicContact NZ-OE1 3.34Å; K133-E153 IonicContact NZ-OE2 3.38Å; K133-E153 PolarHBondContact NZ-OE2 2.8Å; K133-K154 WeakPolarHBondContact CA-O 3.29Å; K133-V155 HydrophobicContact CB-CG2 4.35Å; K133-V155 HydrophobicContact CD-CG2 4.25Å; K133-V155 HydrophobicContact CG-CG2 4.1Å; K133-V191 WeakPolarHBondContact O-CA 3.45Å; K133-T192 PolarHBondContact N-O 3.05Å; K133-T192 PolarHBondContact O-N 3.5Å; K133-Y194 HydrophobicContact CB-CE2 4.03Å; K133-Y194 WeakPolarHBondContact CB-OH 3.43Å
134	V	96.1	Very high	87	Confident	3 Å²	3	49.6 Å²	49.6	2%	0.018	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	135.9	-177	178.3	0	0	0	0	109.2	L121 F136 E153 K154 I156 A168 V190 V191	L121-V134 HydrophobicContact CD2-CB 4.3Å; L121-V134 HydrophobicContact CD2-CG1 3.67Å; L121-V134 HydrophobicContact CD2-CG2 3.57Å; V134-F136 HydrophobicContact CG1-CD2 4.4Å; V134-F136 HydrophobicContact CG1-CE2 4.06Å; V134-E153 CarbonylContact O-C 3.56Å; V134-E153 VanDerWaalsContact O-CA 3.28Å; V134-E153 WeakPolarHBondContact O-CA 3.19Å; V134-K154 PolarHBondContact N-O 3.49Å; V134-K154 PolarHBondContact O-N 2.83Å; V134-I156 HydrophobicContact CB-CD1 4.23Å; V134-I156 HydrophobicContact CG2-CD1 3.57Å; V134-A168 HydrophobicContact CB-CB 4.04Å; V134-A168 HydrophobicContact CG1-CB 3.77Å; V134-A168 HydrophobicContact CG2-CB 4.29Å; V134-V190 WeakPolarHBondContact CA-O 3.39Å; V134-V191 HydrophobicContact CG2-CG1 4.28Å; V134-V191 HydrophobicContact CG2-CG2 4.37Å
135	R	95.7	Very high	86.2	Confident	67 Å²	67	55.3 Å²	55.3	25%	0.253	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	140.1	174.7	-178.5	175.5	64.9	95.6	6.1	109.1	D137 T150 E153 V190	R135-D137 IonicContact CZ-OD1 3.97Å; R135-D137 IonicContact CZ-OD2 2.75Å; R135-D137 IonicContact NH1-OD1 3.38Å; R135-D137 PolarHBondContact NH1-OD1 2.82Å; R135-D137 IonicContact NH1-OD2 2.99Å; R135-D137 PolarHBondContact NH1-OD2 3.37Å; R135-D137 IonicContact NH2-OD2 3.86Å; R135-D137 PolarHBondContact NH2-OD2 2.83Å; R135-T150 HydrophobicContact CG-CG2 4.07Å; R135-E153 HydrophobicContact CB-CB 4.47Å; R135-V190 PolarHBondContact N-O 2.8Å; R135-V190 PolarHBondContact O-N 3.35Å
136	F	96.8	Very high	86.1	Confident	4 Å²	4	57.8 Å²	57.8	2%	0.018	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	140.5	170.5	-70.9	-81	0	0	0	109.1	I96 L119 L121 V134 L151 A168 V170 V187 I188 C189	I96-F136 HydrophobicContact CD1-CE1 4.16Å; I96-F136 HydrophobicContact CG1-CE1 4.12Å; I96-F136 HydrophobicContact CG2-CE1 3.91Å; I96-F136 HydrophobicContact CG2-CZ 4.39Å; L119-F136 HydrophobicContact CB-CE1 4.49Å; L119-F136 HydrophobicContact CB-CZ 4.41Å; L119-F136 HydrophobicContact CD1-CB 4.39Å; L119-F136 HydrophobicContact CD1-CD1 4.12Å; L119-F136 HydrophobicContact CD1-CG 4.28Å; L121-F136 HydrophobicContact CB-CE2 4.41Å; L121-F136 HydrophobicContact CB-CZ 3.88Å; V134-F136 HydrophobicContact CG1-CD2 4.4Å; V134-F136 HydrophobicContact CG1-CE2 4.06Å; F136-L151 HydrophobicContact CB-CB 4.29Å; F136-L151 HydrophobicContact CB-CD1 3.86Å; F136-L151 HydrophobicContact CB-CG 4.46Å; F136-L151 WeakPolarHBondContact O-CA 3.44Å; F136-L151 VanDerWaalsContact O-CB 3.23Å; F136-L151 WeakPolarHBondContact O-CB 3.45Å; F136-L151 PolarHBondContact O-N 2.81Å; F136-A168 HydrophobicContact CE2-CB 4.46Å; F136-V170 HydrophobicContact CB-CG1 4.22Å; F136-V170 HydrophobicContact CD2-CB 4.48Å; F136-V170 HydrophobicContact CD2-CG1 3.52Å; F136-V170 HydrophobicContact CE2-CG1 4.11Å; F136-V170 HydrophobicContact CG-CG1 4.1Å; F136-V187 HydrophobicContact CD1-CG1 3.96Å; F136-I188 CarbonylContact C-O 3.54Å; F136-I188 VanDerWaalsContact CA-O 3.29Å; F136-I188 WeakPolarHBondContact CA-O 3.39Å; F136-C189 HydrophobicContact CD1-CB 3.89Å; F136-C189 HydrophobicContact CE1-CB 3.8Å
137	D	95.1	Very high	86.7	Confident	3 Å²	3	50.3 Å²	50.3	2%	0.016	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	148.3	170.1	-45.4	-49.4	0	0	0	110.1	R135 L148 Q149 T150 I188	R135-D137 IonicContact CZ-OD1 3.97Å; R135-D137 IonicContact CZ-OD2 2.75Å; R135-D137 IonicContact NH1-OD1 3.38Å; R135-D137 PolarHBondContact NH1-OD1 2.82Å; R135-D137 IonicContact NH1-OD2 2.99Å; R135-D137 PolarHBondContact NH1-OD2 3.37Å; R135-D137 IonicContact NH2-OD2 3.86Å; R135-D137 PolarHBondContact NH2-OD2 2.83Å; D137-L148 HydrophobicContact CB-CD2 3.88Å; D137-L148 HydrophobicContact CB-CG 4.49Å; D137-Q149 CarbonylContact C-O 3.54Å; D137-Q149 VanDerWaalsContact CA-O 3.24Å; D137-Q149 WeakPolarHBondContact CA-O 3.5Å; D137-T150 WeakPolarHBondContact OD1-CA 3.24Å; D137-T150 WeakPolarHBondContact OD1-CG2 3.28Å; D137-I188 HydrophobicContact CB-CB 4.21Å; D137-I188 PolarHBondContact N-O 3.14Å; D137-I188 PolarHBondContact O-N 2.8Å
138	I	95.5	Very high	87.7	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	121.6	170.3	-51.5	-59.5	0	0	0	108.4	L119 L148 Q149 L151 L172 L179 L185 T186 V187	L119-I138 HydrophobicContact CD1-CD1 4.24Å; I138-L148 CarbonylContact O-C 3.56Å; I138-L148 WeakPolarHBondContact O-CA 3.45Å; I138-Q149 HydrophobicContact CB-CB 4.49Å; I138-Q149 PolarHBondContact N-O 3.31Å; I138-Q149 PolarHBondContact O-N 2.99Å; I138-L151 HydrophobicContact CD1-CD1 4.47Å; I138-L151 HydrophobicContact CG1-CD1 4.32Å; I138-L172 HydrophobicContact CD1-CD2 4.02Å; I138-L172 HydrophobicContact CG1-CD2 4.28Å; I138-L179 HydrophobicContact CG2-CB 3.96Å; I138-L179 HydrophobicContact CG2-CD2 4.44Å; I138-L185 HydrophobicContact CD1-CD1 4.39Å; I138-L185 HydrophobicContact CG2-CD1 3.71Å; I138-T186 WeakPolarHBondContact CA-O 3.25Å; I138-V187 HydrophobicContact CD1-CB 4.45Å; I138-V187 HydrophobicContact CD1-CG1 4.47Å; I138-V187 HydrophobicContact CD1-CG2 3.9Å
139	A	93.3	Very high	88.2	Confident	21 Å²	21	51.2 Å²	51.2	17%	0.174	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	132.7	177.9	0	0	0	0	0	110.3	S147 L148 T186 I188	A139-S147 WeakPolarHBondContact CA-O 3.34Å; A139-L148 HydrophobicContact CB-CD1 4.5Å; A139-L148 HydrophobicContact CB-CG 4.41Å; A139-T186 HydrophobicContact CB-CG2 3.97Å; A139-T186 PolarHBondContact N-O 3.05Å; A139-I188 HydrophobicContact CB-CD1 3.96Å
140	Y	90.6	Very high	88.5	Confident	60 Å²	60	51.5 Å²	51.5	24%	0.235	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	156	-178.2	58.6	-83.7	0	0	0	110.4	N142 S147 Q149 S178 L179	Y140-N142 HydrophobicContact CE2-CB 4.38Å; Y140-S147 VanDerWaalsContact CE2-CB 3.48Å; Y140-S147 VanDerWaalsContact CZ-CB 3.48Å; Y140-S147 PolarHBondContact N-O 3.46Å; Y140-S147 PolarHBondContact O-N 3.32Å; Y140-Q149 HydrophobicContact CE1-CB 4.02Å; Y140-S178 WeakPolarHBondContact CD2-O 3.18Å; Y140-L179 HydrophobicContact CD1-CD2 3.74Å; Y140-L179 HydrophobicContact CE1-CD2 3.68Å; Y140-L179 HydrophobicContact CG-CD2 4.47Å
141	A	83.2	Confident	88.6	Confident	50 Å²	50	52.1 Å²	52.1	41%	0.413	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	132.5	174	0	0	0	0	0	110.7	D181	A141-D181 HydrophobicContact CB-CB 4.49Å; A141-D181 WeakPolarHBondContact CB-OD2 3.5Å
142	N	75.6	Confident	88.6	Confident	105 Å²	105	56.3 Å²	56.3	56%	0.561	35%	0.346	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125	96.1	168	-173.7	7.4	0	0	0	108.6	Y140 S144 Q145 S147	Y140-N142 HydrophobicContact CE2-CB 4.38Å; N142-S144 PolarHBondContact O-N 2.58Å; N142-Q145 CarbonylContact C-O 3.59Å; N142-Q145 PolarHBondContact N-O 3.39Å; N142-Q145 PolarHBondContact O-N 2.75Å; N142-Q145 VanDerWaalsContact O-O 3.05Å; N142-S147 VanDerWaalsContact CB-OG 3.29Å; N142-S147 WeakPolarHBondContact CB-OG 3.27Å
143	G	77.1	Confident	88.5	Confident	73 Å²	73	61.7 Å²	61.7	75%	0.753	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.1	-129.1	-170.2	0	0	0	0	0	111.3
144	S	71.5	Confident	88.2	Confident	131 Å²	131	63.6 Å²	63.6	92%	0.916	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.5	4.8	179.5	43	0	0	0	0	114.7	N142	N142-S144 PolarHBondContact O-N 2.58Å
145	Q	74.9	Confident	88	Confident	151 Å²	151	67.5 Å²	67.5	71%	0.706	40%	0.403	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.1	142.1	177.6	-69.3	-176.6	-0.2	0	0	111.6	N142	N142-Q145 CarbonylContact C-O 3.59Å; N142-Q145 PolarHBondContact N-O 3.39Å; N142-Q145 PolarHBondContact O-N 2.75Å; N142-Q145 VanDerWaalsContact O-O 3.05Å
146	G	80.3	Confident	87.6	Confident	69 Å²	69	65.1 Å²	65.1	71%	0.711	40%	0.395	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.4	130.9	170.3	0	0	0	0	0	110.7
147	S	87.8	Confident	87	Confident	28 Å²	28	68.6 Å²	68.6	20%	0.196	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	154	174	-68.7	0	0	0	0	110.6	A139 Y140 N142	A139-S147 WeakPolarHBondContact CA-O 3.34Å; Y140-S147 VanDerWaalsContact CE2-CB 3.48Å; Y140-S147 VanDerWaalsContact CZ-CB 3.48Å; Y140-S147 PolarHBondContact N-O 3.46Å; Y140-S147 PolarHBondContact O-N 3.32Å; N142-S147 VanDerWaalsContact CB-OG 3.29Å; N142-S147 WeakPolarHBondContact CB-OG 3.27Å
148	L	89.1	Confident	86.5	Confident	97 Å²	97	70.3 Å²	70.3	51%	0.508	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	132.6	174.7	-88.5	81.6	0	0	0	110	D137 I138 A139 I188	D137-L148 HydrophobicContact CB-CD2 3.88Å; D137-L148 HydrophobicContact CB-CG 4.49Å; I138-L148 CarbonylContact O-C 3.56Å; I138-L148 WeakPolarHBondContact O-CA 3.45Å; A139-L148 HydrophobicContact CB-CD1 4.5Å; A139-L148 HydrophobicContact CB-CG 4.41Å; L148-I188 HydrophobicContact CD2-CD1 4.03Å
149	Q	91.4	Very high	85.7	Confident	63 Å²	63	76.1 Å²	76.1	29%	0.294	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	113.3	163.8	-175.8	-174.4	40.4	0	0	109.1	D137 I138 Y140 L179	D137-Q149 CarbonylContact C-O 3.54Å; D137-Q149 VanDerWaalsContact CA-O 3.24Å; D137-Q149 WeakPolarHBondContact CA-O 3.5Å; I138-Q149 HydrophobicContact CB-CB 4.49Å; I138-Q149 PolarHBondContact N-O 3.31Å; I138-Q149 PolarHBondContact O-N 2.99Å; Y140-Q149 HydrophobicContact CE1-CB 4.02Å; Q149-L179 HydrophobicContact CB-CD2 3.99Å; Q149-L179 VanDerWaalsContact OE1-CD2 3.24Å
150	T	93.1	Very high	84.6	Confident	86 Å²	86	83.4 Å²	83.4	53%	0.528	47%	0.474	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	126.1	175.9	-56.6	0	0	0	0	110.8	R135 D137	R135-T150 HydrophobicContact CG-CG2 4.07Å; D137-T150 WeakPolarHBondContact OD1-CA 3.24Å; D137-T150 WeakPolarHBondContact OD1-CG2 3.28Å
151	L	91.7	Very high	83.4	Confident	13 Å²	13	81.4 Å²	81.4	7%	0.068	47%	0.468	C	S	.	.	P	Polyproline II helix	trans	-91.5	161	174.4	-55.4	178	0	0	0	111	L119 F136 I138 E153 V170 L172	L119-L151 HydrophobicContact CD1-CD1 4.27Å; F136-L151 HydrophobicContact CB-CB 4.29Å; F136-L151 HydrophobicContact CB-CD1 3.86Å; F136-L151 HydrophobicContact CB-CG 4.46Å; F136-L151 WeakPolarHBondContact O-CA 3.44Å; F136-L151 VanDerWaalsContact O-CB 3.23Å; F136-L151 WeakPolarHBondContact O-CB 3.45Å; F136-L151 PolarHBondContact O-N 2.81Å; I138-L151 HydrophobicContact CD1-CD1 4.47Å; I138-L151 HydrophobicContact CG1-CD1 4.32Å; L151-E153 PolarHBondContact O-N 3.24Å; L151-V170 HydrophobicContact CB-CG2 4.04Å; L151-V170 HydrophobicContact CD1-CG1 3.86Å; L151-V170 HydrophobicContact CD1-CG2 4.35Å; L151-L172 HydrophobicContact CD1-CD2 3.59Å
152	P	91.6	Very high	82.4	Confident	100 Å²	100	90.3 Å²	90.3	65%	0.649	49%	0.491	S	S	*	.	P	Polyproline II helix	trans	-52.8	134.7	-179.4	-28.2	35.3	0	0	0	113.4
153	E	92	Very high	81.9	Confident	114 Å²	114	88.2 Å²	88.2	53%	0.533	49%	0.488	S	S	.	.	P	Polyproline II helix	trans	-80.3	149.5	175.3	58.9	175.8	-151	0	0	112.1	K133 V134 R135 L151	K133-E153 WeakPolarHBondContact CD-OE2 3.26Å; K133-E153 WeakPolarHBondContact CE-OE2 3.12Å; K133-E153 HydrophobicContact CG-CB 4.41Å; K133-E153 IonicContact NZ-OE1 3.34Å; K133-E153 IonicContact NZ-OE2 3.38Å; K133-E153 PolarHBondContact NZ-OE2 2.8Å; V134-E153 CarbonylContact O-C 3.56Å; V134-E153 VanDerWaalsContact O-CA 3.28Å; V134-E153 WeakPolarHBondContact O-CA 3.19Å; R135-E153 HydrophobicContact CB-CB 4.47Å; L151-E153 PolarHBondContact O-N 3.24Å
154	K	90.4	Very high	81.8	Confident	98 Å²	98	88 Å²	88	43%	0.426	47%	0.472	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	126.7	178.8	-169	168.3	-179.2	174.7	0	110.6	K133 V134 I156 A168	K133-K154 WeakPolarHBondContact CA-O 3.29Å; V134-K154 PolarHBondContact N-O 3.49Å; V134-K154 PolarHBondContact O-N 2.83Å; K154-I156 HydrophobicContact CG-CG1 4.23Å; K154-A168 HydrophobicContact CD-CB 4.47Å
155	V	90.5	Very high	82.5	Confident	85 Å²	85	83.1 Å²	83.1	52%	0.515	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	132.3	173.6	-178.1	0	0	0	0	109.2	C132 K133	C132-V155 WeakPolarHBondContact O-CA 3.26Å; K133-V155 HydrophobicContact CB-CG2 4.35Å; K133-V155 HydrophobicContact CD-CG2 4.25Å; K133-V155 HydrophobicContact CG-CG2 4.1Å
156	I	87.3	Confident	83.1	Confident	16 Å²	16	80.8 Å²	80.8	8%	0.082	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	139	-171.4	-58.1	157.6	0	0	0	108.8	S131 C132 V134 K154 L158 I167 A168	S131-I156 CarbonylContact C-O 3.35Å; S131-I156 WeakPolarHBondContact CA-O 3.34Å; C132-I156 PolarHBondContact N-O 3.18Å; C132-I156 PolarHBondContact O-N 2.9Å; V134-I156 HydrophobicContact CB-CD1 4.23Å; V134-I156 HydrophobicContact CG2-CD1 3.57Å; K154-I156 HydrophobicContact CG-CG1 4.23Å; I156-L158 HydrophobicContact CG2-CD2 3.85Å; I156-L158 HydrophobicContact CG2-CG 3.93Å; I156-I167 HydrophobicContact CD1-CB 4.13Å; I156-I167 HydrophobicContact CD1-CD1 4.28Å; I156-I167 HydrophobicContact CD1-CG1 4.25Å; I156-I167 WeakPolarHBondContact CD1-O 3.33Å; I156-I167 WeakPolarHBondContact CG1-O 2.87Å; I156-I167 HydrophobicContact CG2-CB 4.29Å; I156-A168 HydrophobicContact CD1-CB 3.73Å
157	H	85.9	Confident	83.6	Confident	78 Å²	78	78.3 Å²	78.3	36%	0.361	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	111.1	173.9	-175.7	72	0	0	0	110.4	L130 S131 K159	L130-H157 CarbonylContact O-C 3.59Å; L130-H157 WeakPolarHBondContact O-CA 3.49Å; S131-H157 PolarHBondContact OG-CE1 2.79Å; S131-H157 PolarHBondContact OG-ND1 3.41Å; H157-K159 WeakPolarHBondContact NE2-CE 3.37Å; H157-K159 WeakPolarHBondContact NE2-CG 3.05Å
158	L	83.1	Confident	83.8	Confident	39 Å²	39	77.1 Å²	77.1	20%	0.204	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	105.2	179.6	-53.7	177.1	0	0	0	109	P129 L130 I156 I167	P129-L158 CarbonylContact C-O 3.57Å; P129-L158 WeakPolarHBondContact CA-O 3.39Å; P129-L158 WeakPolarHBondContact CB-O 3.47Å; L130-L158 HydrophobicContact CB-CB 4.21Å; L130-L158 HydrophobicContact CB-CD1 4.1Å; L130-L158 HydrophobicContact CB-CG 4.39Å; L130-L158 HydrophobicContact CD2-CD1 4.04Å; L130-L158 PolarHBondContact N-O 3.4Å; L130-L158 PolarHBondContact O-N 3.31Å; I156-L158 HydrophobicContact CG2-CD2 3.85Å; I156-L158 HydrophobicContact CG2-CG 3.93Å; L158-I167 HydrophobicContact CD1-CB 4.45Å; L158-I167 HydrophobicContact CD1-CG2 3.56Å; L158-I167 HydrophobicContact CD2-CG2 4.2Å; L158-I167 HydrophobicContact CG-CG2 4.45Å
159	K	78.9	Confident	84	Confident	121 Å²	121	76 Å²	76	53%	0.526	39%	0.386	S	S	.	.	S	Bend	trans	-75.3	-34.1	-179.3	-70.5	-172.2	173.6	-169.6	0	113.6	D31 H157	D31-K159 IonicContact OD2-NZ 2.75Å; D31-K159 PolarHBondContact OD2-NZ 3.1Å; H157-K159 WeakPolarHBondContact NE2-CE 3.37Å; H157-K159 WeakPolarHBondContact NE2-CG 3.05Å
160	K	71.4	Confident	84.1	Confident	175 Å²	175	73.9 Å²	73.9	76%	0.761	38%	0.377	S	S	*	.			trans	-154	89.4	-179.5	-66.6	-173.3	-178.7	179.4	0	109.8	R162	K160-R162 PolarHBondContact O-N 3.4Å
161	P	63.9	Low	84.1	Confident	17 Å²	17	72.8 Å²	72.8	11%	0.11	37%	0.37	C	S	.	.			trans	-68.2	99.4	176.4	26.7	-30.6	0	0	0	109.4	R126 A163	R126-P161 CarbonylContact C-O 3.59Å; P161-A163 PolarHBondContact O-N 3.46Å
162	R	62.9	Low	84.1	Confident	237 Å²	237	72.5 Å²	72.5	89%	0.894	37%	0.369	S	S	*	.			trans	-72	-19.8	178.6	-70.2	-176.3	178.5	169.6	-0.7	112.9	K160	K160-R162 PolarHBondContact O-N 3.4Å
163	A	66.1	Low	83.8	Confident	62 Å²	62	69.7 Å²	69.7	51%	0.512	35%	0.351	S	S	.	.	S	Bend	trans	-154	167.2	-177.3	0	0	0	0	0	111	P161	P161-A163 PolarHBondContact O-N 3.46Å
164	V	74.6	Confident	83.3	Confident	67 Å²	67	72.1 Å²	72.1	41%	0.406	36%	0.362	S	S	.	.	S	Bend	trans	-58.2	133.5	161.1	174.3	0	0	0	0	108.4	S123 L124	S123-V164 VanDerWaalsContact O-CA 3.3Å; S123-V164 WeakPolarHBondContact O-CA 3.28Å; L124-V164 HydrophobicContact CD2-CB 4.45Å; L124-V164 HydrophobicContact CD2-CG1 3.34Å; L124-V164 HydrophobicContact CD2-CG2 4.36Å
165	G	85.3	Confident	83	Confident	29 Å²	29	72.3 Å²	72.3	30%	0.299	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-168.6	169.9	-179.7	0	0	0	0	0	114.9	H122 S123	H122-G165 CarbonylContact C-O 3.6Å; H122-G165 VanDerWaalsContact CA-O 3.29Å; H122-G165 WeakPolarHBondContact CA-O 3.32Å; S123-G165 PolarHBondContact N-O 3.19Å; S123-G165 PolarHBondContact O-N 2.6Å; S123-G165 VanDerWaalsContact O-N 3.14Å
166	E	88.6	Confident	82.7	Confident	102 Å²	102	68.5 Å²	68.5	48%	0.477	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	132.5	174.8	-53	-171	159.3	0	0	110.3	K101 T120	K101-E166 IonicContact NZ-OE1 3.5Å; K101-E166 PolarHBondContact NZ-OE1 2.85Å; K101-E166 IonicContact NZ-OE2 3.24Å; T120-E166 HydrophobicContact CG2-CB 3.7Å; T120-E166 HydrophobicContact CG2-CG 3.54Å
167	I	90.3	Very high	82.5	Confident	17 Å²	17	73.4 Å²	73.4	9%	0.087	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	-32.2	179.5	62.3	159.7	0	0	0	112	F94 L121 L130 I156 L158	F94-I167 HydrophobicContact CD1-CD1 4.17Å; F94-I167 HydrophobicContact CE1-CD1 3.96Å; L121-I167 HydrophobicContact CB-CG1 4.09Å; L121-I167 HydrophobicContact CD2-CD1 3.62Å; L121-I167 HydrophobicContact CD2-CG1 3.96Å; L121-I167 HydrophobicContact CG-CD1 3.98Å; L121-I167 HydrophobicContact CG-CG1 3.91Å; L121-I167 VanDerWaalsContact O-CG1 3.26Å; L121-I167 WeakPolarHBondContact O-CG1 3.26Å; L121-I167 PolarHBondContact O-N 2.89Å; L130-I167 HydrophobicContact CD2-CD1 4.3Å; I156-I167 HydrophobicContact CD1-CB 4.13Å; I156-I167 HydrophobicContact CD1-CD1 4.28Å; I156-I167 HydrophobicContact CD1-CG1 4.25Å; I156-I167 WeakPolarHBondContact CD1-O 3.33Å; I156-I167 WeakPolarHBondContact CG1-O 2.87Å; I156-I167 HydrophobicContact CG2-CB 4.29Å; L158-I167 HydrophobicContact CD1-CB 4.45Å; L158-I167 HydrophobicContact CD1-CG2 3.56Å; L158-I167 HydrophobicContact CD2-CG2 4.2Å; L158-I167 HydrophobicContact CG-CG2 4.45Å
168	A	92.8	Very high	82.5	Confident	3 Å²	3	73.8 Å²	73.8	3%	0.025	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	145.8	176.2	0	0	0	0	0	109.6	T120 L121 V134 F136 K154 I156	T120-A168 CarbonylContact C-O 3.57Å; T120-A168 VanDerWaalsContact CA-O 3.3Å; T120-A168 WeakPolarHBondContact CA-O 3.43Å; T120-A168 WeakPolarHBondContact CG2-O 3.31Å; L121-A168 HydrophobicContact CB-CB 3.8Å; L121-A168 PolarHBondContact N-O 3.42Å; L121-A168 PolarHBondContact O-N 3.43Å; V134-A168 HydrophobicContact CB-CB 4.04Å; V134-A168 HydrophobicContact CG1-CB 3.77Å; V134-A168 HydrophobicContact CG2-CB 4.29Å; F136-A168 HydrophobicContact CE2-CB 4.46Å; K154-A168 HydrophobicContact CD-CB 4.47Å; I156-A168 HydrophobicContact CD1-CB 3.73Å
169	E	93	Very high	82.8	Confident	75 Å²	75	72.1 Å²	72.1	35%	0.35	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	138	175.2	-176.1	173.4	124.9	0	0	108.4	K101 T118 L119	K101-E169 IonicContact NZ-OE2 2.84Å; K101-E169 PolarHBondContact NZ-OE2 2.86Å; T118-E169 HydrophobicContact CG2-CG 3.15Å; T118-E169 WeakPolarHBondContact CG2-OE1 3.35Å; L119-E169 CarbonylContact O-C 3.59Å; L119-E169 VanDerWaalsContact O-CA 3.32Å; L119-E169 WeakPolarHBondContact O-CA 3.32Å
170	V	93.7	Very high	83.3	Confident	17 Å²	17	67.4 Å²	67.4	10%	0.103	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	135.9	172	68.3	0	0	0	0	110.8	L119 F136 L151	L119-V170 HydrophobicContact CB-CG1 3.85Å; L119-V170 HydrophobicContact CD1-CG1 4.44Å; L119-V170 PolarHBondContact N-O 2.82Å; L119-V170 PolarHBondContact O-N 2.83Å; F136-V170 HydrophobicContact CB-CG1 4.22Å; F136-V170 HydrophobicContact CD2-CB 4.48Å; F136-V170 HydrophobicContact CD2-CG1 3.52Å; F136-V170 HydrophobicContact CE2-CG1 4.11Å; F136-V170 HydrophobicContact CG-CG1 4.1Å; L151-V170 HydrophobicContact CB-CG2 4.04Å; L151-V170 HydrophobicContact CD1-CG1 3.86Å; L151-V170 HydrophobicContact CD1-CG2 4.35Å
171	T	92.3	Very high	84.2	Confident	63 Å²	63	63 Å²	63	39%	0.387	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	131.6	174.6	-50.8	0	0	0	0	110.1	Q116 R117	Q116-T171 HydrophobicContact CB-CG2 3.7Å; Q116-T171 HydrophobicContact CG-CG2 4.29Å; R117-T171 CarbonylContact O-C 3.59Å; R117-T171 WeakPolarHBondContact O-CA 3.35Å
172	L	91	Very high	85.5	Confident	8 Å²	8	69 Å²	69	4%	0.042	37%	0.37	C	S	.	.	P	Polyproline II helix	trans	-77.6	154.4	173.4	-66.5	-178.7	0	0	0	111.5	L98 R117 L119 I138 L151 M176	L98-L172 HydrophobicContact CD1-CD1 3.79Å; R117-L172 HydrophobicContact CB-CB 3.92Å; R117-L172 HydrophobicContact CB-CD1 4.14Å; R117-L172 HydrophobicContact CB-CG 4.38Å; R117-L172 PolarHBondContact O-N 3.19Å; L119-L172 HydrophobicContact CD1-CD1 4.41Å; L119-L172 HydrophobicContact CD1-CD2 3.68Å; L119-L172 HydrophobicContact CD1-CG 4.26Å; L119-L172 HydrophobicContact CG-CD1 4.18Å; L119-L172 HydrophobicContact CG-CD2 4.13Å; L119-L172 HydrophobicContact CG-CG 4.16Å; I138-L172 HydrophobicContact CD1-CD2 4.02Å; I138-L172 HydrophobicContact CG1-CD2 4.28Å; L151-L172 HydrophobicContact CD1-CD2 3.59Å; L172-M176 HydrophobicContact CB-SD 3.98Å; L172-M176 HydrophobicContact CD1-CE 3.94Å; L172-M176 HydrophobicContact CD1-SD 4.33Å
173	P	86.4	Confident	86.9	Confident	40 Å²	40	60 Å²	60	26%	0.26	34%	0.339	S	S	.	.	P	Polyproline II helix	trans	-55.1	147.7	173.3	-24.7	35.2	0	0	0	112.7	L179	P173-L179 HydrophobicContact CB-CD1 4.5Å; P173-L179 HydrophobicContact CG-CD1 4.03Å
174	Q	81.9	Confident	88.3	Confident	165 Å²	165	58.4 Å²	58.4	77%	0.771	32%	0.323	S	S	*	.	S	Bend	trans	-64.7	-43.1	178.4	-70.9	-176	-9.2	0	0	112	R117	R117-Q174 PolarHBondContact NH1-O 3.46Å; R117-Q174 VanDerWaalsContact NH1-O 3.12Å
175	N	83.5	Confident	89.3	Confident	102 Å²	102	55.2 Å²	55.2	55%	0.545	30%	0.304	S	S	.	.			trans	-89.9	111.2	174.3	-172.1	-15.4	0	0	0	109.6	D177	N175-D177 WeakPolarHBondContact OD1-CB 3.4Å; N175-D177 PolarHBondContact OD1-N 2.91Å; N175-D177 PolarHBondContact OD1-OD2 3.19Å
176	M	83.4	Confident	89.8	Confident	5 Å²	5	55 Å²	55	3%	0.025	30%	0.296	C	S	.	.			trans	-103.3	-4.7	-178.4	-68.2	-67.7	-64.1	0	0	112.8	L172 S178 L179 I180 L185	L172-M176 HydrophobicContact CB-SD 3.98Å; L172-M176 HydrophobicContact CD1-CE 3.94Å; L172-M176 HydrophobicContact CD1-SD 4.33Å; M176-S178 PolarHBondContact O-N 2.92Å; M176-S178 VanDerWaalsContact O-N 3.15Å; M176-L179 HydrophobicContact CE-CB 4.27Å; M176-L179 HydrophobicContact CE-CD1 4.22Å; M176-L179 WeakPolarHBondContact O-CA 3.38Å; M176-L179 WeakPolarHBondContact O-CB 3.16Å; M176-L179 PolarHBondContact O-N 3.33Å; M176-L179 HydrophobicContact SD-CD1 3.84Å; M176-I180 HydrophobicContact CB-CD1 3.72Å; M176-I180 HydrophobicContact CB-CG1 4.28Å; M176-I180 WeakPolarHBondContact O-CG1 3.31Å; M176-I180 PolarHBondContact O-N 3.48Å; M176-I180 VanDerWaalsContact O-N 3.16Å; M176-L185 HydrophobicContact CE-CD1 3.62Å; M176-L185 HydrophobicContact CE-CD2 4.16Å
177	D	84.2	Confident	90.2	Very high	120 Å²	120	50.1 Å²	50.1	64%	0.642	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-34.9	-169.5	-61	-19	0	0	0	111.9	N175 L179	N175-D177 WeakPolarHBondContact OD1-CB 3.4Å; N175-D177 PolarHBondContact OD1-N 2.91Å; N175-D177 PolarHBondContact OD1-OD2 3.19Å; D177-L179 VanDerWaalsContact C-N 3.31Å; D177-L179 PolarHBondContact O-N 3.49Å
178	S	85.9	Confident	90.6	Very high	85 Å²	85	49.6 Å²	49.6	59%	0.594	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.1	-12.4	176.7	63.1	0	0	0	0	114.9	Y140 M176	Y140-S178 WeakPolarHBondContact CD2-O 3.18Å; M176-S178 PolarHBondContact O-N 2.92Å; M176-S178 VanDerWaalsContact O-N 3.15Å
179	L	88.6	Confident	90.8	Very high	4 Å²	4	49.5 Å²	49.5	2%	0.021	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.9	-9.7	-173.9	-59.9	172.8	0	0	0	112.8	I138 Y140 Q149 P173 M176 D177	I138-L179 HydrophobicContact CG2-CB 3.96Å; I138-L179 HydrophobicContact CG2-CD2 4.44Å; Y140-L179 HydrophobicContact CD1-CD2 3.74Å; Y140-L179 HydrophobicContact CE1-CD2 3.68Å; Y140-L179 HydrophobicContact CG-CD2 4.47Å; Q149-L179 HydrophobicContact CB-CD2 3.99Å; Q149-L179 VanDerWaalsContact OE1-CD2 3.24Å; P173-L179 HydrophobicContact CB-CD1 4.5Å; P173-L179 HydrophobicContact CG-CD1 4.03Å; M176-L179 HydrophobicContact CE-CB 4.27Å; M176-L179 HydrophobicContact CE-CD1 4.22Å; M176-L179 WeakPolarHBondContact O-CA 3.38Å; M176-L179 WeakPolarHBondContact O-CB 3.16Å; M176-L179 PolarHBondContact O-N 3.33Å; M176-L179 HydrophobicContact SD-CD1 3.84Å; D177-L179 VanDerWaalsContact C-N 3.31Å; D177-L179 PolarHBondContact O-N 3.49Å
180	I	90.6	Very high	91	Very high	22 Å²	22	46 Å²	46	11%	0.113	25%	0.254	C	S	.	.			trans	-102.6	115.8	177.4	-62.8	164.1	0	0	0	107.2	Y66 M176 L185	Y66-I180 HydrophobicContact CD1-CD1 3.5Å; Y66-I180 VanDerWaalsContact CD1-CD1 3.5Å; Y66-I180 HydrophobicContact CD1-CG1 4.16Å; Y66-I180 HydrophobicContact CE1-CD1 3.59Å; Y66-I180 HydrophobicContact CE1-CG1 4.45Å; M176-I180 HydrophobicContact CB-CD1 3.72Å; M176-I180 HydrophobicContact CB-CG1 4.28Å; M176-I180 WeakPolarHBondContact O-CG1 3.31Å; M176-I180 PolarHBondContact O-N 3.48Å; M176-I180 VanDerWaalsContact O-N 3.16Å; I180-L185 HydrophobicContact CG1-CD1 4.48Å
181	D	89.7	Confident	91.1	Very high	83 Å²	83	45.2 Å²	45.2	44%	0.444	25%	0.249	S	C	.	.	B	Isolated β-bridge	trans	-102	120.6	177.2	179.9	23.3	0	0	0	109.3	A141 D183 T184	A141-D181 HydrophobicContact CB-CB 4.49Å; A141-D181 WeakPolarHBondContact CB-OD2 3.5Å; D181-D183 VanDerWaalsContact C-N 3.33Å; D181-D183 PolarHBondContact O-N 3.06Å; D181-T184 PolarHBondContact N-O 2.73Å; D181-T184 VanDerWaalsContact N-O 3.09Å; D181-T184 WeakPolarHBondContact O-CA 3.31Å; D181-T184 WeakPolarHBondContact O-CB 3.26Å; D181-T184 PolarHBondContact O-N 3.14Å
182	N	90.4	Very high	91.3	Very high	143 Å²	143	43.2 Å²	43.2	77%	0.765	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	46	53.4	-179.7	-168	44.5	0	0	0	113.5	T184	N182-T184 PolarHBondContact O-N 3.49Å; N182-T184 VanDerWaalsContact O-N 3.1Å; N182-T184 PolarHBondContact O-OG1 2.96Å
183	D	93.3	Very high	91.4	Very high	47 Å²	47	42.9 Å²	42.9	25%	0.251	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.7	25.8	-175.2	-161.4	18.4	0	0	0	114.8	N65 Y66 H67 D181	N65-D183 VanDerWaalsContact CA-OD2 3.29Å; N65-D183 WeakPolarHBondContact CA-OD2 3.32Å; N65-D183 PolarHBondContact N-O 3.36Å; N65-D183 VanDerWaalsContact N-O 3.11Å; Y66-D183 PolarHBondContact N-O 3.48Å; Y66-D183 PolarHBondContact N-OD1 3.2Å; Y66-D183 VanDerWaalsContact N-OD1 3.1Å; H67-D183 IonicContact CE1-OD1 3.12Å; H67-D183 IonicContact CG-OD1 2.68Å; H67-D183 PolarHBondContact N-OD1 3.03Å; H67-D183 IonicContact ND1-OD1 2.66Å; H67-D183 PolarHBondContact ND1-OD1 3.08Å; D181-D183 VanDerWaalsContact C-N 3.33Å; D181-D183 PolarHBondContact O-N 3.06Å
184	T	94.6	Very high	91.7	Very high	29 Å²	29	43.1 Å²	43.1	18%	0.178	23%	0.231	C	C	.	.	B	Isolated β-bridge	trans	-118.9	118.6	179.7	-55.3	0	0	0	0	110.6	I62 I63 E64 D181 N182	I62-T184 HydrophobicContact CG2-CG2 3.4Å; I63-T184 WeakPolarHBondContact O-CA 3.26Å; E64-T184 HydrophobicContact CG-CG2 4.37Å; D181-T184 PolarHBondContact N-O 2.73Å; D181-T184 VanDerWaalsContact N-O 3.09Å; D181-T184 WeakPolarHBondContact O-CA 3.31Å; D181-T184 WeakPolarHBondContact O-CB 3.26Å; D181-T184 PolarHBondContact O-N 3.14Å; N182-T184 PolarHBondContact O-N 3.49Å; N182-T184 VanDerWaalsContact O-N 3.1Å; N182-T184 PolarHBondContact O-OG1 2.96Å
185	L	95.8	Very high	92	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	117.6	170.8	179.4	63.8	0	0	0	109.4	I63 Y66 L98 I138 M176 I180 V187	I63-L185 HydrophobicContact CB-CB 4.33Å; I63-L185 HydrophobicContact CD1-CD2 4.26Å; I63-L185 PolarHBondContact N-O 3.43Å; I63-L185 PolarHBondContact O-N 3.06Å; Y66-L185 HydrophobicContact CD2-CB 3.77Å; Y66-L185 HydrophobicContact CD2-CD2 3.85Å; Y66-L185 HydrophobicContact CD2-CG 4.47Å; Y66-L185 HydrophobicContact CE2-CB 4.31Å; Y66-L185 HydrophobicContact CE2-CD2 3.51Å; Y66-L185 HydrophobicContact CG-CB 4Å; L98-L185 HydrophobicContact CD2-CD2 3.85Å; I138-L185 HydrophobicContact CD1-CD1 4.39Å; I138-L185 HydrophobicContact CG2-CD1 3.71Å; M176-L185 HydrophobicContact CE-CD1 3.62Å; M176-L185 HydrophobicContact CE-CD2 4.16Å; I180-L185 HydrophobicContact CG1-CD1 4.48Å; L185-V187 HydrophobicContact CD2-CG2 4.39Å; L185-V187 HydrophobicContact CG-CG2 4.21Å
186	T	96.4	Very high	92	Very high	24 Å²	24	38.2 Å²	38.2	15%	0.147	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	112.3	177.3	-59.6	0	0	0	0	111.3	R60 I62 I138 A139	R60-T186 HydrophobicContact CG-CG2 3.84Å; I62-T186 HydrophobicContact CG1-CG2 4.19Å; I138-T186 WeakPolarHBondContact CA-O 3.25Å; A139-T186 HydrophobicContact CB-CG2 3.97Å; A139-T186 PolarHBondContact N-O 3.05Å
187	V	97.2	Very high	92.1	Very high	0 Å²	0	41 Å²	41	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	129.3	177.6	-177	0	0	0	0	109.8	R60 W61 L119 F136 I138 L185	R60-V187 WeakPolarHBondContact CA-O 3.4Å; W61-V187 HydrophobicContact CB-CB 4.44Å; W61-V187 HydrophobicContact CE3-CB 4.42Å; W61-V187 HydrophobicContact CE3-CG2 4.46Å; W61-V187 PolarHBondContact N-O 3.32Å; W61-V187 PolarHBondContact O-N 3.34Å; L119-V187 HydrophobicContact CD1-CG1 3.78Å; L119-V187 HydrophobicContact CD1-CG2 4.28Å; L119-V187 HydrophobicContact CD2-CG1 4.3Å; L119-V187 HydrophobicContact CD2-CG2 4.23Å; F136-V187 HydrophobicContact CD1-CG1 3.96Å; I138-V187 HydrophobicContact CD1-CB 4.45Å; I138-V187 HydrophobicContact CD1-CG1 4.47Å; I138-V187 HydrophobicContact CD1-CG2 3.9Å; L185-V187 HydrophobicContact CD2-CG2 4.39Å; L185-V187 HydrophobicContact CG-CG2 4.21Å
188	I	97.4	Very high	92	Very high	7 Å²	7	37.9 Å²	37.9	4%	0.036	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	122.3	171.3	-58.2	172.3	0	0	0	107.8	Q58 H59 R60 F136 D137 A139 L148 V190	Q58-I188 HydrophobicContact CG-CG2 3.82Å; H59-I188 CarbonylContact O-C 3.57Å; H59-I188 WeakPolarHBondContact O-CA 3.3Å; R60-I188 HydrophobicContact CG-CG1 4.34Å; F136-I188 CarbonylContact C-O 3.54Å; F136-I188 VanDerWaalsContact CA-O 3.29Å; F136-I188 WeakPolarHBondContact CA-O 3.39Å; D137-I188 HydrophobicContact CB-CB 4.21Å; D137-I188 PolarHBondContact N-O 3.14Å; D137-I188 PolarHBondContact O-N 2.8Å; A139-I188 HydrophobicContact CB-CD1 3.96Å; L148-I188 HydrophobicContact CD2-CD1 4.03Å; I188-V190 HydrophobicContact CG2-CG2 4.11Å
189	C	97.7	Very high	91.7	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	127.8	172.4	-175.9	0	0	0	0	109.4	Q58 H59 F85 I96 F136	Q58-C189 CarbonylContact C-O 3.48Å; Q58-C189 WeakPolarHBondContact CA-O 3.27Å; H59-C189 PolarHBondContact N-O 2.84Å; H59-C189 PolarHBondContact O-N 2.91Å; F85-C189 HydrophobicContact CZ-CB 4.45Å; I96-C189 HydrophobicContact CD1-CB 3.51Å; I96-C189 HydrophobicContact CG1-CB 4.26Å; F136-C189 HydrophobicContact CD1-CB 3.89Å; F136-C189 HydrophobicContact CE1-CB 3.8Å
190	V	96.9	Very high	91.2	Very high	3 Å²	3	41.4 Å²	41.4	2%	0.018	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	119.3	175.3	-176.5	0	0	0	0	109.2	Q56 V57 Q58 V134 R135 I188	Q56-V190 VanDerWaalsContact CD-CG1 3.48Å; Q56-V190 HydrophobicContact CG-CG1 3.57Å; V57-V190 CarbonylContact O-C 3.58Å; V57-V190 WeakPolarHBondContact O-CA 3.39Å; Q58-V190 HydrophobicContact CB-CG2 4.47Å; Q58-V190 HydrophobicContact CG-CG2 4.1Å; V134-V190 WeakPolarHBondContact CA-O 3.39Å; R135-V190 PolarHBondContact N-O 2.8Å; R135-V190 PolarHBondContact O-N 3.35Å; I188-V190 HydrophobicContact CG2-CG2 4.11Å
191	V	96.4	Very high	90.4	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	113.9	176.8	-172.5	0	0	0	0	108.4	Q56 V57 F85 F94 L121 C132 K133 V134 I193	Q56-V191 CarbonylContact C-O 3.55Å; Q56-V191 WeakPolarHBondContact CA-O 3.32Å; V57-V191 HydrophobicContact CB-CB 4.41Å; V57-V191 PolarHBondContact N-O 2.86Å; V57-V191 PolarHBondContact O-N 3.12Å; F85-V191 HydrophobicContact CE2-CG2 4.38Å; F94-V191 HydrophobicContact CE1-CG1 4.49Å; F94-V191 HydrophobicContact CE2-CG1 4.29Å; F94-V191 HydrophobicContact CZ-CG1 3.99Å; L121-V191 HydrophobicContact CD2-CG2 3.79Å; C132-V191 HydrophobicContact CB-CG1 3.89Å; K133-V191 WeakPolarHBondContact O-CA 3.45Å; V134-V191 HydrophobicContact CG2-CG1 4.28Å; V134-V191 HydrophobicContact CG2-CG2 4.37Å; V191-I193 HydrophobicContact CG1-CG1 3.91Å
192	T	95.7	Very high	89.1	Confident	20 Å²	20	41.7 Å²	41.7	12%	0.123	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	105	174	-54.9	0	0	0	0	108.4	C132 K133 Y194	C132-T192 CarbonylContact C-O 3.55Å; C132-T192 WeakPolarHBondContact CA-O 3.45Å; C132-T192 VanDerWaalsContact CB-O 3.27Å; C132-T192 WeakPolarHBondContact CB-O 3.39Å; K133-T192 PolarHBondContact N-O 3.05Å; K133-T192 PolarHBondContact O-N 3.5Å; T192-Y194 HydrophobicContact CG2-CE1 4.02Å
193	I	93.9	Very high	87.2	Confident	2 Å²	2	43 Å²	43	1%	0.01	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	120.9	-176	-56.9	175.4	0	0	0	108.4	S54 T55 V57 Y92 F94 L130 C132 V191	S54-I193 CarbonylContact C-O 3.53Å; S54-I193 WeakPolarHBondContact CA-O 3.28Å; S54-I193 VanDerWaalsContact CB-O 3.27Å; S54-I193 WeakPolarHBondContact CB-O 3.38Å; T55-I193 PolarHBondContact N-O 3.14Å; T55-I193 PolarHBondContact O-N 2.72Å; V57-I193 HydrophobicContact CG2-CD1 3.93Å; Y92-I193 HydrophobicContact CD2-CD1 3.67Å; Y92-I193 HydrophobicContact CD2-CG2 4.13Å; Y92-I193 HydrophobicContact CE2-CD1 4.41Å; Y92-I193 HydrophobicContact CE2-CG2 3.81Å; Y92-I193 HydrophobicContact CG-CD1 4.19Å; F94-I193 HydrophobicContact CE2-CD1 4.14Å; F94-I193 HydrophobicContact CZ-CD1 4.21Å; L130-I193 HydrophobicContact CD1-CG1 4.21Å; L130-I193 HydrophobicContact CD1-CG2 3.81Å; C132-I193 HydrophobicContact CB-CG1 4.38Å; V191-I193 HydrophobicContact CG1-CG1 3.91Å
194	Y	92.8	Very high	85.1	Confident	45 Å²	45	44.3 Å²	44.3	18%	0.176	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	122.7	178.1	-57.5	-57	0	0	0	110.1	I52 S131 K133 T192	I52-Y194 HydrophobicContact CD1-CD1 3.33Å; I52-Y194 HydrophobicContact CD1-CD2 4.47Å; I52-Y194 HydrophobicContact CD1-CE1 3.92Å; I52-Y194 HydrophobicContact CD1-CG 3.66Å; I52-Y194 HydrophobicContact CG1-CD1 3.86Å; I52-Y194 HydrophobicContact CG1-CG 4.39Å; S131-Y194 PolarHBondContact O-N 2.75Å; K133-Y194 HydrophobicContact CB-CE2 4.03Å; K133-Y194 WeakPolarHBondContact CB-OH 3.43Å; T192-Y194 HydrophobicContact CG2-CE1 4.02Å
195	E	87.8	Confident	82.5	Confident	54 Å²	54	47 Å²	47	25%	0.252	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	-55.2	-175	-62.1	-177.3	-178.4	0	0	111.6	K53 T55	K53-E195 HydrophobicContact CB-CB 4.46Å; K53-E195 WeakPolarHBondContact CD-OE2 3.2Å; K53-E195 WeakPolarHBondContact CE-OE2 3.13Å; K53-E195 HydrophobicContact CG-CB 4.47Å; K53-E195 IonicContact NZ-OE2 3.23Å; K53-E195 PolarHBondContact NZ-OE2 3.08Å; K53-E195 VanDerWaalsContact NZ-OE2 3.08Å; K53-E195 PolarHBondContact O-N 3Å; T55-E195 WeakPolarHBondContact CB-OE1 3.35Å; T55-E195 PolarHBondContact OG1-OE1 3.07Å
196	E	84.1	Confident	79.9	Confident	109 Å²	109	52.1 Å²	52.1	51%	0.509	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149	141	-171	-174.6	172.5	-162	0	0	110.3	I52 K53	I52-E196 CarbonylContact C-O 3.54Å; I52-E196 WeakPolarHBondContact CA-O 3.3Å; K53-E196 HydrophobicContact CB-CB 4.45Å; K53-E196 PolarHBondContact N-O 2.76Å
197	I	84.2	Confident	77.5	Confident	64 Å²	64	56 Å²	56	33%	0.328	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	124.5	164.7	-65.3	173.4	0	0	0	106.9	L32 T51 I52	L32-I197 HydrophobicContact CB-CD1 4.05Å; L32-I197 HydrophobicContact CB-CG1 4.26Å; L32-I197 HydrophobicContact CD1-CD1 3.66Å; L32-I197 HydrophobicContact CD1-CG1 3.63Å; L32-I197 HydrophobicContact CG-CD1 4.41Å; T51-I197 WeakPolarHBondContact O-CA 3.41Å; I52-I197 HydrophobicContact CB-CG1 4.26Å; I52-I197 HydrophobicContact CD1-CD1 4.31Å; I52-I197 HydrophobicContact CD1-CG1 3.97Å; I52-I197 HydrophobicContact CG1-CG1 3.92Å
198	S	81.8	Confident	75.2	Confident	54 Å²	54	62.4 Å²	62.4	38%	0.378	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	142.5	170.5	61.1	0	0	0	0	109.5	S50 T51	S50-S198 CarbonylContact C-O 3.57Å; S50-S198 VanDerWaalsContact CA-O 3.29Å; S50-S198 WeakPolarHBondContact CA-O 3.24Å; T51-S198 PolarHBondContact N-O 3.42Å; T51-S198 PolarHBondContact O-N 2.84Å
199	T	81.5	Confident	73.3	Confident	85 Å²	85	67.5 Å²	67.5	52%	0.521	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	120.8	172.3	-56.2	0	0	0	0	107.5	R49 S50	R49-T199 WeakPolarHBondContact O-CA 3.46Å; S50-T199 WeakPolarHBondContact OG-CG2 3.29Å; S50-T199 PolarHBondContact OG-OG1 3.16Å
200	V	77	Confident	71.3	Confident	78 Å²	78	76 Å²	76	47%	0.473	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	147	175.2	-62.7	0	0	0	0	109.2	S48 R49	S48-V200 CarbonylContact C-O 3.57Å; S48-V200 VanDerWaalsContact CA-O 3.3Å; S48-V200 WeakPolarHBondContact CA-O 3.27Å; R49-V200 HydrophobicContact CB-CG2 4.44Å; R49-V200 PolarHBondContact N-O 3.27Å; R49-V200 PolarHBondContact O-N 2.85Å
201	C	74.7	Confident	69.8	Low	63 Å²	63	82.2 Å²	82.2	43%	0.426	47%	0.466	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	135.9	160.3	-71.3	0	0	0	0	108.1	C44 E203	C44-C201 HydrophobicContact CB-CB 4.44Å; C44-C201 WeakPolarHBondContact CB-SG 3.41Å; C44-C201 VanDerWaalsContact SG-CA 3.52Å; C44-C201 WeakPolarHBondContact SG-CB 3.1Å; C44-C201 CovalentContact SG-SG 2.04Å; C44-C201 PolarHBondContact SG-SG 2.99Å; C201-E203 VanDerWaalsContact C-N 3.3Å; C201-E203 PolarHBondContact O-N 3.46Å
202	D	61	Low	68.9	Low	49 Å²	49	83.3 Å²	83.3	26%	0.262	48%	0.477	S	S	.	.			trans	-67.7	88.4	178	-84.4	-11	0	0	0	109.8	T47 R49 A204	T47-D202 PolarHBondContact O-N 3.42Å; R49-D202 IonicContact CZ-OD1 3.49Å; R49-D202 IonicContact CZ-OD2 3.44Å; R49-D202 IonicContact NH1-OD1 3.55Å; R49-D202 PolarHBondContact NH1-OD1 3.37Å; R49-D202 IonicContact NH1-OD2 3.5Å; R49-D202 PolarHBondContact NH1-OD2 2.85Å; R49-D202 IonicContact NH2-OD1 3.37Å; R49-D202 IonicContact NH2-OD2 2.64Å; R49-D202 PolarHBondContact NH2-OD2 3.05Å; D202-A204 PolarHBondContact O-N 2.85Å
203	E	50.2	Low	68.3	Low	171 Å²	171	87.1 Å²	87.1	80%	0.799	49%	0.493	S	S	*	.	S	Bend	trans	-82.2	101.4	154.4	-70.8	-173.7	-169.9	0	0	107	C201 S205	C201-E203 VanDerWaalsContact C-N 3.3Å; C201-E203 PolarHBondContact O-N 3.46Å; E203-S205 PolarHBondContact O-N 3.03Å
204	A	49.5	Very low	67.8	Low	74 Å²	74	89.6 Å²	89.6	61%	0.612	51%	0.514	S	S	*	.	S	Bend	trans	19.2	87.1	173.5	0	0	0	0	0	114.8	D202 K310	D202-A204 PolarHBondContact O-N 2.85Å; A204-K310 PolarHBondContact O-NZ 2.93Å
205	S	40.9	Very low	67.6	Low	85 Å²	85	93.6 Å²	93.6	59%	0.594	53%	0.533	S	S	*	.			trans	-28.8	148.3	-179.5	57.7	0	0	0	0	118.6	E203	E203-S205 PolarHBondContact O-N 3.03Å
206	S	41.4	Very low	67.7	Low	108 Å²	108	93.2 Å²	93.2	76%	0.755	53%	0.532	S	S	*	.			trans	-121.2	121.8	146.2	60.3	0	0	0	0	110.3
207	P	46.2	Very low	68	Low	104 Å²	104	89.9 Å²	89.9	68%	0.675	52%	0.52	S	S	*	.			trans	-91	156.2	178.4	30.1	-21.6	0	0	0	113.1
208	D	49	Very low	68.3	Low	136 Å²	136	89.5 Å²	89.5	73%	0.727	52%	0.524	S	S	*	.			trans	39.6	86.3	167.5	-67.1	-21.5	0	0	0	117.3	E210 N211 G212	D208-E210 VanDerWaalsContact C-N 3.32Å; D208-E210 PolarHBondContact O-N 2.91Å; D208-N211 PolarHBondContact O-N 2.88Å; D208-G212 PolarHBondContact O-N 2.81Å
209	N	55.9	Low	68.9	Low	114 Å²	114	89.8 Å²	89.8	61%	0.61	52%	0.518	S	S	*	.	H	α-helix	trans	-61.3	-30.7	-169	-142.1	36.6	0	0	0	114.6	E213	N209-E213 PolarHBondContact ND2-OE1 3.07Å; N209-E213 VanDerWaalsContact O-CB 3.3Å; N209-E213 WeakPolarHBondContact O-CB 3.33Å; N209-E213 VanDerWaalsContact O-CG 3.24Å; N209-E213 WeakPolarHBondContact O-CG 3.45Å; N209-E213 PolarHBondContact O-N 2.84Å
210	E	55.9	Low	69.4	Low	178 Å²	178	88.8 Å²	88.8	83%	0.832	51%	0.507	S	S	*	.	H	α-helix	trans	-71.8	-43.7	179.9	-70.6	-169.3	172.9	0	0	112.7	D208 A214	D208-E210 VanDerWaalsContact C-N 3.32Å; D208-E210 PolarHBondContact O-N 2.91Å; E210-A214 PolarHBondContact O-N 3.19Å
211	N	65.9	Low	70.2	Confident	134 Å²	134	91.7 Å²	91.7	72%	0.717	51%	0.514	S	S	*	.	H	α-helix	trans	-79.2	-33.9	179.1	-125.1	45.3	0	0	0	111.2	D208 F215	D208-N211 PolarHBondContact O-N 2.88Å; N211-F215 VanDerWaalsContact O-CB 3.27Å; N211-F215 WeakPolarHBondContact O-CB 3.3Å; N211-F215 PolarHBondContact O-N 2.89Å
212	G	78.4	Confident	71.1	Confident	23 Å²	23	92.2 Å²	92.2	24%	0.237	51%	0.509	C	S	.	.	H	α-helix	trans	-62.6	-45.6	175.1	0	0	0	0	0	112.5	D208 F215 I216	D208-G212 PolarHBondContact O-N 2.81Å; G212-F215 PolarHBondContact O-N 3.27Å; G212-I216 WeakPolarHBondContact O-CB 3.27Å; G212-I216 VanDerWaalsContact O-CG1 3.28Å; G212-I216 WeakPolarHBondContact O-CG1 3.12Å; G212-I216 PolarHBondContact O-N 3.33Å
213	E	82.3	Confident	72.7	Confident	99 Å²	99	91.4 Å²	91.4	46%	0.463	50%	0.504	S	S	.	.	H	α-helix	trans	-64.1	-43.6	177.3	-77.7	-177.1	-179.5	0	0	112.2	N209 F215 I216 S217	N209-E213 PolarHBondContact ND2-OE1 3.07Å; N209-E213 VanDerWaalsContact O-CB 3.3Å; N209-E213 WeakPolarHBondContact O-CB 3.33Å; N209-E213 VanDerWaalsContact O-CG 3.24Å; N209-E213 WeakPolarHBondContact O-CG 3.45Å; N209-E213 PolarHBondContact O-N 2.84Å; E213-F215 PolarHBondContact O-N 3.26Å; E213-I216 PolarHBondContact O-N 3.2Å; E213-S217 VanDerWaalsContact O-CB 3.26Å; E213-S217 WeakPolarHBondContact O-CB 3.41Å; E213-S217 PolarHBondContact O-N 2.83Å; E213-S217 PolarHBondContact O-OG 2.89Å
214	A	84.5	Confident	74.7	Confident	55 Å²	55	92 Å²	92	46%	0.455	50%	0.499	S	S	.	.	H	α-helix	trans	-61.3	-44.7	176	0	0	0	0	0	111.6	E210 S217 S218	E210-A214 PolarHBondContact O-N 3.19Å; A214-S217 PolarHBondContact O-N 2.76Å; A214-S217 PolarHBondContact O-OG 2.8Å; A214-S218 PolarHBondContact O-N 3.45Å; A214-S218 VanDerWaalsContact O-N 3.14Å
215	F	87.2	Confident	76.8	Confident	129 Å²	129	91.7 Å²	91.7	57%	0.566	50%	0.497	S	S	*	.	H	α-helix	trans	-61.4	-51.3	176.2	180	-99.8	0	0	0	112	N211 G212 E213 S217 S218 F219	N211-F215 VanDerWaalsContact O-CB 3.27Å; N211-F215 WeakPolarHBondContact O-CB 3.3Å; N211-F215 PolarHBondContact O-N 2.89Å; G212-F215 PolarHBondContact O-N 3.27Å; E213-F215 PolarHBondContact O-N 3.26Å; F215-S217 VanDerWaalsContact C-N 3.3Å; F215-S217 PolarHBondContact O-N 2.83Å; F215-S218 WeakPolarHBondContact O-CB 3.48Å; F215-S218 PolarHBondContact O-N 2.94Å; F215-S218 PolarHBondContact O-OG 2.81Å; F215-F219 HydrophobicContact CD1-CD2 4.3Å; F215-F219 HydrophobicContact CD1-CE2 4.19Å; F215-F219 HydrophobicContact CD2-CE2 4.33Å; F215-F219 HydrophobicContact CE1-CD2 4.03Å; F215-F219 AromaticContact CE1-CE2 3.57Å; F215-F219 HydrophobicContact CE1-CE2 3.57Å; F215-F219 AromaticContact CE2-CE2 3.74Å; F215-F219 HydrophobicContact CE2-CE2 3.74Å; F215-F219 HydrophobicContact CZ-CD2 4.22Å; F215-F219 AromaticContact CZ-CE2 3.34Å; F215-F219 HydrophobicContact CZ-CE2 3.34Å; F215-F219 HydrophobicContact CZ-CZ 4.1Å; F215-F219 PolarHBondContact O-N 3.07Å
216	I	91	Very high	79.3	Confident	46 Å²	46	93.8 Å²	93.8	24%	0.236	50%	0.496	C	S	.	.	H	α-helix	trans	-58.7	-42.9	177	-72.3	166.9	0	0	0	111.1	G212 E213 S218 F219 E220 T286	G212-I216 WeakPolarHBondContact O-CB 3.27Å; G212-I216 VanDerWaalsContact O-CG1 3.28Å; G212-I216 WeakPolarHBondContact O-CG1 3.12Å; G212-I216 PolarHBondContact O-N 3.33Å; E213-I216 PolarHBondContact O-N 3.2Å; I216-S218 PolarHBondContact O-N 3.11Å; I216-F219 PolarHBondContact O-N 3.03Å; I216-F219 VanDerWaalsContact O-N 3.08Å; I216-E220 PolarHBondContact O-N 2.64Å; I216-T286 HydrophobicContact CG2-CG2 3.91Å
217	S	89.9	Confident	81.6	Confident	38 Å²	38	90.9 Å²	90.9	27%	0.266	48%	0.478	S	S	.	.	H	α-helix	trans	-61.5	-28.4	178	82.1	0	0	0	0	112.5	E213 A214 F215 K221	E213-S217 VanDerWaalsContact O-CB 3.26Å; E213-S217 WeakPolarHBondContact O-CB 3.41Å; E213-S217 PolarHBondContact O-N 2.83Å; E213-S217 PolarHBondContact O-OG 2.89Å; A214-S217 PolarHBondContact O-N 2.76Å; A214-S217 PolarHBondContact O-OG 2.8Å; F215-S217 VanDerWaalsContact C-N 3.3Å; F215-S217 PolarHBondContact O-N 2.83Å; S217-K221 VanDerWaalsContact O-CG 3.26Å; S217-K221 WeakPolarHBondContact O-CG 3.4Å; S217-K221 PolarHBondContact O-N 3.32Å
218	S	91.2	Very high	83.7	Confident	56 Å²	56	90.1 Å²	90.1	39%	0.392	48%	0.48	S	S	.	.	H	α-helix	trans	-69.1	-37.8	176.2	80.2	0	0	0	0	111.8	A214 F215 I216 K221 F222	A214-S218 PolarHBondContact O-N 3.45Å; A214-S218 VanDerWaalsContact O-N 3.14Å; F215-S218 WeakPolarHBondContact O-CB 3.48Å; F215-S218 PolarHBondContact O-N 2.94Å; F215-S218 PolarHBondContact O-OG 2.81Å; I216-S218 PolarHBondContact O-N 3.11Å; S218-K221 PolarHBondContact O-N 3.12Å; S218-F222 VanDerWaalsContact O-CB 3.31Å; S218-F222 WeakPolarHBondContact O-CB 3.3Å; S218-F222 PolarHBondContact O-N 3.03Å
219	F	93.1	Very high	85.9	Confident	60 Å²	60	84.6 Å²	84.6	26%	0.263	45%	0.451	S	S	.	.	H	α-helix	trans	-69.4	-40	174.4	-82.4	-82.5	0	0	0	112.3	F215 I216 K221 F222 L223 I246 Y285	F215-F219 HydrophobicContact CD1-CD2 4.3Å; F215-F219 HydrophobicContact CD1-CE2 4.19Å; F215-F219 HydrophobicContact CD2-CE2 4.33Å; F215-F219 HydrophobicContact CE1-CD2 4.03Å; F215-F219 AromaticContact CE1-CE2 3.57Å; F215-F219 HydrophobicContact CE1-CE2 3.57Å; F215-F219 AromaticContact CE2-CE2 3.74Å; F215-F219 HydrophobicContact CE2-CE2 3.74Å; F215-F219 HydrophobicContact CZ-CD2 4.22Å; F215-F219 AromaticContact CZ-CE2 3.34Å; F215-F219 HydrophobicContact CZ-CE2 3.34Å; F215-F219 HydrophobicContact CZ-CZ 4.1Å; F215-F219 PolarHBondContact O-N 3.07Å; I216-F219 PolarHBondContact O-N 3.03Å; I216-F219 VanDerWaalsContact O-N 3.08Å; F219-K221 VanDerWaalsContact C-N 3.35Å; F219-K221 PolarHBondContact O-N 2.96Å; F219-F222 WeakPolarHBondContact O-CB 3.38Å; F219-F222 PolarHBondContact O-N 2.77Å; F219-L223 PolarHBondContact O-N 2.52Å; F219-I246 HydrophobicContact CD1-CD1 3.7Å; F219-I246 HydrophobicContact CE1-CD1 3.67Å; F219-I246 HydrophobicContact CE1-CG1 4.26Å; F219-Y285 HydrophobicContact CB-CD1 4.07Å; F219-Y285 HydrophobicContact CD1-CD1 4.28Å; F219-Y285 WeakPolarHBondContact O-CD1 3.28Å
220	E	92.9	Very high	87.8	Confident	64 Å²	64	81.8 Å²	81.8	30%	0.299	44%	0.437	S	S	.	.	H	α-helix	trans	-60.8	-44.7	174.6	-168.5	-176.2	178.3	0	0	111.6	I216 F222 L223 R224 T286	I216-E220 PolarHBondContact O-N 2.64Å; E220-F222 VanDerWaalsContact C-N 3.32Å; E220-F222 PolarHBondContact O-N 2.68Å; E220-L223 PolarHBondContact O-N 2.95Å; E220-R224 WeakPolarHBondContact O-CG 3.33Å; E220-R224 PolarHBondContact O-N 2.89Å; E220-R224 IonicContact OE1-CZ 3.53Å; E220-R224 IonicContact OE1-NE 3.61Å; E220-R224 IonicContact OE1-NH1 3.28Å; E220-R224 IonicContact OE1-NH2 2.66Å; E220-R224 PolarHBondContact OE1-NH2 2.9Å; E220-T286 HydrophobicContact CB-CG2 3.82Å; E220-T286 HydrophobicContact CG-CG2 4.16Å
221	K	92.7	Very high	89.6	Confident	140 Å²	140	73.3 Å²	73.3	61%	0.609	40%	0.397	S	S	*	.	H	α-helix	trans	-62.4	-40.3	173.8	-72.2	168.9	-173.8	169.6	0	111.7	S217 S218 F219 R224 A225	S217-K221 VanDerWaalsContact O-CG 3.26Å; S217-K221 WeakPolarHBondContact O-CG 3.4Å; S217-K221 PolarHBondContact O-N 3.32Å; S218-K221 PolarHBondContact O-N 3.12Å; F219-K221 VanDerWaalsContact C-N 3.35Å; F219-K221 PolarHBondContact O-N 2.96Å; K221-R224 PolarHBondContact O-N 3.32Å; K221-A225 WeakPolarHBondContact O-CB 3.21Å; K221-A225 PolarHBondContact O-N 2.81Å
222	F	93.2	Very high	91	Very high	74 Å²	74	68.2 Å²	68.2	33%	0.325	37%	0.37	S	S	.	.	H	α-helix	trans	-63	-45.1	179.1	-173.9	-132.1	0	0	0	112	S218 F219 E220 A225 K226 A227 A228 H243 I246	S218-F222 VanDerWaalsContact O-CB 3.31Å; S218-F222 WeakPolarHBondContact O-CB 3.3Å; S218-F222 PolarHBondContact O-N 3.03Å; F219-F222 WeakPolarHBondContact O-CB 3.38Å; F219-F222 PolarHBondContact O-N 2.77Å; E220-F222 VanDerWaalsContact C-N 3.32Å; E220-F222 PolarHBondContact O-N 2.68Å; F222-A225 PolarHBondContact O-N 2.84Å; F222-K226 PolarHBondContact O-N 3.11Å; F222-A227 HydrophobicContact CD2-CB 4.41Å; F222-A227 HydrophobicContact CE2-CB 4.17Å; F222-A227 WeakPolarHBondContact CE2-O 3.36Å; F222-A227 WeakPolarHBondContact CZ-O 3.25Å; F222-A228 HydrophobicContact CZ-CB 4.46Å; F222-H243 AromaticContact CD1-CE1 3.45Å; F222-H243 VanDerWaalsContact CD1-CE1 3.45Å; F222-H243 WeakPolarHBondContact CD1-CE1 3.37Å; F222-H243 AromaticContact CD1-ND1 3.83Å; F222-H243 AromaticContact CD1-NE2 3.87Å; F222-H243 AromaticContact CE1-CD2 3.53Å; F222-H243 AromaticContact CE1-CE1 3.28Å; F222-H243 WeakPolarHBondContact CE1-CE1 3.41Å; F222-H243 AromaticContact CE1-CG 3.76Å; F222-H243 AromaticContact CE1-ND1 3.61Å; F222-H243 AromaticContact CE1-NE2 3.24Å; F222-H243 WeakPolarHBondContact CE1-NE2 3.36Å; F222-H243 AromaticContact CE2-NE2 3.8Å; F222-H243 AromaticContact CG-CE1 3.99Å; F222-H243 AromaticContact CZ-CD2 3.64Å; F222-H243 AromaticContact CZ-CE1 3.68Å; F222-H243 AromaticContact CZ-NE2 3.19Å; F222-H243 WeakPolarHBondContact CZ-NE2 3.39Å; F222-I246 HydrophobicContact CD1-CD1 4.17Å; F222-I246 HydrophobicContact CE1-CD1 4.18Å
223	L	94.6	Very high	91.9	Very high	31 Å²	31	67.1 Å²	67.1	16%	0.162	36%	0.359	C	S	.	.	H	α-helix	trans	-59.5	-48.7	172.4	178	63.1	0	0	0	111.8	F219 E220 A225 K226 A242 V281 Y285	F219-L223 PolarHBondContact O-N 2.52Å; E220-L223 PolarHBondContact O-N 2.95Å; L223-A225 VanDerWaalsContact C-N 3.33Å; L223-A225 PolarHBondContact O-N 3.07Å; L223-K226 PolarHBondContact O-N 3.45Å; L223-K226 VanDerWaalsContact O-N 3.1Å; L223-A242 HydrophobicContact CD1-CB 4.48Å; L223-V281 HydrophobicContact CD1-CG1 3.89Å; L223-V281 HydrophobicContact CD2-CG1 3.77Å; L223-V281 HydrophobicContact CG-CG1 4.49Å; L223-Y285 HydrophobicContact CB-CD1 3.73Å; L223-Y285 HydrophobicContact CB-CE1 3.78Å; L223-Y285 HydrophobicContact CB-CG 4.22Å; L223-Y285 HydrophobicContact CD1-CE1 4.24Å; L223-Y285 HydrophobicContact CD1-CE2 4.08Å; L223-Y285 HydrophobicContact CD2-CD1 4.41Å; L223-Y285 HydrophobicContact CD2-CD2 4.05Å; L223-Y285 HydrophobicContact CD2-CE2 4.39Å; L223-Y285 HydrophobicContact CD2-CG 4.05Å; L223-Y285 HydrophobicContact CG-CD1 4.5Å; L223-Y285 HydrophobicContact CG-CE1 4.45Å
224	R	94.1	Very high	92.6	Very high	183 Å²	183	65.1 Å²	65.1	69%	0.691	35%	0.35	S	S	*	.	H	α-helix	trans	-63.4	-36.8	-179	-75.2	-179.2	179.2	169.1	6.3	113.2	E220 K221 K226	E220-R224 WeakPolarHBondContact O-CG 3.33Å; E220-R224 PolarHBondContact O-N 2.89Å; E220-R224 IonicContact OE1-CZ 3.53Å; E220-R224 IonicContact OE1-NE 3.61Å; E220-R224 IonicContact OE1-NH1 3.28Å; E220-R224 IonicContact OE1-NH2 2.66Å; E220-R224 PolarHBondContact OE1-NH2 2.9Å; K221-R224 PolarHBondContact O-N 3.32Å; R224-K226 PolarHBondContact O-N 2.97Å
225	A	93.2	Very high	93.2	Very high	69 Å²	69	62.9 Å²	62.9	57%	0.57	33%	0.331	S	S	*	.	H	α-helix	trans	-69.1	-16	177.3	0	0	0	0	0	112.9	K221 F222 L223 A227	K221-A225 WeakPolarHBondContact O-CB 3.21Å; K221-A225 PolarHBondContact O-N 2.81Å; F222-A225 PolarHBondContact O-N 2.84Å; L223-A225 VanDerWaalsContact C-N 3.33Å; L223-A225 PolarHBondContact O-N 3.07Å; A225-A227 HydrophobicContact CB-CB 4.24Å; A225-A227 PolarHBondContact O-N 3.17Å
226	K	93	Very high	93.6	Very high	129 Å²	129	60 Å²	60	56%	0.561	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.2	18.6	-173.8	-58.1	-176.4	173.5	-170.1	0	113.9	F222 L223 R224 T229 T241	F222-K226 PolarHBondContact O-N 3.11Å; L223-K226 PolarHBondContact O-N 3.45Å; L223-K226 VanDerWaalsContact O-N 3.1Å; R224-K226 PolarHBondContact O-N 2.97Å; K226-T229 HydrophobicContact CB-CG2 4.31Å; K226-T229 WeakPolarHBondContact O-CG2 3.1Å; K226-T229 PolarHBondContact O-OG1 3Å; K226-T241 WeakPolarHBondContact CD-OG1 3.38Å
227	A	89.6	Confident	93.9	Very high	46 Å²	46	63.1 Å²	63.1	38%	0.38	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.7	128.7	-175.3	0	0	0	0	0	110	F222 A225 T229 H243	F222-A227 HydrophobicContact CD2-CB 4.41Å; F222-A227 HydrophobicContact CE2-CB 4.17Å; F222-A227 WeakPolarHBondContact CE2-O 3.36Å; F222-A227 WeakPolarHBondContact CZ-O 3.25Å; A225-A227 HydrophobicContact CB-CB 4.24Å; A225-A227 PolarHBondContact O-N 3.17Å; A227-T229 PolarHBondContact O-N 3.08Å; A227-H243 PolarHBondContact O-NE2 2.59Å
228	A	91.4	Very high	94.2	Very high	88 Å²	88	63 Å²	63	73%	0.727	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	58	24	-179.7	0	0	0	0	0	115.3	F222 D230 H243	F222-A228 HydrophobicContact CZ-CB 4.46Å; A228-D230 PolarHBondContact O-N 2.95Å; A228-H243 PolarHBondContact O-CD2 3.42Å; A228-H243 VanDerWaalsContact O-CD2 3.31Å
229	T	95	Very high	94.5	Very high	20 Å²	20	64.2 Å²	64.2	12%	0.123	35%	0.348	C	S	.	.			trans	-65.3	129	170.8	56.4	0	0	0	0	110.5	K226 A227 A242 R264	K226-T229 HydrophobicContact CB-CG2 4.31Å; K226-T229 WeakPolarHBondContact O-CG2 3.1Å; K226-T229 PolarHBondContact O-OG1 3Å; A227-T229 PolarHBondContact O-N 3.08Å; T229-A242 WeakPolarHBondContact CA-O 3.12Å; T229-A242 VanDerWaalsContact CB-O 3.27Å; T229-A242 WeakPolarHBondContact CB-O 3.19Å; T229-R264 PolarHBondContact O-NH1 2.94Å; T229-R264 PolarHBondContact O-NH2 2.85Å; T229-R264 PolarHBondContact OG1-NH2 2.86Å
230	D	94.8	Very high	94.6	Very high	56 Å²	56	62.4 Å²	62.4	30%	0.299	34%	0.341	S	S	.	.			trans	-119.3	3.1	-175.5	65.6	-15.7	0	0	0	112.8	A228 A242 H243 K244 Y265	A228-D230 PolarHBondContact O-N 2.95Å; D230-A242 PolarHBondContact N-O 2.83Å; D230-A242 VanDerWaalsContact N-O 3.14Å; D230-H243 WeakPolarHBondContact OD1-CA 3.34Å; D230-K244 PolarHBondContact OD1-N 3.2Å; D230-Y265 WeakPolarHBondContact O-CD2 3.08Å; D230-Y265 PolarHBondContact O-N 3.2Å
231	M	94.8	Very high	94.8	Very high	0 Å²	0	60.8 Å²	60.8	0%	0	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	142.3	-177.1	178.2	176.1	-82.5	0	0	112.2	T241 A242 K244 L247 V258 R264 Y265	M231-T241 CarbonylContact O-C 3.55Å; M231-T241 WeakPolarHBondContact O-CA 3.43Å; M231-A242 PolarHBondContact N-O 3.15Å; M231-A242 PolarHBondContact O-N 3.31Å; M231-K244 HydrophobicContact CB-CB 4.31Å; M231-K244 HydrophobicContact CE-CB 3.58Å; M231-K244 HydrophobicContact CE-CD 4.14Å; M231-K244 HydrophobicContact CE-CG 3.58Å; M231-K244 HydrophobicContact SD-CB 4.43Å; M231-L247 HydrophobicContact SD-CB 4.48Å; M231-L247 HydrophobicContact SD-CD2 3.64Å; M231-V258 HydrophobicContact CE-CB 4.14Å; M231-V258 HydrophobicContact CE-CG1 3.53Å; M231-V258 HydrophobicContact CE-CG2 3.39Å; M231-R264 PolarHBondContact O-NH2 3.47Å; M231-Y265 CarbonylContact C-O 3.46Å; M231-Y265 VanDerWaalsContact CA-O 3.24Å; M231-Y265 WeakPolarHBondContact CA-O 3.43Å
232	D	95.3	Very high	95	Very high	27 Å²	27	54.1 Å²	54.1	14%	0.144	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	127.2	171.5	-63.8	-18.4	0	0	0	110.2	M234 V239 R264 Y265 I266 L267	D232-M234 HydrophobicContact CB-CE 4.14Å; D232-V239 HydrophobicContact CB-CG1 3.85Å; D232-R264 IonicContact OD1-CZ 3.8Å; D232-R264 VanDerWaalsContact OD1-CZ 3.26Å; D232-R264 IonicContact OD1-NE 2.76Å; D232-R264 PolarHBondContact OD1-NE 3.26Å; D232-R264 IonicContact OD1-NH2 3.21Å; D232-R264 PolarHBondContact OD1-NH2 2.91Å; D232-R264 WeakPolarHBondContact OD2-CD 3.49Å; D232-R264 IonicContact OD2-NE 2.71Å; D232-R264 PolarHBondContact OD2-NE 3.36Å; D232-Y265 PolarHBondContact N-O 2.95Å; D232-I266 WeakPolarHBondContact O-CA 3.46Å; D232-L267 PolarHBondContact O-N 3.45Å
233	I	96.4	Very high	95	Very high	0 Å²	0	51 Å²	51	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	115.3	176.1	-57.3	163.5	0	0	0	107.3	A235 V239 I240 A242 L247 L267 A269 M277 V281	I233-A235 PolarHBondContact O-N 2.75Å; I233-V239 CarbonylContact O-C 3.01Å; I233-V239 WeakPolarHBondContact O-CA 3.18Å; I233-I240 HydrophobicContact CB-CB 4.2Å; I233-I240 PolarHBondContact N-O 3.5Å; I233-I240 PolarHBondContact O-N 2.95Å; I233-A242 HydrophobicContact CD1-CB 4.11Å; I233-L247 HydrophobicContact CD1-CD2 3.66Å; I233-L247 HydrophobicContact CG1-CD2 4.23Å; I233-L267 WeakPolarHBondContact CA-O 3.36Å; I233-L267 HydrophobicContact CG1-CB 4.23Å; I233-L267 HydrophobicContact CG1-CD2 4.09Å; I233-L267 HydrophobicContact CG2-CD2 4.01Å; I233-A269 HydrophobicContact CG2-CB 4Å; I233-M277 HydrophobicContact CG2-CE 3.81Å; I233-V281 HydrophobicContact CD1-CG2 3.38Å
234	M	96	Very high	95	Very high	57 Å²	57	51.8 Å²	51.8	28%	0.281	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	94.3	179.9	-53.9	-61.5	-176.7	0	0	108.4	D232 V239 I266 L267 A269 T270	D232-M234 HydrophobicContact CB-CE 4.14Å; M234-V239 HydrophobicContact CE-CG1 4.48Å; M234-V239 HydrophobicContact SD-CB 4.29Å; M234-V239 HydrophobicContact SD-CG1 3.84Å; M234-V239 HydrophobicContact SD-CG2 3.53Å; M234-V239 VanDerWaalsContact SD-CG2 3.53Å; M234-I266 HydrophobicContact CE-CD1 4.4Å; M234-I266 HydrophobicContact CE-CG2 4.06Å; M234-I266 HydrophobicContact CG-CG2 3.87Å; M234-L267 PolarHBondContact N-O 2.99Å; M234-A269 CarbonylContact O-C 3.48Å; M234-A269 VanDerWaalsContact O-CA 3.28Å; M234-A269 WeakPolarHBondContact O-CA 3.24Å; M234-A269 PolarHBondContact O-N 2.79Å; M234-T270 HydrophobicContact CB-CG2 4.23Å; M234-T270 PolarHBondContact O-N 2.8Å; M234-T270 VanDerWaalsContact O-N 3.08Å
235	A	97.1	Very high	95	Very high	7 Å²	7	47 Å²	47	6%	0.058	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	172	169.4	0	0	0	0	0	110.1	I233 D237 C238 C274 M277	I233-A235 PolarHBondContact O-N 2.75Å; A235-D237 VanDerWaalsContact C-N 3.25Å; A235-D237 PolarHBondContact O-N 2.86Å; A235-C238 WeakPolarHBondContact CA-O 3.4Å; A235-C238 WeakPolarHBondContact CB-O 3.5Å; A235-C238 PolarHBondContact N-O 2.77Å; A235-C274 HydrophobicContact CB-CB 4.35Å; A235-M277 HydrophobicContact CB-CB 4.28Å; A235-M277 HydrophobicContact CB-CG 4.17Å
236	S	96.7	Very high	95.1	Very high	70 Å²	70	44.8 Å²	44.8	49%	0.49	27%	0.268	S	S	.	.	S	Bend	trans	-59.6	-34.7	-176.5	68.3	0	0	0	0	113.8	T270 F272 S273	S236-T270 WeakPolarHBondContact CB-O 3.3Å; S236-F272 WeakPolarHBondContact CB-O 2.95Å; S236-F272 PolarHBondContact N-O 2.88Å; S236-F272 PolarHBondContact OG-O 3.23Å; S236-S273 WeakPolarHBondContact OG-CA 3.37Å
237	D	96.1	Very high	95.1	Very high	111 Å²	111	38.7 Å²	38.7	59%	0.594	24%	0.242	S	C	*	.	S	Bend	trans	-127.6	4.1	-172.8	63.2	-33.8	0	0	0	114.1	A235 C274	A235-D237 VanDerWaalsContact C-N 3.25Å; A235-D237 PolarHBondContact O-N 2.86Å; D237-C274 WeakPolarHBondContact OD1-CA 3.47Å; D237-C274 WeakPolarHBondContact OD1-CB 3.48Å; D237-C274 PolarHBondContact OD1-N 3.38Å
238	C	97.3	Very high	95.2	Very high	36 Å²	36	38 Å²	38	24%	0.243	23%	0.231	C	C	.	.			trans	-158.8	171.1	176.5	88.5	0	0	0	0	113.6	A235 C274	A235-C238 WeakPolarHBondContact CA-O 3.4Å; A235-C238 WeakPolarHBondContact CB-O 3.5Å; A235-C238 PolarHBondContact N-O 2.77Å; C238-C274 HydrophobicContact CB-CB 3.64Å; C238-C274 WeakPolarHBondContact CB-SG 3.42Å; C238-C274 WeakPolarHBondContact SG-CB 3.43Å; C238-C274 CovalentContact SG-SG 2.02Å; C238-C274 PolarHBondContact SG-SG 2.78Å
239	V	96.5	Very high	95.3	Very high	81 Å²	81	37.5 Å²	37.5	49%	0.491	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	127.8	170.1	-175.3	0	0	0	0	110	D232 I233 M234	D232-V239 HydrophobicContact CB-CG1 3.85Å; I233-V239 CarbonylContact O-C 3.01Å; I233-V239 WeakPolarHBondContact O-CA 3.18Å; M234-V239 HydrophobicContact CE-CG1 4.48Å; M234-V239 HydrophobicContact SD-CB 4.29Å; M234-V239 HydrophobicContact SD-CG1 3.84Å; M234-V239 HydrophobicContact SD-CG2 3.53Å; M234-V239 VanDerWaalsContact SD-CG2 3.53Å
240	I	96.9	Very high	95.2	Very high	21 Å²	21	41.1 Å²	41.1	11%	0.108	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	118.3	177.9	-53.1	169.3	0	0	0	109.2	I233 M277 Q278 V281	I233-I240 HydrophobicContact CB-CB 4.2Å; I233-I240 PolarHBondContact N-O 3.5Å; I233-I240 PolarHBondContact O-N 2.95Å; I240-M277 HydrophobicContact CD1-CB 3.61Å; I240-Q278 HydrophobicContact CD1-CB 4.49Å; I240-Q278 HydrophobicContact CD1-CG 3.75Å; I240-Q278 HydrophobicContact CG1-CG 4.36Å; I240-V281 HydrophobicContact CG2-CG1 4.49Å; I240-V281 HydrophobicContact CG2-CG2 4.32Å
241	T	96	Very high	95	Very high	31 Å²	31	38.6 Å²	38.6	19%	0.19	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	129.4	175.7	56	0	0	0	0	110.7	K226 M231	K226-T241 WeakPolarHBondContact CD-OG1 3.38Å; M231-T241 CarbonylContact O-C 3.55Å; M231-T241 WeakPolarHBondContact O-CA 3.43Å
242	A	96.1	Very high	94.6	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	-176.1	-177.4	0	0	0	0	0	112.5	L223 T229 D230 M231 I233 L247	L223-A242 HydrophobicContact CD1-CB 4.48Å; T229-A242 WeakPolarHBondContact CA-O 3.12Å; T229-A242 VanDerWaalsContact CB-O 3.27Å; T229-A242 WeakPolarHBondContact CB-O 3.19Å; D230-A242 PolarHBondContact N-O 2.83Å; D230-A242 VanDerWaalsContact N-O 3.14Å; M231-A242 PolarHBondContact N-O 3.15Å; M231-A242 PolarHBondContact O-N 3.31Å; I233-A242 HydrophobicContact CD1-CB 4.11Å; A242-L247 HydrophobicContact CB-CD1 3.73Å
243	H	95	Very high	94.3	Very high	7 Å²	7	43.3 Å²	43.3	3%	0.032	26%	0.257	C	S	.	.			trans	-104.5	119.1	175.8	-48.5	90.8	0	0	0	110.7	F222 A227 A228 D230 S245 I246 L247 Y285	F222-H243 AromaticContact CD1-CE1 3.45Å; F222-H243 VanDerWaalsContact CD1-CE1 3.45Å; F222-H243 WeakPolarHBondContact CD1-CE1 3.37Å; F222-H243 AromaticContact CD1-ND1 3.83Å; F222-H243 AromaticContact CD1-NE2 3.87Å; F222-H243 AromaticContact CE1-CD2 3.53Å; F222-H243 AromaticContact CE1-CE1 3.28Å; F222-H243 WeakPolarHBondContact CE1-CE1 3.41Å; F222-H243 AromaticContact CE1-CG 3.76Å; F222-H243 AromaticContact CE1-ND1 3.61Å; F222-H243 AromaticContact CE1-NE2 3.24Å; F222-H243 WeakPolarHBondContact CE1-NE2 3.36Å; F222-H243 AromaticContact CE2-NE2 3.8Å; F222-H243 AromaticContact CG-CE1 3.99Å; F222-H243 AromaticContact CZ-CD2 3.64Å; F222-H243 AromaticContact CZ-CE1 3.68Å; F222-H243 AromaticContact CZ-NE2 3.19Å; F222-H243 WeakPolarHBondContact CZ-NE2 3.39Å; A227-H243 PolarHBondContact O-NE2 2.59Å; A228-H243 PolarHBondContact O-CD2 3.42Å; A228-H243 VanDerWaalsContact O-CD2 3.31Å; D230-H243 WeakPolarHBondContact OD1-CA 3.34Å; H243-S245 VanDerWaalsContact C-N 3.31Å; H243-S245 PolarHBondContact O-N 2.94Å; H243-I246 HydrophobicContact CB-CB 4.33Å; H243-I246 HydrophobicContact CB-CD1 3.87Å; H243-I246 HydrophobicContact CB-CG1 4.04Å; H243-I246 PolarHBondContact O-N 3.32Å; H243-L247 VanDerWaalsContact O-CD1 3.3Å; H243-L247 WeakPolarHBondContact O-CD1 3.12Å; H243-L247 PolarHBondContact O-N 3.45Å; H243-Y285 WeakPolarHBondContact CB-OH 3.31Å; H243-Y285 PolarHBondContact N-OH 3.22Å; H243-Y285 AromaticContact ND1-CE1 3.59Å; H243-Y285 AromaticContact ND1-CZ 3.56Å; H243-Y285 PolarHBondContact ND1-OH 3.43Å
244	K	94.2	Very high	93.9	Very high	48 Å²	48	43.3 Å²	43.3	21%	0.209	26%	0.257	C	S	.	.	H	α-helix	trans	-52.4	-49.7	178.4	174.8	172.9	172.1	-174.3	0	111.6	D230 M231 I246 L247 L248 V258 Y265	D230-K244 PolarHBondContact OD1-N 3.2Å; M231-K244 HydrophobicContact CB-CB 4.31Å; M231-K244 HydrophobicContact CE-CB 3.58Å; M231-K244 HydrophobicContact CE-CD 4.14Å; M231-K244 HydrophobicContact CE-CG 3.58Å; M231-K244 HydrophobicContact SD-CB 4.43Å; K244-I246 VanDerWaalsContact C-N 3.26Å; K244-I246 PolarHBondContact O-N 3.24Å; K244-L247 PolarHBondContact O-N 3.38Å; K244-L248 HydrophobicContact CD-CD1 4.08Å; K244-L248 HydrophobicContact CG-CD1 3.56Å; K244-L248 HydrophobicContact CG-CG 3.96Å; K244-L248 VanDerWaalsContact O-CG 3.3Å; K244-L248 WeakPolarHBondContact O-CG 3.46Å; K244-L248 PolarHBondContact O-N 3.44Å; K244-V258 HydrophobicContact CD-CG1 4.44Å; K244-Y265 HydrophobicContact CB-CD2 3.99Å; K244-Y265 HydrophobicContact CD-CD1 3.77Å; K244-Y265 HydrophobicContact CD-CD2 3.26Å; K244-Y265 HydrophobicContact CD-CE1 3.94Å; K244-Y265 HydrophobicContact CD-CE2 3.39Å; K244-Y265 HydrophobicContact CD-CG 3.44Å; K244-Y265 VanDerWaalsContact CD-CG 3.44Å; K244-Y265 HydrophobicContact CG-CD2 4.24Å; K244-Y265 HydrophobicContact CG-CG 4.49Å; K244-Y265 PolarHBondContact NZ-OH 2.94Å
245	S	93.9	Very high	93.3	Very high	84 Å²	84	44.4 Å²	44.4	59%	0.587	27%	0.267	S	S	*	.	H	α-helix	trans	-56.7	-40.5	-174.9	54.3	0	0	0	0	112.5	H243 A249	H243-S245 VanDerWaalsContact C-N 3.31Å; H243-S245 PolarHBondContact O-N 2.94Å; S245-A249 VanDerWaalsContact O-CB 3.28Å; S245-A249 WeakPolarHBondContact O-CB 3.41Å; S245-A249 PolarHBondContact O-N 2.79Å; S245-A249 VanDerWaalsContact O-N 3.11Å
246	I	94.7	Very high	92.7	Very high	21 Å²	21	49.1 Å²	49.1	11%	0.108	30%	0.299	C	S	.	.	H	α-helix	trans	-71.8	-44.8	179.9	-58.8	175.3	0	0	0	110.4	F219 F222 H243 K244 L248 A249 R250 I284 Y285	F219-I246 HydrophobicContact CD1-CD1 3.7Å; F219-I246 HydrophobicContact CE1-CD1 3.67Å; F219-I246 HydrophobicContact CE1-CG1 4.26Å; F222-I246 HydrophobicContact CD1-CD1 4.17Å; F222-I246 HydrophobicContact CE1-CD1 4.18Å; H243-I246 HydrophobicContact CB-CB 4.33Å; H243-I246 HydrophobicContact CB-CD1 3.87Å; H243-I246 HydrophobicContact CB-CG1 4.04Å; H243-I246 PolarHBondContact O-N 3.32Å; K244-I246 VanDerWaalsContact C-N 3.26Å; K244-I246 PolarHBondContact O-N 3.24Å; I246-L248 PolarHBondContact O-N 2.7Å; I246-A249 PolarHBondContact O-N 2.95Å; I246-R250 WeakPolarHBondContact O-CB 3.42Å; I246-R250 WeakPolarHBondContact O-CG 3.37Å; I246-R250 PolarHBondContact O-N 2.79Å; I246-I284 HydrophobicContact CG2-CG2 3.9Å; I246-Y285 HydrophobicContact CB-CE1 4.43Å; I246-Y285 HydrophobicContact CB-CE2 4.4Å; I246-Y285 HydrophobicContact CD1-CD1 4.16Å; I246-Y285 HydrophobicContact CD1-CE1 3.39Å; I246-Y285 HydrophobicContact CG1-CE1 4.49Å; I246-Y285 HydrophobicContact CG2-CD1 4.31Å; I246-Y285 HydrophobicContact CG2-CD2 4.14Å; I246-Y285 HydrophobicContact CG2-CE1 4.1Å; I246-Y285 HydrophobicContact CG2-CE2 3.91Å; I246-Y285 HydrophobicContact CG2-CG 4.34Å
247	L	93.8	Very high	92.2	Very high	2 Å²	2	48.3 Å²	48.3	1%	0.01	29%	0.29	C	S	.	.	H	α-helix	trans	-58.4	-50.6	177.4	-92.5	74.6	0	0	0	111.3	M231 I233 A242 H243 K244 A249 R250 S251 M254 I284 Y285	M231-L247 HydrophobicContact SD-CB 4.48Å; M231-L247 HydrophobicContact SD-CD2 3.64Å; I233-L247 HydrophobicContact CD1-CD2 3.66Å; I233-L247 HydrophobicContact CG1-CD2 4.23Å; A242-L247 HydrophobicContact CB-CD1 3.73Å; H243-L247 VanDerWaalsContact O-CD1 3.3Å; H243-L247 WeakPolarHBondContact O-CD1 3.12Å; H243-L247 PolarHBondContact O-N 3.45Å; K244-L247 PolarHBondContact O-N 3.38Å; L247-A249 VanDerWaalsContact C-N 3.35Å; L247-A249 PolarHBondContact O-N 2.84Å; L247-R250 PolarHBondContact O-N 2.86Å; L247-R250 VanDerWaalsContact O-N 3.15Å; L247-S251 PolarHBondContact O-N 3.32Å; L247-M254 HydrophobicContact CD2-CE 3.68Å; L247-M254 HydrophobicContact CD2-SD 4.43Å; L247-M254 HydrophobicContact CG-CE 4.44Å; L247-I284 HydrophobicContact CD1-CG2 4.24Å; L247-I284 HydrophobicContact CG-CD1 3.95Å; L247-I284 HydrophobicContact CG-CG2 4.34Å; L247-Y285 HydrophobicContact CD1-CE2 3.96Å
248	L	91.6	Very high	91.9	Very high	31 Å²	31	44.3 Å²	44.3	16%	0.162	27%	0.269	C	S	.	.	H	α-helix	trans	-68.4	-33	-176.4	-60.8	-173.1	0	0	0	113	K244 I246 R250 S251 P252 M254 V255 V258	K244-L248 HydrophobicContact CD-CD1 4.08Å; K244-L248 HydrophobicContact CG-CD1 3.56Å; K244-L248 HydrophobicContact CG-CG 3.96Å; K244-L248 VanDerWaalsContact O-CG 3.3Å; K244-L248 WeakPolarHBondContact O-CG 3.46Å; K244-L248 PolarHBondContact O-N 3.44Å; I246-L248 PolarHBondContact O-N 2.7Å; L248-R250 VanDerWaalsContact C-N 3.26Å; L248-R250 PolarHBondContact O-N 2.81Å; L248-S251 CarbonylContact O-C 3.59Å; L248-P252 WeakPolarHBondContact O-CA 3.46Å; L248-M254 HydrophobicContact CD2-CB 4.12Å; L248-V255 HydrophobicContact CB-CG2 3.99Å; L248-V255 HydrophobicContact CD1-CG2 4.01Å; L248-V255 VanDerWaalsContact CD2-CA 3.49Å; L248-V255 HydrophobicContact CD2-CB 4.11Å; L248-V255 HydrophobicContact CD2-CG2 3.6Å; L248-V255 HydrophobicContact CG-CG2 4.03Å; L248-V258 HydrophobicContact CD2-CG2 4.14Å
249	A	93.5	Very high	91.4	Very high	78 Å²	78	49 Å²	49	65%	0.645	29%	0.287	S	S	*	.	H	α-helix	trans	-66.2	-30.8	174.8	0	0	0	0	0	112.3	S245 I246 L247	S245-A249 VanDerWaalsContact O-CB 3.28Å; S245-A249 WeakPolarHBondContact O-CB 3.41Å; S245-A249 PolarHBondContact O-N 2.79Å; S245-A249 VanDerWaalsContact O-N 3.11Å; I246-A249 PolarHBondContact O-N 2.95Å; L247-A249 VanDerWaalsContact C-N 3.35Å; L247-A249 PolarHBondContact O-N 2.84Å
250	R	92.7	Very high	90.8	Very high	96 Å²	96	50.9 Å²	50.9	36%	0.362	30%	0.295	S	S	.	.	H	α-helix	trans	-101.8	-24.2	-171	-61.8	-73.9	-95	119.3	-6.5	113.3	I246 L247 L248 I284 D287	I246-R250 WeakPolarHBondContact O-CB 3.42Å; I246-R250 WeakPolarHBondContact O-CG 3.37Å; I246-R250 PolarHBondContact O-N 2.79Å; L247-R250 PolarHBondContact O-N 2.86Å; L247-R250 VanDerWaalsContact O-N 3.15Å; L248-R250 VanDerWaalsContact C-N 3.26Å; L248-R250 PolarHBondContact O-N 2.81Å; R250-I284 HydrophobicContact CB-CB 4.43Å; R250-I284 HydrophobicContact CB-CG1 4.33Å; R250-I284 HydrophobicContact CB-CG2 3.91Å; R250-I284 HydrophobicContact CG-CG2 4.14Å; R250-I284 PolarHBondContact NE-O 3.24Å; R250-I284 PolarHBondContact NH2-O 3.4Å; R250-D287 IonicContact CZ-OD1 2.83Å; R250-D287 IonicContact CZ-OD2 3.98Å; R250-D287 IonicContact NH1-OD1 2.7Å; R250-D287 PolarHBondContact NH1-OD1 2.93Å; R250-D287 IonicContact NH1-OD2 2.67Å; R250-D287 IonicContact NH2-OD1 3.57Å; R250-D287 PolarHBondContact NH2-OD1 2.88Å; R250-D287 IonicContact NH2-OD2 2.58Å; R250-D287 PolarHBondContact NH2-OD2 2.84Å
251	S	90.7	Very high	90	Very high	2 Å²	2	51.6 Å²	51.6	1%	0.014	30%	0.304	C	S	.	.			trans	-137	87.6	166.5	178.4	0	0	0	0	109.4	L247 L248 P253 M254 Y306	L247-S251 PolarHBondContact O-N 3.32Å; L248-S251 CarbonylContact O-C 3.59Å; S251-P253 VanDerWaalsContact C-N 3.27Å; S251-M254 VanDerWaalsContact CB-SD 3.54Å; S251-M254 WeakPolarHBondContact O-CB 3.22Å; S251-M254 PolarHBondContact O-N 2.86Å; S251-M254 WeakPolarHBondContact OG-CG 3.49Å; S251-Y306 PolarHBondContact OG-O 3.25Å
252	P	86.9	Confident	89.1	Confident	86 Å²	86	60.6 Å²	60.6	56%	0.558	34%	0.34	S	S	*	.	G	3₁₀ helix	trans	-53	-33.4	174.6	-26.2	34.6	0	0	0	115.1	L248 M254 V255	L248-P252 WeakPolarHBondContact O-CA 3.46Å; P252-M254 PolarHBondContact O-N 3.22Å; P252-M254 VanDerWaalsContact O-N 3.16Å; P252-V255 WeakPolarHBondContact O-CB 3.41Å; P252-V255 WeakPolarHBondContact O-CG2 3.24Å; P252-V255 PolarHBondContact O-N 3.43Å; P252-V255 VanDerWaalsContact O-N 3.1Å
253	P	87.6	Confident	88.4	Confident	40 Å²	40	69.4 Å²	69.4	26%	0.26	38%	0.382	S	S	.	.	G	3₁₀ helix	trans	-58.1	-25.4	174.5	-27.9	36.9	0	0	0	114.5	S251 V255 S256 K307	S251-P253 VanDerWaalsContact C-N 3.27Å; P253-V255 PolarHBondContact O-N 2.87Å; P253-S256 PolarHBondContact O-OG 3.4Å; P253-K307 HydrophobicContact CB-CD 4.39Å; P253-K307 HydrophobicContact CG-CB 4.05Å; P253-K307 HydrophobicContact CG-CD 3.83Å; P253-K307 HydrophobicContact CG-CG 4.1Å
254	M	88.9	Confident	88.1	Confident	1 Å²	1	72.5 Å²	72.5	1%	0.005	39%	0.393	C	S	.	.	G	3₁₀ helix	trans	-67.3	-20	178.3	-63.7	175.9	83.8	0	0	112.7	L247 L248 S251 P252 S256 L257 V258 L267 I284 Y306	L247-M254 HydrophobicContact CD2-CE 3.68Å; L247-M254 HydrophobicContact CD2-SD 4.43Å; L247-M254 HydrophobicContact CG-CE 4.44Å; L248-M254 HydrophobicContact CD2-CB 4.12Å; S251-M254 VanDerWaalsContact CB-SD 3.54Å; S251-M254 WeakPolarHBondContact O-CB 3.22Å; S251-M254 PolarHBondContact O-N 2.86Å; S251-M254 WeakPolarHBondContact OG-CG 3.49Å; P252-M254 PolarHBondContact O-N 3.22Å; P252-M254 VanDerWaalsContact O-N 3.16Å; M254-S256 VanDerWaalsContact C-N 3.28Å; M254-S256 PolarHBondContact O-N 3.25Å; M254-L257 WeakPolarHBondContact O-CB 3.49Å; M254-L257 PolarHBondContact O-N 3.32Å; M254-V258 WeakPolarHBondContact O-CG2 3.09Å; M254-V258 PolarHBondContact O-N 2.97Å; M254-L267 HydrophobicContact CE-CD2 3.16Å; M254-L267 HydrophobicContact CE-CG 4.45Å; M254-I284 HydrophobicContact SD-CD1 4.02Å; M254-Y306 HydrophobicContact CE-CD1 4.31Å; M254-Y306 HydrophobicContact CE-CE1 4.25Å; M254-Y306 HydrophobicContact CG-CD1 3.58Å; M254-Y306 HydrophobicContact CG-CE1 4.18Å; M254-Y306 HydrophobicContact CG-CG 4.08Å; M254-Y306 HydrophobicContact SD-CD1 4.34Å; M254-Y306 HydrophobicContact SD-CG 4.38Å
255	V	84	Confident	88.1	Confident	79 Å²	79	73.3 Å²	73.3	48%	0.479	40%	0.395	S	S	.	.	G	3₁₀ helix	trans	-53.9	-44.2	-177	176.6	0	0	0	0	112	L248 P252 P253 L257 V258	L248-V255 HydrophobicContact CB-CG2 3.99Å; L248-V255 HydrophobicContact CD1-CG2 4.01Å; L248-V255 VanDerWaalsContact CD2-CA 3.49Å; L248-V255 HydrophobicContact CD2-CB 4.11Å; L248-V255 HydrophobicContact CD2-CG2 3.6Å; L248-V255 HydrophobicContact CG-CG2 4.03Å; P252-V255 WeakPolarHBondContact O-CB 3.41Å; P252-V255 WeakPolarHBondContact O-CG2 3.24Å; P252-V255 PolarHBondContact O-N 3.43Å; P252-V255 VanDerWaalsContact O-N 3.1Å; P253-V255 PolarHBondContact O-N 2.87Å; V255-L257 PolarHBondContact O-N 2.91Å; V255-V258 PolarHBondContact O-N 2.71Å
256	S	84.1	Confident	88.1	Confident	106 Å²	106	71.3 Å²	71.3	74%	0.741	38%	0.377	S	S	*	.	G	3₁₀ helix	trans	-73.5	-11.8	-177.8	51.9	0	0	0	0	114.1	P253 M254	P253-S256 PolarHBondContact O-OG 3.4Å; M254-S256 VanDerWaalsContact C-N 3.28Å; M254-S256 PolarHBondContact O-N 3.25Å
257	L	86.5	Confident	88.1	Confident	54 Å²	54	70.3 Å²	70.3	28%	0.283	37%	0.372	S	S	.	.	G	3₁₀ helix	trans	-98.8	-7.5	-177.6	-54.9	176.2	0	0	0	112.3	M254 V255 L267 Y305 Y306	M254-L257 WeakPolarHBondContact O-CB 3.49Å; M254-L257 PolarHBondContact O-N 3.32Å; V255-L257 PolarHBondContact O-N 2.91Å; L257-L267 HydrophobicContact CB-CD1 3.53Å; L257-L267 HydrophobicContact CD1-CD1 4.4Å; L257-Y305 HydrophobicContact CD1-CD1 4.46Å; L257-Y305 HydrophobicContact CD1-CE1 3.58Å; L257-Y306 HydrophobicContact CD1-CD1 4.02Å; L257-Y306 HydrophobicContact CD1-CE1 3.64Å
258	V	88.3	Confident	88.1	Confident	27 Å²	27	74.4 Å²	74.4	16%	0.164	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	115.8	-177.5	173.3	0	0	0	0	110	M231 K244 L248 M254 V255 Y265 I266	M231-V258 HydrophobicContact CE-CB 4.14Å; M231-V258 HydrophobicContact CE-CG1 3.53Å; M231-V258 HydrophobicContact CE-CG2 3.39Å; K244-V258 HydrophobicContact CD-CG1 4.44Å; L248-V258 HydrophobicContact CD2-CG2 4.14Å; M254-V258 WeakPolarHBondContact O-CG2 3.09Å; M254-V258 PolarHBondContact O-N 2.97Å; V255-V258 PolarHBondContact O-N 2.71Å; V258-Y265 HydrophobicContact CG1-CD1 3.92Å; V258-Y265 HydrophobicContact CG1-CG 4.13Å; V258-I266 WeakPolarHBondContact CA-O 3.39Å
259	E	87.5	Confident	88.3	Confident	133 Å²	133	73 Å²	73	62%	0.621	39%	0.386	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86	141.7	171	-64.5	-177.7	174.1	0	0	110.2	Y265 I266	E259-Y265 CarbonylContact O-C 3.5Å; E259-Y265 WeakPolarHBondContact O-CA 3.34Å; E259-I266 PolarHBondContact N-O 3.41Å; E259-I266 PolarHBondContact O-N 3.02Å
260	N	84.7	Confident	88.4	Confident	122 Å²	122	72.8 Å²	72.8	65%	0.652	38%	0.377	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.1	102.3	173	-172.6	6.1	0	0	0	109.3	Y265	N260-Y265 HydrophobicContact CB-CD1 4.15Å; N260-Y265 HydrophobicContact CB-CE1 3.98Å
261	A	79	Confident	88.6	Confident	36 Å²	36	72.7 Å²	72.7	30%	0.298	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	151.4	166.6	0	0	0	0	0	109.5	E263 R264 I266	A261-E263 PolarHBondContact O-N 3.29Å; A261-R264 CarbonylContact C-O 3.47Å; A261-R264 WeakPolarHBondContact CA-O 3.43Å; A261-R264 VanDerWaalsContact CB-O 3.25Å; A261-R264 WeakPolarHBondContact CB-O 3.35Å; A261-R264 PolarHBondContact N-O 3.11Å; A261-R264 PolarHBondContact O-N 2.83Å; A261-I266 HydrophobicContact CB-CD1 3.67Å; A261-I266 HydrophobicContact CB-CG1 4.09Å
262	K	77.2	Confident	88.9	Confident	219 Å²	219	73.1 Å²	73.1	95%	0.952	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-41.8	-38.4	-166.9	-70.6	-179.5	178	177.4	0	115.7
263	E	82.3	Confident	89.4	Confident	186 Å²	186	70.4 Å²	70.4	87%	0.869	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.6	-17	-177	-63.1	-179.2	179.2	0	0	114	A261	A261-E263 PolarHBondContact O-N 3.29Å
264	R	87.5	Confident	89.8	Confident	72 Å²	72	69 Å²	69	27%	0.272	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	149.6	-171.8	-62.1	-176	73.5	77.9	-0.9	111.1	T229 M231 D232 A261	T229-R264 PolarHBondContact O-NH1 2.94Å; T229-R264 PolarHBondContact O-NH2 2.85Å; T229-R264 PolarHBondContact OG1-NH2 2.86Å; M231-R264 PolarHBondContact O-NH2 3.47Å; D232-R264 IonicContact OD1-CZ 3.8Å; D232-R264 VanDerWaalsContact OD1-CZ 3.26Å; D232-R264 IonicContact OD1-NE 2.76Å; D232-R264 PolarHBondContact OD1-NE 3.26Å; D232-R264 IonicContact OD1-NH2 3.21Å; D232-R264 PolarHBondContact OD1-NH2 2.91Å; D232-R264 WeakPolarHBondContact OD2-CD 3.49Å; D232-R264 IonicContact OD2-NE 2.71Å; D232-R264 PolarHBondContact OD2-NE 3.36Å; A261-R264 CarbonylContact C-O 3.47Å; A261-R264 WeakPolarHBondContact CA-O 3.43Å; A261-R264 VanDerWaalsContact CB-O 3.25Å; A261-R264 WeakPolarHBondContact CB-O 3.35Å; A261-R264 PolarHBondContact N-O 3.11Å; A261-R264 PolarHBondContact O-N 2.83Å
265	Y	93.9	Very high	90.2	Very high	65 Å²	65	73.5 Å²	73.5	26%	0.255	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	142.2	170.6	-63.9	-70.8	0	0	0	110.6	D230 M231 D232 K244 V258 E259 N260	D230-Y265 WeakPolarHBondContact O-CD2 3.08Å; D230-Y265 PolarHBondContact O-N 3.2Å; M231-Y265 CarbonylContact C-O 3.46Å; M231-Y265 VanDerWaalsContact CA-O 3.24Å; M231-Y265 WeakPolarHBondContact CA-O 3.43Å; D232-Y265 PolarHBondContact N-O 2.95Å; K244-Y265 HydrophobicContact CB-CD2 3.99Å; K244-Y265 HydrophobicContact CD-CD1 3.77Å; K244-Y265 HydrophobicContact CD-CD2 3.26Å; K244-Y265 HydrophobicContact CD-CE1 3.94Å; K244-Y265 HydrophobicContact CD-CE2 3.39Å; K244-Y265 HydrophobicContact CD-CG 3.44Å; K244-Y265 VanDerWaalsContact CD-CG 3.44Å; K244-Y265 HydrophobicContact CG-CD2 4.24Å; K244-Y265 HydrophobicContact CG-CG 4.49Å; K244-Y265 PolarHBondContact NZ-OH 2.94Å; V258-Y265 HydrophobicContact CG1-CD1 3.92Å; V258-Y265 HydrophobicContact CG1-CG 4.13Å; E259-Y265 CarbonylContact O-C 3.5Å; E259-Y265 WeakPolarHBondContact O-CA 3.34Å; N260-Y265 HydrophobicContact CB-CD1 4.15Å; N260-Y265 HydrophobicContact CB-CE1 3.98Å
266	I	94.8	Very high	90.8	Very high	41 Å²	41	69.7 Å²	69.7	21%	0.21	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	129.8	-179.2	-57.9	178.6	0	0	0	109.1	D232 M234 V258 E259 A261	D232-I266 WeakPolarHBondContact O-CA 3.46Å; M234-I266 HydrophobicContact CE-CD1 4.4Å; M234-I266 HydrophobicContact CE-CG2 4.06Å; M234-I266 HydrophobicContact CG-CG2 3.87Å; V258-I266 WeakPolarHBondContact CA-O 3.39Å; E259-I266 PolarHBondContact N-O 3.41Å; E259-I266 PolarHBondContact O-N 3.02Å; A261-I266 HydrophobicContact CB-CD1 3.67Å; A261-I266 HydrophobicContact CB-CG1 4.09Å
267	L	95.1	Very high	91.4	Very high	0 Å²	0	64.7 Å²	64.7	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	116.2	165.2	176.5	70.6	0	0	0	108.3	D232 I233 M234 M254 L257 A269	D232-L267 PolarHBondContact O-N 3.45Å; I233-L267 WeakPolarHBondContact CA-O 3.36Å; I233-L267 HydrophobicContact CG1-CB 4.23Å; I233-L267 HydrophobicContact CG1-CD2 4.09Å; I233-L267 HydrophobicContact CG2-CD2 4.01Å; M234-L267 PolarHBondContact N-O 2.99Å; M254-L267 HydrophobicContact CE-CD2 3.16Å; M254-L267 HydrophobicContact CE-CG 4.45Å; L257-L267 HydrophobicContact CB-CD1 3.53Å; L257-L267 HydrophobicContact CD1-CD1 4.4Å; L267-A269 PolarHBondContact O-N 2.98Å
268	N	94	Very high	91.9	Very high	89 Å²	89	67.1 Å²	67.1	48%	0.476	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	116.3	170.7	-167.8	-14.5	0	0	0	109.2	T270	N268-T270 WeakPolarHBondContact OD1-CB 3.36Å; N268-T270 VanDerWaalsContact OD1-CG2 3.22Å; N268-T270 WeakPolarHBondContact OD1-CG2 3.01Å; N268-T270 PolarHBondContact OD1-N 3.23Å; N268-T270 PolarHBondContact OD1-OG1 3.03Å
269	A	95.7	Very high	92.3	Very high	0 Å²	0	66.3 Å²	66.3	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	33.4	180	0	0	0	0	0	110	I233 M234 L267 E271 F272 M277 Y306	I233-A269 HydrophobicContact CG2-CB 4Å; M234-A269 CarbonylContact O-C 3.48Å; M234-A269 VanDerWaalsContact O-CA 3.28Å; M234-A269 WeakPolarHBondContact O-CA 3.24Å; M234-A269 PolarHBondContact O-N 2.79Å; L267-A269 PolarHBondContact O-N 2.98Å; A269-E271 WeakPolarHBondContact CA-OE2 3.29Å; A269-E271 PolarHBondContact O-N 2.8Å; A269-F272 HydrophobicContact CB-CD2 4.29Å; A269-F272 PolarHBondContact O-N 3.3Å; A269-M277 HydrophobicContact CB-CE 3.88Å; A269-M277 HydrophobicContact CB-CG 4.23Å; A269-M277 HydrophobicContact CB-SD 4.11Å; A269-Y306 WeakPolarHBondContact CB-OH 3.16Å
270	T	95.7	Very high	92.8	Very high	74 Å²	74	60 Å²	60	45%	0.454	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-9.9	-172.2	47.8	0	0	0	0	113.6	M234 S236 N268 F272	M234-T270 HydrophobicContact CB-CG2 4.23Å; M234-T270 PolarHBondContact O-N 2.8Å; M234-T270 VanDerWaalsContact O-N 3.08Å; S236-T270 WeakPolarHBondContact CB-O 3.3Å; N268-T270 WeakPolarHBondContact OD1-CB 3.36Å; N268-T270 VanDerWaalsContact OD1-CG2 3.22Å; N268-T270 WeakPolarHBondContact OD1-CG2 3.01Å; N268-T270 PolarHBondContact OD1-N 3.23Å; N268-T270 PolarHBondContact OD1-OG1 3.03Å; T270-F272 VanDerWaalsContact C-N 3.3Å
271	E	95.9	Very high	93.3	Very high	95 Å²	95	54.3 Å²	54.3	44%	0.444	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-19.3	169.6	67.2	-87.6	-150.2	0	0	113.3	A269	A269-E271 WeakPolarHBondContact CA-OE2 3.29Å; A269-E271 PolarHBondContact O-N 2.8Å
272	F	97.3	Very high	94.1	Very high	11 Å²	11	54.4 Å²	54.4	5%	0.048	26%	0.264	C	S	.	.	S	Bend	trans	-111.9	147.5	-177.2	-52.8	-59.1	0	0	0	111.6	S236 A269 T270 M277 D298 Q301 A302 Y305 Y306	S236-F272 WeakPolarHBondContact CB-O 2.95Å; S236-F272 PolarHBondContact N-O 2.88Å; S236-F272 PolarHBondContact OG-O 3.23Å; A269-F272 HydrophobicContact CB-CD2 4.29Å; A269-F272 PolarHBondContact O-N 3.3Å; T270-F272 VanDerWaalsContact C-N 3.3Å; F272-M277 HydrophobicContact CB-CG 3.76Å; F272-M277 HydrophobicContact CB-SD 3.85Å; F272-M277 HydrophobicContact CD2-SD 3.74Å; F272-M277 HydrophobicContact CG-SD 4.1Å; F272-D298 WeakPolarHBondContact CD1-OD1 3.02Å; F272-Q301 HydrophobicContact CE1-CB 3.96Å; F272-A302 HydrophobicContact CD1-CB 3.8Å; F272-A302 HydrophobicContact CD2-CB 3.99Å; F272-A302 HydrophobicContact CE1-CB 3.88Å; F272-A302 HydrophobicContact CE2-CB 4.08Å; F272-A302 HydrophobicContact CG-CB 3.87Å; F272-A302 HydrophobicContact CZ-CB 4.04Å; F272-Y305 HydrophobicContact CE2-CD1 4.09Å; F272-Y305 HydrophobicContact CE2-CG 4.41Å; F272-Y305 HydrophobicContact CZ-CD1 4.23Å; F272-Y305 HydrophobicContact CZ-CG 4.09Å; F272-Y306 HydrophobicContact CD2-CE2 4.19Å; F272-Y306 AromaticContact CE2-CE2 3.91Å; F272-Y306 HydrophobicContact CE2-CE2 3.91Å; F272-Y306 AromaticContact CE2-CZ 3.95Å
273	S	97.1	Very high	95.1	Very high	28 Å²	28	44.6 Å²	44.6	20%	0.196	22%	0.221	C	C	.	.			trans	-68.3	156.4	175.1	72	0	0	0	0	112.6	S236 Q275 A276 M277 D298	S236-S273 WeakPolarHBondContact OG-CA 3.37Å; S273-Q275 PolarHBondContact O-N 2.83Å; S273-A276 PolarHBondContact O-N 3.26Å; S273-A276 PolarHBondContact OG-N 3.1Å; S273-A276 VanDerWaalsContact OG-N 3.17Å; S273-M277 PolarHBondContact O-N 3.01Å; S273-D298 WeakPolarHBondContact CA-OD2 3.38Å; S273-D298 WeakPolarHBondContact CB-OD2 3.12Å; S273-D298 PolarHBondContact N-OD2 3.15Å; S273-D298 PolarHBondContact OG-OD2 3.25Å
274	C	96.6	Very high	95.7	Very high	12 Å²	12	35.8 Å²	35.8	8%	0.081	18%	0.18	C	C	.	.	H	α-helix	trans	-55.3	-38.9	172.4	-172.4	0	0	0	0	111.6	A235 D237 C238 M277 Q278	A235-C274 HydrophobicContact CB-CB 4.35Å; D237-C274 WeakPolarHBondContact OD1-CA 3.47Å; D237-C274 WeakPolarHBondContact OD1-CB 3.48Å; D237-C274 PolarHBondContact OD1-N 3.38Å; C238-C274 HydrophobicContact CB-CB 3.64Å; C238-C274 WeakPolarHBondContact CB-SG 3.42Å; C238-C274 WeakPolarHBondContact SG-CB 3.43Å; C238-C274 CovalentContact SG-SG 2.02Å; C238-C274 PolarHBondContact SG-SG 2.78Å; C274-M277 PolarHBondContact O-N 3.16Å; C274-Q278 VanDerWaalsContact O-CB 3.27Å; C274-Q278 WeakPolarHBondContact O-CB 3.03Å; C274-Q278 WeakPolarHBondContact O-CG 3Å; C274-Q278 PolarHBondContact O-N 3.43Å; C274-Q278 PolarHBondContact SG-NE2 2.91Å
275	Q	96.7	Very high	96.1	Very high	94 Å²	94	32.7 Å²	32.7	44%	0.439	17%	0.168	S	C	.	.	H	α-helix	trans	-67.2	-42.1	-179.9	-63.7	-171.2	6.4	0	0	111.8	S273 Q278 C279 T295	S273-Q275 PolarHBondContact O-N 2.83Å; Q275-Q278 PolarHBondContact O-N 3.42Å; Q275-C279 PolarHBondContact O-N 3.28Å; Q275-C279 VanDerWaalsContact O-N 3.1Å; Q275-T295 HydrophobicContact CB-CG2 3.7Å; Q275-T295 HydrophobicContact CG-CG2 4.5Å
276	A	97.4	Very high	96.1	Very high	0 Å²	0	30 Å²	30	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-64.5	-47.6	175.9	0	0	0	0	0	111.3	S273 Q278 C279 V280 D298 V299	S273-A276 PolarHBondContact O-N 3.26Å; S273-A276 PolarHBondContact OG-N 3.1Å; S273-A276 VanDerWaalsContact OG-N 3.17Å; A276-Q278 VanDerWaalsContact C-N 3.31Å; A276-Q278 PolarHBondContact O-N 2.02Å; A276-C279 WeakPolarHBondContact O-CA 3.44Å; A276-C279 VanDerWaalsContact O-CB 3.27Å; A276-C279 WeakPolarHBondContact O-CB 3.22Å; A276-C279 PolarHBondContact O-N 2.83Å; A276-V280 WeakPolarHBondContact O-CG2 3.14Å; A276-V280 PolarHBondContact O-N 3.08Å; A276-D298 HydrophobicContact CB-CB 3.85Å; A276-D298 VanDerWaalsContact CB-CG 3.45Å; A276-D298 WeakPolarHBondContact CB-OD2 3.48Å; A276-V299 HydrophobicContact CB-CG2 3.85Å
277	M	97.1	Very high	95.9	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-66.3	-32	179	-68.6	-51.8	-62.8	0	0	112.8	I233 A235 I240 A269 F272 S273 C274 C279 V280 V281 A302 Y306	I233-M277 HydrophobicContact CG2-CE 3.81Å; A235-M277 HydrophobicContact CB-CB 4.28Å; A235-M277 HydrophobicContact CB-CG 4.17Å; I240-M277 HydrophobicContact CD1-CB 3.61Å; A269-M277 HydrophobicContact CB-CE 3.88Å; A269-M277 HydrophobicContact CB-CG 4.23Å; A269-M277 HydrophobicContact CB-SD 4.11Å; F272-M277 HydrophobicContact CB-CG 3.76Å; F272-M277 HydrophobicContact CB-SD 3.85Å; F272-M277 HydrophobicContact CD2-SD 3.74Å; F272-M277 HydrophobicContact CG-SD 4.1Å; S273-M277 PolarHBondContact O-N 3.01Å; C274-M277 PolarHBondContact O-N 3.16Å; M277-C279 VanDerWaalsContact C-N 3.33Å; M277-V280 HydrophobicContact CE-CG1 4.39Å; M277-V280 PolarHBondContact O-N 2.04Å; M277-V280 HydrophobicContact SD-CG2 4.42Å; M277-V281 WeakPolarHBondContact O-CB 3.26Å; M277-V281 VanDerWaalsContact O-CG2 3.22Å; M277-V281 WeakPolarHBondContact O-CG2 3.47Å; M277-V281 PolarHBondContact O-N 3.38Å; M277-A302 HydrophobicContact SD-CB 4.32Å; M277-Y306 HydrophobicContact CE-CE2 3.73Å; M277-Y306 HydrophobicContact SD-CE2 3.92Å
278	Q	96.6	Very high	95.7	Very high	105 Å²	105	37.1 Å²	37.1	49%	0.491	19%	0.191	S	C	.	.	H	α-helix	trans	-62.7	-39.2	169.3	-78	172.9	3.7	0	0	111.9	I240 C274 Q275 A276 S282	I240-Q278 HydrophobicContact CD1-CB 4.49Å; I240-Q278 HydrophobicContact CD1-CG 3.75Å; I240-Q278 HydrophobicContact CG1-CG 4.36Å; C274-Q278 VanDerWaalsContact O-CB 3.27Å; C274-Q278 WeakPolarHBondContact O-CB 3.03Å; C274-Q278 WeakPolarHBondContact O-CG 3Å; C274-Q278 PolarHBondContact O-N 3.43Å; C274-Q278 PolarHBondContact SG-NE2 2.91Å; Q275-Q278 PolarHBondContact O-N 3.42Å; A276-Q278 VanDerWaalsContact C-N 3.31Å; A276-Q278 PolarHBondContact O-N 2.02Å; Q278-S282 VanDerWaalsContact O-CB 3.24Å; Q278-S282 WeakPolarHBondContact O-CB 3.27Å; Q278-S282 PolarHBondContact O-N 3.47Å
279	C	96.9	Very high	95.5	Very high	10 Å²	10	33.9 Å²	33.9	7%	0.068	18%	0.176	C	C	.	.	H	α-helix	trans	-63.7	-48.7	173.9	-145.2	0	0	0	0	110.9	Q275 A276 M277 V281 S282 Y283 C289 I291 V299	Q275-C279 PolarHBondContact O-N 3.28Å; Q275-C279 VanDerWaalsContact O-N 3.1Å; A276-C279 WeakPolarHBondContact O-CA 3.44Å; A276-C279 VanDerWaalsContact O-CB 3.27Å; A276-C279 WeakPolarHBondContact O-CB 3.22Å; A276-C279 PolarHBondContact O-N 2.83Å; M277-C279 VanDerWaalsContact C-N 3.33Å; C279-V281 PolarHBondContact O-N 3.46Å; C279-S282 PolarHBondContact O-N 3Å; C279-Y283 WeakPolarHBondContact O-CB 3.32Å; C279-Y283 PolarHBondContact O-N 2.06Å; C279-C289 HydrophobicContact CB-CB 3.95Å; C279-C289 WeakPolarHBondContact CB-SG 3.28Å; C279-C289 VanDerWaalsContact O-CB 3.23Å; C279-C289 WeakPolarHBondContact O-CB 3.23Å; C279-C289 PolarHBondContact O-SG 3.49Å; C279-C289 WeakPolarHBondContact SG-CB 3.42Å; C279-C289 CovalentContact SG-SG 2.06Å; C279-C289 PolarHBondContact SG-SG 3.41Å; C279-I291 VanDerWaalsContact SG-CG1 3.58Å; C279-V299 HydrophobicContact CB-CG1 4.48Å; C279-V299 HydrophobicContact CB-CG2 3.87Å
280	V	97	Very high	95.2	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-57.1	-48.6	178.3	172.5	0	0	0	0	110.8	A276 M277 Y283 I284 A302 Y306 M308 L311	A276-V280 WeakPolarHBondContact O-CG2 3.14Å; A276-V280 PolarHBondContact O-N 3.08Å; M277-V280 HydrophobicContact CE-CG1 4.39Å; M277-V280 PolarHBondContact O-N 2.04Å; M277-V280 HydrophobicContact SD-CG2 4.42Å; V280-Y283 WeakPolarHBondContact O-CB 3.27Å; V280-Y283 PolarHBondContact O-N 2.75Å; V280-I284 HydrophobicContact CG1-CD1 4.11Å; V280-I284 WeakPolarHBondContact O-CG1 3.33Å; V280-I284 PolarHBondContact O-N 2.85Å; V280-A302 HydrophobicContact CG2-CB 3.87Å; V280-Y306 HydrophobicContact CG1-CD2 4.29Å; V280-M308 HydrophobicContact CG1-CE 4.48Å; V280-M308 HydrophobicContact CG1-SD 3.99Å; V280-L311 HydrophobicContact CG2-CD2 4.04Å
281	V	96.7	Very high	95	Very high	4 Å²	4	38.6 Å²	38.6	2%	0.024	20%	0.196	C	C	.	.	H	α-helix	trans	-65.4	-44.6	178.1	175.6	0	0	0	0	111	L223 I233 I240 M277 C279 Y283 I284 Y285	L223-V281 HydrophobicContact CD1-CG1 3.89Å; L223-V281 HydrophobicContact CD2-CG1 3.77Å; L223-V281 HydrophobicContact CG-CG1 4.49Å; I233-V281 HydrophobicContact CD1-CG2 3.38Å; I240-V281 HydrophobicContact CG2-CG1 4.49Å; I240-V281 HydrophobicContact CG2-CG2 4.32Å; M277-V281 WeakPolarHBondContact O-CB 3.26Å; M277-V281 VanDerWaalsContact O-CG2 3.22Å; M277-V281 WeakPolarHBondContact O-CG2 3.47Å; M277-V281 PolarHBondContact O-N 3.38Å; C279-V281 PolarHBondContact O-N 3.46Å; V281-Y283 VanDerWaalsContact C-N 3.26Å; V281-Y283 PolarHBondContact O-N 3.38Å; V281-I284 WeakPolarHBondContact O-CB 3.44Å; V281-I284 PolarHBondContact O-N 2.96Å; V281-Y285 HydrophobicContact CG1-CD2 4.2Å; V281-Y285 HydrophobicContact CG1-CE2 4.04Å; V281-Y285 WeakPolarHBondContact O-CD2 3.33Å; V281-Y285 PolarHBondContact O-N 2.94Å
282	S	95.7	Very high	94.8	Very high	37 Å²	37	39.3 Å²	39.3	26%	0.259	20%	0.198	S	C	.	.	H	α-helix	trans	-56.4	-43.8	174.8	-179	0	0	0	0	111.5	Q278 C279 Y285 T286 K288	Q278-S282 VanDerWaalsContact O-CB 3.24Å; Q278-S282 WeakPolarHBondContact O-CB 3.27Å; Q278-S282 PolarHBondContact O-N 3.47Å; C279-S282 PolarHBondContact O-N 3Å; S282-Y285 PolarHBondContact O-N 3.1Å; S282-T286 PolarHBondContact O-N 2.8Å; S282-T286 PolarHBondContact O-OG1 3.26Å; S282-K288 CarbonylContact C-O 3.55Å; S282-K288 PolarHBondContact OG-O 3.12Å
283	Y	96.6	Very high	94.5	Very high	13 Å²	13	42.2 Å²	42.2	5%	0.051	22%	0.217	C	C	.	.	H	α-helix	trans	-63.5	-43.7	178.9	-175.2	-84.3	0	0	0	111.8	C279 V280 V281 Y285 T286 D287 K288 M308 K310 L311 I314	C279-Y283 WeakPolarHBondContact O-CB 3.32Å; C279-Y283 PolarHBondContact O-N 2.06Å; V280-Y283 WeakPolarHBondContact O-CB 3.27Å; V280-Y283 PolarHBondContact O-N 2.75Å; V281-Y283 VanDerWaalsContact C-N 3.26Å; V281-Y283 PolarHBondContact O-N 3.38Å; Y283-Y285 PolarHBondContact O-N 2.93Å; Y283-T286 PolarHBondContact O-N 3.44Å; Y283-D287 WeakPolarHBondContact CE2-O 3.48Å; Y283-D287 WeakPolarHBondContact O-CA 3.01Å; Y283-D287 PolarHBondContact O-N 2.94Å; Y283-K288 PolarHBondContact N-O 2.97Å; Y283-M308 HydrophobicContact CD1-CE 3.34Å; Y283-M308 HydrophobicContact CE1-CE 3.86Å; Y283-M308 HydrophobicContact CG-CE 4.32Å; Y283-K310 WeakPolarHBondContact OH-CB 3.42Å; Y283-L311 HydrophobicContact CD1-CB 4.13Å; Y283-L311 HydrophobicContact CD1-CD2 4.27Å; Y283-L311 HydrophobicContact CD2-CB 4.17Å; Y283-L311 HydrophobicContact CD2-CD1 3.77Å; Y283-L311 HydrophobicContact CD2-CG 4.39Å; Y283-L311 HydrophobicContact CE1-CB 4.1Å; Y283-L311 HydrophobicContact CE2-CB 4.13Å; Y283-L311 HydrophobicContact CE2-CD1 4.34Å; Y283-L311 HydrophobicContact CG-CB 4.18Å; Y283-L311 HydrophobicContact CG-CD1 4.02Å; Y283-L311 HydrophobicContact CG-CD2 4.06Å; Y283-L311 HydrophobicContact CG-CG 4.31Å; Y283-I314 HydrophobicContact CD2-CD1 4.38Å; Y283-I314 HydrophobicContact CE2-CD1 3.8Å
284	I	95.8	Very high	94.3	Very high	1 Å²	1	46.7 Å²	46.7	1%	0.005	24%	0.239	C	C	.	.	H	α-helix	trans	-54.7	-38.4	176.1	-77.9	172.4	0	0	0	111.9	I246 L247 R250 M254 V280 V281 M308	I246-I284 HydrophobicContact CG2-CG2 3.9Å; L247-I284 HydrophobicContact CD1-CG2 4.24Å; L247-I284 HydrophobicContact CG-CD1 3.95Å; L247-I284 HydrophobicContact CG-CG2 4.34Å; R250-I284 HydrophobicContact CB-CB 4.43Å; R250-I284 HydrophobicContact CB-CG1 4.33Å; R250-I284 HydrophobicContact CB-CG2 3.91Å; R250-I284 HydrophobicContact CG-CG2 4.14Å; R250-I284 PolarHBondContact NE-O 3.24Å; R250-I284 PolarHBondContact NH2-O 3.4Å; M254-I284 HydrophobicContact SD-CD1 4.02Å; V280-I284 HydrophobicContact CG1-CD1 4.11Å; V280-I284 WeakPolarHBondContact O-CG1 3.33Å; V280-I284 PolarHBondContact O-N 2.85Å; V281-I284 WeakPolarHBondContact O-CB 3.44Å; V281-I284 PolarHBondContact O-N 2.96Å; I284-M308 HydrophobicContact CD1-CE 4.49Å; I284-M308 HydrophobicContact CG1-CE 3.83Å
285	Y	95.3	Very high	94.2	Very high	8 Å²	8	46.6 Å²	46.6	3%	0.031	24%	0.239	C	C	.	.	H	α-helix	trans	-83.9	-24.6	-177.6	-78.9	-110.6	0	0	0	113.3	F219 L223 H243 I246 L247 V281 S282 Y283	F219-Y285 HydrophobicContact CB-CD1 4.07Å; F219-Y285 HydrophobicContact CD1-CD1 4.28Å; F219-Y285 WeakPolarHBondContact O-CD1 3.28Å; L223-Y285 HydrophobicContact CB-CD1 3.73Å; L223-Y285 HydrophobicContact CB-CE1 3.78Å; L223-Y285 HydrophobicContact CB-CG 4.22Å; L223-Y285 HydrophobicContact CD1-CE1 4.24Å; L223-Y285 HydrophobicContact CD1-CE2 4.08Å; L223-Y285 HydrophobicContact CD2-CD1 4.41Å; L223-Y285 HydrophobicContact CD2-CD2 4.05Å; L223-Y285 HydrophobicContact CD2-CE2 4.39Å; L223-Y285 HydrophobicContact CD2-CG 4.05Å; L223-Y285 HydrophobicContact CG-CD1 4.5Å; L223-Y285 HydrophobicContact CG-CE1 4.45Å; H243-Y285 WeakPolarHBondContact CB-OH 3.31Å; H243-Y285 PolarHBondContact N-OH 3.22Å; H243-Y285 AromaticContact ND1-CE1 3.59Å; H243-Y285 AromaticContact ND1-CZ 3.56Å; H243-Y285 PolarHBondContact ND1-OH 3.43Å; I246-Y285 HydrophobicContact CB-CE1 4.43Å; I246-Y285 HydrophobicContact CB-CE2 4.4Å; I246-Y285 HydrophobicContact CD1-CD1 4.16Å; I246-Y285 HydrophobicContact CD1-CE1 3.39Å; I246-Y285 HydrophobicContact CG1-CE1 4.49Å; I246-Y285 HydrophobicContact CG2-CD1 4.31Å; I246-Y285 HydrophobicContact CG2-CD2 4.14Å; I246-Y285 HydrophobicContact CG2-CE1 4.1Å; I246-Y285 HydrophobicContact CG2-CE2 3.91Å; I246-Y285 HydrophobicContact CG2-CG 4.34Å; L247-Y285 HydrophobicContact CD1-CE2 3.96Å; V281-Y285 HydrophobicContact CG1-CD2 4.2Å; V281-Y285 HydrophobicContact CG1-CE2 4.04Å; V281-Y285 WeakPolarHBondContact O-CD2 3.33Å; V281-Y285 PolarHBondContact O-N 2.94Å; S282-Y285 PolarHBondContact O-N 3.1Å; Y283-Y285 PolarHBondContact O-N 2.93Å
286	T	93.4	Very high	94.2	Very high	7 Å²	7	42.1 Å²	42.1	4%	0.043	22%	0.218	C	C	.	.	H	α-helix	trans	-136.5	-5.7	-163.3	68.3	0	0	0	0	116.3	I216 E220 S282 Y283 K288	I216-T286 HydrophobicContact CG2-CG2 3.91Å; E220-T286 HydrophobicContact CB-CG2 3.82Å; E220-T286 HydrophobicContact CG-CG2 4.16Å; S282-T286 PolarHBondContact O-N 2.8Å; S282-T286 PolarHBondContact O-OG1 3.26Å; Y283-T286 PolarHBondContact O-N 3.44Å; T286-K288 PolarHBondContact O-N 3.01Å; T286-K288 VanDerWaalsContact O-N 3.11Å; T286-K288 WeakPolarHBondContact OG1-CB 3.09Å; T286-K288 PolarHBondContact OG1-N 3.41Å; T286-K288 VanDerWaalsContact OG1-N 3.11Å; T286-K288 PolarHBondContact OG1-O 3.5Å
287	D	91.9	Very high	94.2	Very high	75 Å²	75	45.2 Å²	45.2	40%	0.401	23%	0.232	S	C	.	.	S	Bend	trans	53.2	17.9	-163.3	-68.6	-48.1	0	0	0	113.5	R250 Y283	R250-D287 IonicContact CZ-OD1 2.83Å; R250-D287 IonicContact CZ-OD2 3.98Å; R250-D287 IonicContact NH1-OD1 2.7Å; R250-D287 PolarHBondContact NH1-OD1 2.93Å; R250-D287 IonicContact NH1-OD2 2.67Å; R250-D287 IonicContact NH2-OD1 3.57Å; R250-D287 PolarHBondContact NH2-OD1 2.88Å; R250-D287 IonicContact NH2-OD2 2.58Å; R250-D287 PolarHBondContact NH2-OD2 2.84Å; Y283-D287 WeakPolarHBondContact CE2-O 3.48Å; Y283-D287 WeakPolarHBondContact O-CA 3.01Å; Y283-D287 PolarHBondContact O-N 2.94Å
288	K	90.4	Very high	94.2	Very high	117 Å²	117	46.6 Å²	46.6	51%	0.509	24%	0.239	S	C	.	.			trans	-131.2	133.8	-178.5	-62	173.9	-174.6	179.1	0	109.8	S282 Y283 T286	S282-K288 CarbonylContact C-O 3.55Å; S282-K288 PolarHBondContact OG-O 3.12Å; Y283-K288 PolarHBondContact N-O 2.97Å; T286-K288 PolarHBondContact O-N 3.01Å; T286-K288 VanDerWaalsContact O-N 3.11Å; T286-K288 WeakPolarHBondContact OG1-CB 3.09Å; T286-K288 PolarHBondContact OG1-N 3.41Å; T286-K288 VanDerWaalsContact OG1-N 3.11Å; T286-K288 PolarHBondContact OG1-O 3.5Å
289	C	90.6	Very high	94.2	Very high	21 Å²	21	41.6 Å²	41.6	14%	0.142	22%	0.216	C	C	.	.			trans	-150.6	150.1	160.9	86.5	0	0	0	0	110.2	C279	C279-C289 HydrophobicContact CB-CB 3.95Å; C279-C289 WeakPolarHBondContact CB-SG 3.28Å; C279-C289 VanDerWaalsContact O-CB 3.23Å; C279-C289 WeakPolarHBondContact O-CB 3.23Å; C279-C289 PolarHBondContact O-SG 3.49Å; C279-C289 WeakPolarHBondContact SG-CB 3.42Å; C279-C289 CovalentContact SG-SG 2.06Å; C279-C289 PolarHBondContact SG-SG 3.41Å
290	I	87.7	Confident	94.3	Very high	156 Å²	156	41.2 Å²	41.2	80%	0.8	21%	0.213	S	C	*	.			trans	-90.9	108.4	177.2	-60.8	172.9	0	0	0	106.9
291	I	92.9	Very high	94.3	Very high	16 Å²	16	44.8 Å²	44.8	8%	0.082	23%	0.23	C	C	.	.			trans	-88.7	122.9	174.8	-56.4	-176.7	0	0	0	108.1	C279 A296 V299 L311 I314 A315 E318	C279-I291 VanDerWaalsContact SG-CG1 3.58Å; I291-A296 VanDerWaalsContact CG2-CA 3.47Å; I291-A296 HydrophobicContact CG2-CB 3.52Å; I291-V299 HydrophobicContact CD1-CB 4.49Å; I291-V299 HydrophobicContact CD1-CG1 3.75Å; I291-V299 HydrophobicContact CG1-CG1 4.21Å; I291-L311 HydrophobicContact CD1-CD1 4.13Å; I291-I314 HydrophobicContact CD1-CB 4.11Å; I291-I314 HydrophobicContact CD1-CG2 3.67Å; I291-I314 HydrophobicContact CG1-CG2 4.31Å; I291-A315 VanDerWaalsContact CD1-CA 3.48Å; I291-A315 HydrophobicContact CD1-CB 3.69Å; I291-E318 HydrophobicContact CB-CG 4.45Å; I291-E318 HydrophobicContact CG2-CB 4.29Å; I291-E318 HydrophobicContact CG2-CG 4.08Å
292	K	91	Very high	94.3	Very high	110 Å²	110	44.6 Å²	44.6	48%	0.478	23%	0.229	S	C	.	.			trans	-92	151.5	172.9	-61.6	178.1	-176.2	172	0	110.2	D294 T295 A296	K292-D294 WeakPolarHBondContact CB-OD1 3.31Å; K292-D294 PolarHBondContact O-N 3.44Å; K292-D294 VanDerWaalsContact O-N 3.16Å; K292-T295 PolarHBondContact N-OG1 3.25Å; K292-T295 VanDerWaalsContact N-OG1 3.15Å; K292-T295 PolarHBondContact O-N 3.05Å; K292-T295 PolarHBondContact O-OG1 3.26Å; K292-A296 PolarHBondContact O-N 3.21Å
293	P	91	Very high	94.3	Very high	72 Å²	72	42.9 Å²	42.9	47%	0.468	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.6	-37.8	-179.4	-29.8	35.2	0	0	0	115.2	E318	P293-E318 WeakPolarHBondContact CG-OE1 3.35Å
294	D	92.4	Very high	94.2	Very high	123 Å²	123	46.1 Å²	46.1	66%	0.658	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.1	-24.2	179.9	56.1	-18.9	0	0	0	113.5	K292	K292-D294 WeakPolarHBondContact CB-OD1 3.31Å; K292-D294 PolarHBondContact O-N 3.44Å; K292-D294 VanDerWaalsContact O-N 3.16Å
295	T	95.1	Very high	94.1	Very high	10 Å²	10	51.5 Å²	51.5	6%	0.061	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.7	-12.2	179	58.3	0	0	0	0	114.1	Q275 K292 E297 D298 V299	Q275-T295 HydrophobicContact CB-CG2 3.7Å; Q275-T295 HydrophobicContact CG-CG2 4.5Å; K292-T295 PolarHBondContact N-OG1 3.25Å; K292-T295 VanDerWaalsContact N-OG1 3.15Å; K292-T295 PolarHBondContact O-N 3.05Å; K292-T295 PolarHBondContact O-OG1 3.26Å; T295-E297 VanDerWaalsContact C-N 3.3Å; T295-E297 PolarHBondContact O-N 2.87Å; T295-D298 PolarHBondContact O-N 3.21Å; T295-V299 WeakPolarHBondContact O-CG2 3.44Å; T295-V299 PolarHBondContact O-N 2.73Å
296	A	96.9	Very high	94.1	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-62.3	-34.7	-167.5	0	0	0	0	0	113.9	I291 K292 L300 E318 L319	I291-A296 VanDerWaalsContact CG2-CA 3.47Å; I291-A296 HydrophobicContact CG2-CB 3.52Å; K292-A296 PolarHBondContact O-N 3.21Å; A296-L300 WeakPolarHBondContact O-CB 3.13Å; A296-L300 PolarHBondContact O-N 2.55Å; A296-E318 HydrophobicContact CB-CB 4.37Å; A296-E318 HydrophobicContact CB-CG 4.11Å; A296-L319 HydrophobicContact CB-CD2 3.66Å; A296-L319 HydrophobicContact CB-CG 3.82Å
297	E	96.8	Very high	94	Very high	65 Å²	65	58 Å²	58	30%	0.304	28%	0.281	S	S	.	.	H	α-helix	trans	-67.5	-45.1	177.6	174.8	159.4	173.4	0	0	112	T295 L300 Q301 L319 K331 L334	T295-E297 VanDerWaalsContact C-N 3.3Å; T295-E297 PolarHBondContact O-N 2.87Å; E297-L300 WeakPolarHBondContact O-CB 2.92Å; E297-L300 PolarHBondContact O-N 2.81Å; E297-Q301 WeakPolarHBondContact O-CG 3.39Å; E297-Q301 PolarHBondContact O-N 3.2Å; E297-L319 HydrophobicContact CB-CD2 4.31Å; E297-K331 IonicContact OE2-NZ 2.64Å; E297-K331 PolarHBondContact OE2-NZ 3.28Å; E297-L334 HydrophobicContact CB-CD2 4.1Å; E297-L334 HydrophobicContact CG-CD1 3.82Å; E297-L334 HydrophobicContact CG-CD2 3.59Å; E297-L334 HydrophobicContact CG-CG 4.3Å
298	D	96.9	Very high	94.2	Very high	29 Å²	29	55 Å²	55	16%	0.155	27%	0.265	C	S	.	.	H	α-helix	trans	-67.7	-40.5	178.7	-167.5	22.7	0	0	0	111.2	F272 S273 A276 T295 L300 Q301 A302	F272-D298 WeakPolarHBondContact CD1-OD1 3.02Å; S273-D298 WeakPolarHBondContact CA-OD2 3.38Å; S273-D298 WeakPolarHBondContact CB-OD2 3.12Å; S273-D298 PolarHBondContact N-OD2 3.15Å; S273-D298 PolarHBondContact OG-OD2 3.25Å; A276-D298 HydrophobicContact CB-CB 3.85Å; A276-D298 VanDerWaalsContact CB-CG 3.45Å; A276-D298 WeakPolarHBondContact CB-OD2 3.48Å; T295-D298 PolarHBondContact O-N 3.21Å; D298-L300 VanDerWaalsContact C-N 3.34Å; D298-L300 PolarHBondContact O-N 3.17Å; D298-Q301 PolarHBondContact O-N 3.05Å; D298-A302 WeakPolarHBondContact O-CB 3.37Å; D298-A302 PolarHBondContact O-N 3.19Å
299	V	98.2	Very high	94.3	Very high	0 Å²	0	54 Å²	54	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-62.2	-40.9	171.9	176.6	0	0	0	0	111.5	A276 C279 I291 T295 A302 A303 L311 A315	A276-V299 HydrophobicContact CB-CG2 3.85Å; C279-V299 HydrophobicContact CB-CG1 4.48Å; C279-V299 HydrophobicContact CB-CG2 3.87Å; I291-V299 HydrophobicContact CD1-CB 4.49Å; I291-V299 HydrophobicContact CD1-CG1 3.75Å; I291-V299 HydrophobicContact CG1-CG1 4.21Å; T295-V299 WeakPolarHBondContact O-CG2 3.44Å; T295-V299 PolarHBondContact O-N 2.73Å; V299-A302 PolarHBondContact O-N 3.47Å; V299-A303 WeakPolarHBondContact O-CB 3.07Å; V299-A303 PolarHBondContact O-N 2.9Å; V299-L311 HydrophobicContact CG1-CD1 4.06Å; V299-L311 HydrophobicContact CG1-CD2 4.36Å; V299-L311 HydrophobicContact CG1-CG 4.2Å; V299-A315 HydrophobicContact CG1-CB 4.19Å
300	L	97.9	Very high	94.4	Very high	1 Å²	1	58.4 Å²	58.4	1%	0.005	29%	0.287	C	S	.	.	H	α-helix	trans	-62.6	-45.9	177.2	178	57.4	0	0	0	111.1	A296 E297 D298 A303 H304 E312 A315 E316 L319 L334 I338 L343	A296-L300 WeakPolarHBondContact O-CB 3.13Å; A296-L300 PolarHBondContact O-N 2.55Å; E297-L300 WeakPolarHBondContact O-CB 2.92Å; E297-L300 PolarHBondContact O-N 2.81Å; D298-L300 VanDerWaalsContact C-N 3.34Å; D298-L300 PolarHBondContact O-N 3.17Å; L300-A303 PolarHBondContact O-N 2.98Å; L300-H304 WeakPolarHBondContact O-CB 3.47Å; L300-H304 PolarHBondContact O-N 3.24Å; L300-E312 HydrophobicContact CD1-CB 3.96Å; L300-E312 HydrophobicContact CD1-CG 4.18Å; L300-A315 HydrophobicContact CB-CB 3.81Å; L300-A315 HydrophobicContact CD1-CB 4.29Å; L300-E316 HydrophobicContact CD1-CG 3.73Å; L300-E316 HydrophobicContact CD2-CG 4.12Å; L300-L319 HydrophobicContact CB-CD1 4.26Å; L300-L319 HydrophobicContact CD2-CD1 3.55Å; L300-L334 HydrophobicContact CD2-CD2 4.14Å; L300-I338 HydrophobicContact CD2-CD1 3.83Å; L300-I338 HydrophobicContact CG-CD1 3.69Å; L300-L343 HydrophobicContact CD2-CD2 4.13Å
301	Q	96.9	Very high	94.8	Very high	76 Å²	76	51 Å²	51	36%	0.355	25%	0.249	S	C	.	.	H	α-helix	trans	-61.6	-45.8	177.6	-72.1	177.1	-36	0	0	111.8	F272 E297 D298 H304 Y305 L334 I338	F272-Q301 HydrophobicContact CE1-CB 3.96Å; E297-Q301 WeakPolarHBondContact O-CG 3.39Å; E297-Q301 PolarHBondContact O-N 3.2Å; D298-Q301 PolarHBondContact O-N 3.05Å; Q301-H304 PolarHBondContact O-N 2.95Å; Q301-Y305 WeakPolarHBondContact O-CB 3.34Å; Q301-Y305 PolarHBondContact O-N 2.99Å; Q301-L334 HydrophobicContact CG-CD1 4.05Å; Q301-I338 HydrophobicContact CG-CD1 3.9Å
302	A	96.2	Very high	94.9	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-63.6	-45.4	177	0	0	0	0	0	112.1	F272 M277 V280 D298 V299 H304 Y305 Y306	F272-A302 HydrophobicContact CD1-CB 3.8Å; F272-A302 HydrophobicContact CD2-CB 3.99Å; F272-A302 HydrophobicContact CE1-CB 3.88Å; F272-A302 HydrophobicContact CE2-CB 4.08Å; F272-A302 HydrophobicContact CG-CB 3.87Å; F272-A302 HydrophobicContact CZ-CB 4.04Å; M277-A302 HydrophobicContact SD-CB 4.32Å; V280-A302 HydrophobicContact CG2-CB 3.87Å; D298-A302 WeakPolarHBondContact O-CB 3.37Å; D298-A302 PolarHBondContact O-N 3.19Å; V299-A302 PolarHBondContact O-N 3.47Å; A302-H304 VanDerWaalsContact C-N 3.3Å; A302-H304 PolarHBondContact O-N 2.94Å; A302-Y305 PolarHBondContact O-N 3.34Å; A302-Y306 HydrophobicContact CB-CD2 4.41Å; A302-Y306 HydrophobicContact CB-CE2 4.31Å; A302-Y306 WeakPolarHBondContact O-CD2 3.33Å; A302-Y306 PolarHBondContact O-N 3.11Å
303	A	96.1	Very high	95.1	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-61.3	-41	178.2	0	0	0	0	0	111.4	V299 L300 K307 M308 L311 E312	V299-A303 WeakPolarHBondContact O-CB 3.07Å; V299-A303 PolarHBondContact O-N 2.9Å; L300-A303 PolarHBondContact O-N 2.98Å; A303-K307 CarbonylContact O-C 3.43Å; A303-K307 WeakPolarHBondContact O-CA 3.44Å; A303-K307 PolarHBondContact O-N 3.45Å; A303-M308 HydrophobicContact CB-CB 4.31Å; A303-M308 PolarHBondContact O-N 3.27Å; A303-L311 HydrophobicContact CB-CB 4.05Å; A303-L311 HydrophobicContact CB-CD2 3.9Å; A303-L311 HydrophobicContact CB-CG 3.77Å; A303-E312 HydrophobicContact CB-CB 4.42Å; A303-E312 HydrophobicContact CB-CG 3.57Å
304	H	95.1	Very high	95.3	Very high	81 Å²	81	51.6 Å²	51.6	38%	0.375	24%	0.243	S	C	.	.	H	α-helix	trans	-63.8	-47.7	174.5	-173.3	74.4	0	0	0	112.2	L300 Q301 A302 Y306 K307 E312 I338	L300-H304 WeakPolarHBondContact O-CB 3.47Å; L300-H304 PolarHBondContact O-N 3.24Å; Q301-H304 PolarHBondContact O-N 2.95Å; A302-H304 VanDerWaalsContact C-N 3.3Å; A302-H304 PolarHBondContact O-N 2.94Å; H304-Y306 VanDerWaalsContact C-N 3.34Å; H304-Y306 PolarHBondContact O-N 3.15Å; H304-K307 PolarHBondContact O-N 3.41Å; H304-E312 VanDerWaalsContact CA-CD 3.49Å; H304-E312 WeakPolarHBondContact CA-OE1 3.18Å; H304-E312 HydrophobicContact CB-CG 4.36Å; H304-E312 IonicContact CG-OE2 2.8Å; H304-E312 IonicContact ND1-OE2 3.26Å; H304-E312 PolarHBondContact ND1-OE2 2.85Å; H304-I338 HydrophobicContact CB-CG2 4.21Å; H304-I338 PolarHBondContact CE1-O 3.37Å
305	Y	94	Very high	95.5	Very high	115 Å²	115	45.8 Å²	45.8	45%	0.451	21%	0.212	S	C	.	.	H	α-helix	trans	-59.9	-43.3	179.8	-175	-100.2	0	0	0	112.1	L257 F272 Q301 A302 K307	L257-Y305 HydrophobicContact CD1-CD1 4.46Å; L257-Y305 HydrophobicContact CD1-CE1 3.58Å; F272-Y305 HydrophobicContact CE2-CD1 4.09Å; F272-Y305 HydrophobicContact CE2-CG 4.41Å; F272-Y305 HydrophobicContact CZ-CD1 4.23Å; F272-Y305 HydrophobicContact CZ-CG 4.09Å; Q301-Y305 WeakPolarHBondContact O-CB 3.34Å; Q301-Y305 PolarHBondContact O-N 2.99Å; A302-Y305 PolarHBondContact O-N 3.34Å; Y305-K307 VanDerWaalsContact C-N 3.28Å; Y305-K307 PolarHBondContact O-N 3.12Å
306	Y	94	Very high	95.5	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.9	7.9	176.9	-57.3	-54.1	0	0	0	114	S251 M254 L257 A269 F272 M277 V280 A302 H304	S251-Y306 PolarHBondContact OG-O 3.25Å; M254-Y306 HydrophobicContact CE-CD1 4.31Å; M254-Y306 HydrophobicContact CE-CE1 4.25Å; M254-Y306 HydrophobicContact CG-CD1 3.58Å; M254-Y306 HydrophobicContact CG-CE1 4.18Å; M254-Y306 HydrophobicContact CG-CG 4.08Å; M254-Y306 HydrophobicContact SD-CD1 4.34Å; M254-Y306 HydrophobicContact SD-CG 4.38Å; L257-Y306 HydrophobicContact CD1-CD1 4.02Å; L257-Y306 HydrophobicContact CD1-CE1 3.64Å; A269-Y306 WeakPolarHBondContact CB-OH 3.16Å; F272-Y306 HydrophobicContact CD2-CE2 4.19Å; F272-Y306 AromaticContact CE2-CE2 3.91Å; F272-Y306 HydrophobicContact CE2-CE2 3.91Å; F272-Y306 AromaticContact CE2-CZ 3.95Å; M277-Y306 HydrophobicContact CE-CE2 3.73Å; M277-Y306 HydrophobicContact SD-CE2 3.92Å; V280-Y306 HydrophobicContact CG1-CD2 4.29Å; A302-Y306 HydrophobicContact CB-CD2 4.41Å; A302-Y306 HydrophobicContact CB-CE2 4.31Å; A302-Y306 WeakPolarHBondContact O-CD2 3.33Å; A302-Y306 PolarHBondContact O-N 3.11Å; H304-Y306 VanDerWaalsContact C-N 3.34Å; H304-Y306 PolarHBondContact O-N 3.15Å
307	K	93.1	Very high	95.4	Very high	150 Å²	150	49.3 Å²	49.3	65%	0.652	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	49.7	65.5	179.7	-47.5	-178.9	-179.4	176.3	0	112.5	P253 A303 H304 Y305 P309	P253-K307 HydrophobicContact CB-CD 4.39Å; P253-K307 HydrophobicContact CG-CB 4.05Å; P253-K307 HydrophobicContact CG-CD 3.83Å; P253-K307 HydrophobicContact CG-CG 4.1Å; A303-K307 CarbonylContact O-C 3.43Å; A303-K307 WeakPolarHBondContact O-CA 3.44Å; A303-K307 PolarHBondContact O-N 3.45Å; H304-K307 PolarHBondContact O-N 3.41Å; Y305-K307 VanDerWaalsContact C-N 3.28Å; Y305-K307 PolarHBondContact O-N 3.12Å; K307-P309 VanDerWaalsContact C-CD 3.49Å; K307-P309 VanDerWaalsContact O-CD 3.31Å; K307-P309 WeakPolarHBondContact O-CD 3.44Å
308	M	94.3	Very high	95.4	Very high	13 Å²	13	47.7 Å²	47.7	6%	0.064	22%	0.223	C	C	.	.			trans	-118.2	74	-178.5	-61.1	177.8	67.9	0	0	110.5	V280 Y283 I284 A303 K310 L311 E312	V280-M308 HydrophobicContact CG1-CE 4.48Å; V280-M308 HydrophobicContact CG1-SD 3.99Å; Y283-M308 HydrophobicContact CD1-CE 3.34Å; Y283-M308 HydrophobicContact CE1-CE 3.86Å; Y283-M308 HydrophobicContact CG-CE 4.32Å; I284-M308 HydrophobicContact CD1-CE 4.49Å; I284-M308 HydrophobicContact CG1-CE 3.83Å; A303-M308 HydrophobicContact CB-CB 4.31Å; A303-M308 PolarHBondContact O-N 3.27Å; M308-K310 VanDerWaalsContact C-N 3.3Å; M308-K310 PolarHBondContact O-N 3.1Å; M308-K310 VanDerWaalsContact O-N 3.12Å; M308-L311 HydrophobicContact CB-CB 4.08Å; M308-L311 HydrophobicContact CE-CD2 3.94Å; M308-L311 PolarHBondContact O-N 3.42Å; M308-L311 HydrophobicContact SD-CD2 4.31Å; M308-E312 PolarHBondContact N-OE1 3.29Å; M308-E312 PolarHBondContact O-N 3.02Å
309	P	92.7	Very high	95.3	Very high	95 Å²	95	46.5 Å²	46.5	62%	0.617	22%	0.216	S	C	*	.	H	α-helix	trans	-59	-34.7	-167.4	-26.6	34.3	0	0	0	114.9	K307 E312 R313	K307-P309 VanDerWaalsContact C-CD 3.49Å; K307-P309 VanDerWaalsContact O-CD 3.31Å; K307-P309 WeakPolarHBondContact O-CD 3.44Å; P309-E312 PolarHBondContact O-N 2.91Å; P309-R313 WeakPolarHBondContact O-CB 3.2Å; P309-R313 PolarHBondContact O-N 3.39Å
310	K	93.3	Very high	95.2	Very high	114 Å²	114	48.7 Å²	48.7	50%	0.496	23%	0.227	S	C	.	.	H	α-helix	trans	-68.1	-37.7	177.2	-71.9	-172.6	-179.1	-174.4	0	111.6	A204 Y283 M308 I314	A204-K310 PolarHBondContact O-NZ 2.93Å; Y283-K310 WeakPolarHBondContact OH-CB 3.42Å; M308-K310 VanDerWaalsContact C-N 3.3Å; M308-K310 PolarHBondContact O-N 3.1Å; M308-K310 VanDerWaalsContact O-N 3.12Å; K310-I314 VanDerWaalsContact O-CG1 3.31Å; K310-I314 WeakPolarHBondContact O-CG1 3.07Å; K310-I314 PolarHBondContact O-N 3.16Å
311	L	95.7	Very high	95.1	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-73.2	-39.9	175	179.6	59.3	0	0	0	111.3	V280 Y283 I291 V299 A303 M308 R313 I314 A315	V280-L311 HydrophobicContact CG2-CD2 4.04Å; Y283-L311 HydrophobicContact CD1-CB 4.13Å; Y283-L311 HydrophobicContact CD1-CD2 4.27Å; Y283-L311 HydrophobicContact CD2-CB 4.17Å; Y283-L311 HydrophobicContact CD2-CD1 3.77Å; Y283-L311 HydrophobicContact CD2-CG 4.39Å; Y283-L311 HydrophobicContact CE1-CB 4.1Å; Y283-L311 HydrophobicContact CE2-CB 4.13Å; Y283-L311 HydrophobicContact CE2-CD1 4.34Å; Y283-L311 HydrophobicContact CG-CB 4.18Å; Y283-L311 HydrophobicContact CG-CD1 4.02Å; Y283-L311 HydrophobicContact CG-CD2 4.06Å; Y283-L311 HydrophobicContact CG-CG 4.31Å; I291-L311 HydrophobicContact CD1-CD1 4.13Å; V299-L311 HydrophobicContact CG1-CD1 4.06Å; V299-L311 HydrophobicContact CG1-CD2 4.36Å; V299-L311 HydrophobicContact CG1-CG 4.2Å; A303-L311 HydrophobicContact CB-CB 4.05Å; A303-L311 HydrophobicContact CB-CD2 3.9Å; A303-L311 HydrophobicContact CB-CG 3.77Å; M308-L311 HydrophobicContact CB-CB 4.08Å; M308-L311 HydrophobicContact CE-CD2 3.94Å; M308-L311 PolarHBondContact O-N 3.42Å; M308-L311 HydrophobicContact SD-CD2 4.31Å; L311-R313 VanDerWaalsContact C-N 3.27Å; L311-R313 PolarHBondContact O-N 3.49Å; L311-I314 PolarHBondContact O-N 3.23Å; L311-I314 VanDerWaalsContact O-N 3.12Å; L311-A315 PolarHBondContact O-N 2.87Å
312	E	95.4	Very high	95	Very high	27 Å²	27	54.9 Å²	54.9	13%	0.126	25%	0.253	C	S	.	.	H	α-helix	trans	-52.2	-49.7	171.2	-70.3	174.1	-122	0	0	109.9	L300 A303 H304 M308 P309 I314 A315 E316	L300-E312 HydrophobicContact CD1-CB 3.96Å; L300-E312 HydrophobicContact CD1-CG 4.18Å; A303-E312 HydrophobicContact CB-CB 4.42Å; A303-E312 HydrophobicContact CB-CG 3.57Å; H304-E312 VanDerWaalsContact CA-CD 3.49Å; H304-E312 WeakPolarHBondContact CA-OE1 3.18Å; H304-E312 HydrophobicContact CB-CG 4.36Å; H304-E312 IonicContact CG-OE2 2.8Å; H304-E312 IonicContact ND1-OE2 3.26Å; H304-E312 PolarHBondContact ND1-OE2 2.85Å; M308-E312 PolarHBondContact N-OE1 3.29Å; M308-E312 PolarHBondContact O-N 3.02Å; P309-E312 PolarHBondContact O-N 2.91Å; E312-I314 VanDerWaalsContact C-N 3.32Å; E312-I314 PolarHBondContact O-N 2.98Å; E312-A315 PolarHBondContact O-N 3.5Å; E312-A315 VanDerWaalsContact O-N 3.11Å; E312-E316 WeakPolarHBondContact O-CB 3.45Å; E312-E316 WeakPolarHBondContact O-CG 3.36Å; E312-E316 PolarHBondContact O-N 3.25Å
313	R	94.9	Very high	94.9	Very high	117 Å²	117	55.6 Å²	55.6	44%	0.442	26%	0.257	S	S	.	.	H	α-helix	trans	-58.9	-38.5	178.5	-175.1	61.5	172.5	171.5	4.4	113.7	P309 L311 E316 N317	P309-R313 WeakPolarHBondContact O-CB 3.2Å; P309-R313 PolarHBondContact O-N 3.39Å; L311-R313 VanDerWaalsContact C-N 3.27Å; L311-R313 PolarHBondContact O-N 3.49Å; R313-E316 WeakPolarHBondContact CA-OE2 3.45Å; R313-N317 WeakPolarHBondContact O-CB 3.09Å; R313-N317 PolarHBondContact O-N 3.33Å; R313-N317 VanDerWaalsContact O-N 3.1Å; R313-N317 PolarHBondContact O-ND2 2.99Å
314	I	95.3	Very high	94.8	Very high	68 Å²	68	58.7 Å²	58.7	35%	0.349	27%	0.273	S	S	.	.	H	α-helix	trans	-67.4	-44.4	177	-61.5	164.4	0	0	0	109.9	Y283 I291 K310 L311 E312 N317 E318	Y283-I314 HydrophobicContact CD2-CD1 4.38Å; Y283-I314 HydrophobicContact CE2-CD1 3.8Å; I291-I314 HydrophobicContact CD1-CB 4.11Å; I291-I314 HydrophobicContact CD1-CG2 3.67Å; I291-I314 HydrophobicContact CG1-CG2 4.31Å; K310-I314 VanDerWaalsContact O-CG1 3.31Å; K310-I314 WeakPolarHBondContact O-CG1 3.07Å; K310-I314 PolarHBondContact O-N 3.16Å; L311-I314 PolarHBondContact O-N 3.23Å; L311-I314 VanDerWaalsContact O-N 3.12Å; E312-I314 VanDerWaalsContact C-N 3.32Å; E312-I314 PolarHBondContact O-N 2.98Å; I314-N317 PolarHBondContact O-N 2.67Å; I314-E318 PolarHBondContact O-N 3.44Å; I314-E318 VanDerWaalsContact O-N 3.15Å
315	A	96.5	Very high	94.7	Very high	0 Å²	0	58.8 Å²	58.8	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-65.1	-43.3	178.7	0	0	0	0	0	112.2	I291 V299 L300 L311 E312 N317 E318 L319	I291-A315 VanDerWaalsContact CD1-CA 3.48Å; I291-A315 HydrophobicContact CD1-CB 3.69Å; V299-A315 HydrophobicContact CG1-CB 4.19Å; L300-A315 HydrophobicContact CB-CB 3.81Å; L300-A315 HydrophobicContact CD1-CB 4.29Å; L311-A315 PolarHBondContact O-N 2.87Å; E312-A315 PolarHBondContact O-N 3.5Å; E312-A315 VanDerWaalsContact O-N 3.11Å; A315-N317 PolarHBondContact O-N 2.95Å; A315-E318 PolarHBondContact O-N 2.96Å; A315-L319 WeakPolarHBondContact O-CG 3.5Å; A315-L319 PolarHBondContact O-N 3.46Å
316	E	95.9	Very high	94.5	Very high	12 Å²	12	61.8 Å²	61.8	6%	0.056	29%	0.289	C	S	.	.	H	α-helix	trans	-58.7	-46.4	175.3	-70.3	165.1	157	0	0	111.7	L300 E312 R313 E318 L319 I320 S340 V342 L343	L300-E316 HydrophobicContact CD1-CG 3.73Å; L300-E316 HydrophobicContact CD2-CG 4.12Å; E312-E316 WeakPolarHBondContact O-CB 3.45Å; E312-E316 WeakPolarHBondContact O-CG 3.36Å; E312-E316 PolarHBondContact O-N 3.25Å; R313-E316 WeakPolarHBondContact CA-OE2 3.45Å; E316-E318 VanDerWaalsContact C-N 3.28Å; E316-E318 PolarHBondContact O-N 2.83Å; E316-L319 PolarHBondContact O-N 3.46Å; E316-I320 WeakPolarHBondContact O-CB 3.34Å; E316-I320 WeakPolarHBondContact O-CD1 3.49Å; E316-I320 WeakPolarHBondContact O-CG1 3.49Å; E316-I320 PolarHBondContact O-N 3.21Å; E316-S340 VanDerWaalsContact CD-OG 3.29Å; E316-S340 WeakPolarHBondContact OE1-CB 3.33Å; E316-S340 PolarHBondContact OE1-OG 2.66Å; E316-V342 HydrophobicContact CB-CB 4.44Å; E316-V342 HydrophobicContact CB-CG1 3.62Å; E316-V342 HydrophobicContact CG-CB 4.41Å; E316-V342 HydrophobicContact CG-CG1 4.12Å; E316-V342 WeakPolarHBondContact OE2-CB 3.35Å; E316-V342 WeakPolarHBondContact OE2-CG1 3.43Å; E316-V342 WeakPolarHBondContact OE2-CG2 3.47Å; E316-L343 HydrophobicContact CG-CB 4.45Å
317	N	95	Very high	94.4	Very high	73 Å²	73	63.2 Å²	63.2	39%	0.39	30%	0.297	S	S	.	.	H	α-helix	trans	-62.2	-37.8	178.7	-73.2	-31.4	0	0	0	112	R313 I314 A315 I320 R321	R313-N317 WeakPolarHBondContact O-CB 3.09Å; R313-N317 PolarHBondContact O-N 3.33Å; R313-N317 VanDerWaalsContact O-N 3.1Å; R313-N317 PolarHBondContact O-ND2 2.99Å; I314-N317 PolarHBondContact O-N 2.67Å; A315-N317 PolarHBondContact O-N 2.95Å; N317-I320 PolarHBondContact O-N 3.24Å; N317-R321 WeakPolarHBondContact O-CB 3.45Å; N317-R321 PolarHBondContact O-N 2.81Å
318	E	95.3	Very high	94.4	Very high	30 Å²	30	56.1 Å²	56.1	14%	0.14	27%	0.266	C	S	.	.	H	α-helix	trans	-67.3	-42.1	176.3	-174.7	59.5	-168.2	0	0	111.5	I291 P293 A296 I314 A315 E316 I320 R321 C322	I291-E318 HydrophobicContact CB-CG 4.45Å; I291-E318 HydrophobicContact CG2-CB 4.29Å; I291-E318 HydrophobicContact CG2-CG 4.08Å; P293-E318 WeakPolarHBondContact CG-OE1 3.35Å; A296-E318 HydrophobicContact CB-CB 4.37Å; A296-E318 HydrophobicContact CB-CG 4.11Å; I314-E318 PolarHBondContact O-N 3.44Å; I314-E318 VanDerWaalsContact O-N 3.15Å; A315-E318 PolarHBondContact O-N 2.96Å; E316-E318 VanDerWaalsContact C-N 3.28Å; E316-E318 PolarHBondContact O-N 2.83Å; E318-I320 PolarHBondContact O-N 3.47Å; E318-R321 WeakPolarHBondContact O-CB 3.38Å; E318-R321 PolarHBondContact O-N 3.13Å; E318-R321 IonicContact OE1-CZ 3.15Å; E318-R321 IonicContact OE1-NE 3.38Å; E318-R321 PolarHBondContact OE1-NE 3.38Å; E318-R321 IonicContact OE1-NH2 2.81Å; E318-R321 PolarHBondContact OE1-NH2 2.5Å; E318-R321 IonicContact OE2-CZ 3.19Å; E318-R321 IonicContact OE2-NE 3.61Å; E318-R321 PolarHBondContact OE2-NE 3.23Å; E318-R321 IonicContact OE2-NH2 3.6Å; E318-R321 PolarHBondContact OE2-NH2 3.48Å; E318-C322 PolarHBondContact O-N 3.49Å; E318-C322 VanDerWaalsContact O-N 3.13Å; E318-C322 PolarHBondContact O-SG 3.29Å
319	L	96.5	Very high	94.1	Very high	4 Å²	4	56.8 Å²	56.8	2%	0.021	27%	0.274	C	S	.	.	H	α-helix	trans	-61.9	-43.4	173.8	-69.4	168.8	0	0	0	111.9	A296 E297 L300 A315 E316 R321 C322 L323 K331 L334 L343	A296-L319 HydrophobicContact CB-CD2 3.66Å; A296-L319 HydrophobicContact CB-CG 3.82Å; E297-L319 HydrophobicContact CB-CD2 4.31Å; L300-L319 HydrophobicContact CB-CD1 4.26Å; L300-L319 HydrophobicContact CD2-CD1 3.55Å; A315-L319 WeakPolarHBondContact O-CG 3.5Å; A315-L319 PolarHBondContact O-N 3.46Å; E316-L319 PolarHBondContact O-N 3.46Å; L319-R321 VanDerWaalsContact C-N 3.33Å; L319-R321 PolarHBondContact O-N 2.86Å; L319-C322 CarbonylContact O-C 3.18Å; L319-C322 PolarHBondContact O-N 3Å; L319-L323 PolarHBondContact O-N 3.23Å; L319-K331 HydrophobicContact CD2-CD 4.07Å; L319-L334 HydrophobicContact CD1-CD2 3.85Å; L319-L343 HydrophobicContact CB-CD1 3.98Å; L319-L343 HydrophobicContact CD1-CD2 4.19Å
320	I	95.7	Very high	94	Very high	46 Å²	46	54.8 Å²	54.8	24%	0.236	26%	0.262	C	S	.	.	H	α-helix	trans	-61.3	-43.1	176.7	-67.9	165	0	0	0	110.6	E316 N317 E318 C322 L323 V342 L343	E316-I320 WeakPolarHBondContact O-CB 3.34Å; E316-I320 WeakPolarHBondContact O-CD1 3.49Å; E316-I320 WeakPolarHBondContact O-CG1 3.49Å; E316-I320 PolarHBondContact O-N 3.21Å; N317-I320 PolarHBondContact O-N 3.24Å; E318-I320 PolarHBondContact O-N 3.47Å; I320-C322 PolarHBondContact O-N 3.24Å; I320-L323 HydrophobicContact CB-CD1 4.43Å; I320-L323 HydrophobicContact CG2-CD1 4.31Å; I320-L323 WeakPolarHBondContact O-CB 3.18Å; I320-L323 WeakPolarHBondContact O-CG 3.34Å; I320-L323 PolarHBondContact O-N 3.21Å; I320-V342 HydrophobicContact CD1-CG1 3.93Å; I320-L343 HydrophobicContact CD1-CD1 4.39Å; I320-L343 HydrophobicContact CG1-CD1 3.63Å
321	R	95.2	Very high	94	Very high	169 Å²	169	50.6 Å²	50.6	64%	0.638	24%	0.244	S	C	*	.	H	α-helix	trans	-61	-32	178.1	-170.9	-178.4	76.2	88.8	0.4	112.1	N317 E318 L319	N317-R321 WeakPolarHBondContact O-CB 3.45Å; N317-R321 PolarHBondContact O-N 2.81Å; E318-R321 WeakPolarHBondContact O-CB 3.38Å; E318-R321 PolarHBondContact O-N 3.13Å; E318-R321 IonicContact OE1-CZ 3.15Å; E318-R321 IonicContact OE1-NE 3.38Å; E318-R321 PolarHBondContact OE1-NE 3.38Å; E318-R321 IonicContact OE1-NH2 2.81Å; E318-R321 PolarHBondContact OE1-NH2 2.5Å; E318-R321 IonicContact OE2-CZ 3.19Å; E318-R321 IonicContact OE2-NE 3.61Å; E318-R321 PolarHBondContact OE2-NE 3.23Å; E318-R321 IonicContact OE2-NH2 3.6Å; E318-R321 PolarHBondContact OE2-NH2 3.48Å; L319-R321 VanDerWaalsContact C-N 3.33Å; L319-R321 PolarHBondContact O-N 2.86Å
322	C	94.7	Very high	93.7	Very high	38 Å²	38	50.9 Å²	50.9	26%	0.257	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.8	4.5	-179.2	-68.3	0	0	0	0	114.2	E318 L319 I320 D324 N327	E318-C322 PolarHBondContact O-N 3.49Å; E318-C322 VanDerWaalsContact O-N 3.13Å; E318-C322 PolarHBondContact O-SG 3.29Å; L319-C322 CarbonylContact O-C 3.18Å; L319-C322 PolarHBondContact O-N 3Å; I320-C322 PolarHBondContact O-N 3.24Å; C322-D324 PolarHBondContact O-N 3.24Å; C322-N327 PolarHBondContact O-ND2 2.7Å
323	L	95.2	Very high	93.4	Very high	15 Å²	15	55.4 Å²	55.4	8%	0.079	26%	0.264	C	S	.	.			trans	-59.8	130.9	179.7	-75.7	170.2	0	0	0	112.3	L319 I320 N327 K331 I347 Y350	L319-L323 PolarHBondContact O-N 3.23Å; I320-L323 HydrophobicContact CB-CD1 4.43Å; I320-L323 HydrophobicContact CG2-CD1 4.31Å; I320-L323 WeakPolarHBondContact O-CB 3.18Å; I320-L323 WeakPolarHBondContact O-CG 3.34Å; I320-L323 PolarHBondContact O-N 3.21Å; L323-N327 WeakPolarHBondContact CA-OD1 3.28Å; L323-K331 HydrophobicContact CD2-CB 3.93Å; L323-K331 HydrophobicContact CD2-CG 3.9Å; L323-I347 HydrophobicContact CD1-CG1 3.92Å; L323-I347 HydrophobicContact CD2-CG1 4Å; L323-Y350 HydrophobicContact CB-CD2 3.79Å; L323-Y350 HydrophobicContact CB-CE2 4.13Å; L323-Y350 HydrophobicContact CB-CG 4.02Å; L323-Y350 HydrophobicContact CD1-CG 4.28Å; L323-Y350 VanDerWaalsContact O-CE2 3.27Å; L323-Y350 WeakPolarHBondContact O-CE2 3.48Å
324	D	93.8	Very high	93.3	Very high	65 Å²	65	50 Å²	50	35%	0.348	24%	0.244	S	C	.	.			trans	-142.9	170.9	172	70.3	37.5	0	0	0	111.4	C322 K326 N327 I328 Y350	C322-D324 PolarHBondContact O-N 3.24Å; D324-K326 PolarHBondContact O-N 3.38Å; D324-K326 WeakPolarHBondContact OD1-CA 3.44Å; D324-K326 WeakPolarHBondContact OD1-CB 3.19Å; D324-K326 PolarHBondContact OD1-N 3.19Å; D324-N327 PolarHBondContact N-ND2 3.41Å; D324-N327 PolarHBondContact N-OD1 2.68Å; D324-N327 PolarHBondContact O-N 2.94Å; D324-N327 PolarHBondContact O-OD1 2.88Å; D324-N327 PolarHBondContact OD1-N 2.99Å; D324-N327 PolarHBondContact OD1-ND2 3.49Å; D324-N327 PolarHBondContact OD2-ND2 3.3Å; D324-I328 WeakPolarHBondContact O-CB 3.48Å; D324-I328 PolarHBondContact O-N 2.74Å; D324-Y350 WeakPolarHBondContact CA-OH 3.33Å
325	E	91.3	Very high	93.1	Very high	83 Å²	83	46.8 Å²	46.8	39%	0.388	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-30.2	179.5	-174.6	180	151.2	0	0	113.2	I328 Y350 V357 S360 V362	E325-I328 WeakPolarHBondContact O-CG2 3.17Å; E325-Y350 PolarHBondContact N-OH 3.48Å; E325-V357 HydrophobicContact CB-CG2 4.25Å; E325-V357 HydrophobicContact CG-CG1 4.5Å; E325-V357 HydrophobicContact CG-CG2 4.23Å; E325-S360 WeakPolarHBondContact OE1-CB 3.36Å; E325-V362 WeakPolarHBondContact O-CG1 3.24Å
326	K	91	Very high	92.7	Very high	178 Å²	178	50.4 Å²	50.4	77%	0.774	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81	-34.4	-176.5	-59.4	178.5	-179.3	177.6	0	112	D324	D324-K326 PolarHBondContact O-N 3.38Å; D324-K326 WeakPolarHBondContact OD1-CA 3.44Å; D324-K326 WeakPolarHBondContact OD1-CB 3.19Å; D324-K326 PolarHBondContact OD1-N 3.19Å
327	N	92.6	Very high	92.4	Very high	31 Å²	31	55 Å²	55	17%	0.166	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.4	-15	-174	71	35.2	0	0	0	113.6	C322 L323 D324 A329 S330 K331	C322-N327 PolarHBondContact O-ND2 2.7Å; L323-N327 WeakPolarHBondContact CA-OD1 3.28Å; D324-N327 PolarHBondContact N-ND2 3.41Å; D324-N327 PolarHBondContact N-OD1 2.68Å; D324-N327 PolarHBondContact O-N 2.94Å; D324-N327 PolarHBondContact O-OD1 2.88Å; D324-N327 PolarHBondContact OD1-N 2.99Å; D324-N327 PolarHBondContact OD1-ND2 3.49Å; D324-N327 PolarHBondContact OD2-ND2 3.3Å; N327-A329 VanDerWaalsContact C-N 3.26Å; N327-A329 PolarHBondContact O-N 3.31Å; N327-A329 VanDerWaalsContact O-N 3.15Å; N327-S330 PolarHBondContact O-N 2.89Å; N327-S330 PolarHBondContact O-OG 3.12Å; N327-K331 PolarHBondContact O-N 3.46Å
328	I	91.5	Very high	92.2	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-52.7	-41.8	-174.9	-163.4	172.5	0	0	0	113.3	D324 E325 S330 K331 M332 I347 Y350 I351 V357 W363	D324-I328 WeakPolarHBondContact O-CB 3.48Å; D324-I328 PolarHBondContact O-N 2.74Å; E325-I328 WeakPolarHBondContact O-CG2 3.17Å; I328-S330 PolarHBondContact O-N 3.28Å; I328-K331 PolarHBondContact O-N 3.2Å; I328-M332 HydrophobicContact CG1-SD 4.21Å; I328-M332 WeakPolarHBondContact O-CG 3.4Å; I328-M332 PolarHBondContact O-N 3.28Å; I328-I347 HydrophobicContact CD1-CG2 4.2Å; I328-I347 HydrophobicContact CG1-CG2 4.07Å; I328-Y350 HydrophobicContact CD1-CD1 3.84Å; I328-Y350 HydrophobicContact CD1-CE1 4.1Å; I328-I351 HydrophobicContact CD1-CD1 4Å; I328-I351 HydrophobicContact CD1-CG1 3.6Å; I328-V357 HydrophobicContact CD1-CG1 3.99Å; I328-V357 HydrophobicContact CG2-CG1 4.23Å; I328-W363 HydrophobicContact CD1-CZ3 4.45Å
329	A	89.4	Confident	91.9	Very high	28 Å²	28	53.6 Å²	53.6	23%	0.231	28%	0.275	C	S	.	.	H	α-helix	trans	-63.6	-42.8	179.9	0	0	0	0	0	112.2	N327 K331 M332 K333 V362 M366	N327-A329 VanDerWaalsContact C-N 3.26Å; N327-A329 PolarHBondContact O-N 3.31Å; N327-A329 VanDerWaalsContact O-N 3.15Å; A329-K331 PolarHBondContact O-N 3.32Å; A329-M332 PolarHBondContact O-N 3.22Å; A329-K333 PolarHBondContact O-N 2.87Å; A329-K333 VanDerWaalsContact O-N 3.14Å; A329-V362 HydrophobicContact CB-CG1 4.18Å; A329-M366 VanDerWaalsContact CA-SD 3.57Å; A329-M366 HydrophobicContact CB-CB 4.33Å; A329-M366 HydrophobicContact CB-CG 4.18Å; A329-M366 HydrophobicContact CB-SD 3.58Å; A329-M366 VanDerWaalsContact CB-SD 3.58Å
330	S	90.9	Very high	91.6	Very high	52 Å²	52	53.9 Å²	53.9	36%	0.364	28%	0.277	S	S	.	.	H	α-helix	trans	-64.1	-40.8	176.1	70.5	0	0	0	0	111.6	N327 I328 K333 L334	N327-S330 PolarHBondContact O-N 2.89Å; N327-S330 PolarHBondContact O-OG 3.12Å; I328-S330 PolarHBondContact O-N 3.28Å; S330-K333 PolarHBondContact O-N 3.36Å; S330-L334 PolarHBondContact O-N 3.5Å
331	K	93.1	Very high	91.3	Very high	27 Å²	27	60 Å²	60	12%	0.117	30%	0.302	C	S	.	.	H	α-helix	trans	-71.2	-32.2	179.4	-57.8	-45	176.5	-141.3	0	112.6	E297 L319 L323 N327 I328 A329 L334 T335 I347	E297-K331 IonicContact OE2-NZ 2.64Å; E297-K331 PolarHBondContact OE2-NZ 3.28Å; L319-K331 HydrophobicContact CD2-CD 4.07Å; L323-K331 HydrophobicContact CD2-CB 3.93Å; L323-K331 HydrophobicContact CD2-CG 3.9Å; N327-K331 PolarHBondContact O-N 3.46Å; I328-K331 PolarHBondContact O-N 3.2Å; A329-K331 PolarHBondContact O-N 3.32Å; K331-L334 HydrophobicContact CD-CD2 4.42Å; K331-L334 PolarHBondContact O-N 3.49Å; K331-T335 WeakPolarHBondContact O-CB 3.43Å; K331-T335 PolarHBondContact O-N 3.25Å; K331-T335 PolarHBondContact O-OG1 2.78Å; K331-I347 HydrophobicContact CB-CD1 4.1Å
332	M	88.9	Confident	91.1	Very high	5 Å²	5	53.5 Å²	53.5	3%	0.025	28%	0.28	C	S	.	.	H	α-helix	trans	-65.9	-43.4	173.3	-77.5	174.1	50.1	0	0	112.2	I328 A329 T335 K336 I347 W363 M366 I377	I328-M332 HydrophobicContact CG1-SD 4.21Å; I328-M332 WeakPolarHBondContact O-CG 3.4Å; I328-M332 PolarHBondContact O-N 3.28Å; A329-M332 PolarHBondContact O-N 3.22Å; M332-T335 WeakPolarHBondContact O-CB 3.29Å; M332-T335 PolarHBondContact O-N 3.26Å; M332-K336 PolarHBondContact O-N 2.91Å; M332-I347 HydrophobicContact CG-CD1 3.96Å; M332-I347 HydrophobicContact CG-CG2 3.83Å; M332-I347 HydrophobicContact SD-CG2 4.29Å; M332-W363 HydrophobicContact CE-CH2 4.41Å; M332-W363 HydrophobicContact CE-CZ3 4.46Å; M332-W363 HydrophobicContact SD-CH2 4.35Å; M332-W363 HydrophobicContact SD-CZ3 3.9Å; M332-M366 HydrophobicContact CE-CE 3.48Å; M332-M366 VanDerWaalsContact CE-CE 3.48Å; M332-M366 HydrophobicContact CE-SD 3.5Å; M332-M366 WeakPolarHBondContact CE-SD 3.48Å; M332-M366 HydrophobicContact SD-CE 3.63Å; M332-M366 HydrophobicContact SD-SD 3.68Å; M332-M366 VanDerWaalsContact SD-SD 3.68Å; M332-I377 HydrophobicContact CE-CB 3.67Å; M332-I377 HydrophobicContact CE-CG1 4.38Å; M332-I377 HydrophobicContact CE-CG2 3.15Å; M332-I377 HydrophobicContact CG-CG1 4.36Å; M332-I377 HydrophobicContact SD-CB 4.24Å; M332-I377 HydrophobicContact SD-CG1 4.31Å; M332-I377 HydrophobicContact SD-CG2 3.76Å
333	K	89.5	Confident	91	Very high	123 Å²	123	51.7 Å²	51.7	54%	0.535	27%	0.268	S	S	.	.	H	α-helix	trans	-59	-50.4	174.3	-174.3	179.9	177.2	-175.8	0	110.8	A329 S330 T335 K336 D337	A329-K333 PolarHBondContact O-N 2.87Å; A329-K333 VanDerWaalsContact O-N 3.14Å; S330-K333 PolarHBondContact O-N 3.36Å; K333-T335 VanDerWaalsContact C-N 3.3Å; K333-T335 PolarHBondContact O-N 3.39Å; K333-K336 PolarHBondContact O-N 3.44Å; K333-K336 VanDerWaalsContact O-N 3.12Å; K333-D337 VanDerWaalsContact O-CG 3.28Å; K333-D337 PolarHBondContact O-N 2.95Å
334	L	92	Very high	90.9	Very high	3 Å²	3	51 Å²	51	2%	0.016	27%	0.265	C	S	.	.	H	α-helix	trans	-54.6	-45.1	175	-178.9	68	0	0	0	112.6	E297 L300 Q301 L319 S330 K331 K336 D337 I338 L343	E297-L334 HydrophobicContact CB-CD2 4.1Å; E297-L334 HydrophobicContact CG-CD1 3.82Å; E297-L334 HydrophobicContact CG-CD2 3.59Å; E297-L334 HydrophobicContact CG-CG 4.3Å; L300-L334 HydrophobicContact CD2-CD2 4.14Å; Q301-L334 HydrophobicContact CG-CD1 4.05Å; L319-L334 HydrophobicContact CD1-CD2 3.85Å; S330-L334 PolarHBondContact O-N 3.5Å; K331-L334 HydrophobicContact CD-CD2 4.42Å; K331-L334 PolarHBondContact O-N 3.49Å; L334-K336 VanDerWaalsContact C-N 3.32Å; L334-K336 PolarHBondContact O-N 3.17Å; L334-D337 PolarHBondContact O-N 2.81Å; L334-I338 HydrophobicContact CD1-CD1 3.55Å; L334-I338 HydrophobicContact CD1-CG1 4.19Å; L334-I338 HydrophobicContact CG-CD1 3.99Å; L334-I338 WeakPolarHBondContact O-CB 3.36Å; L334-I338 WeakPolarHBondContact O-CG1 3.4Å; L334-I338 PolarHBondContact O-N 2.95Å; L334-L343 HydrophobicContact CD2-CD2 4.24Å
335	T	91.4	Very high	90.8	Very high	1 Å²	1	52.1 Å²	52.1	1%	0.006	27%	0.268	C	S	.	.	H	α-helix	trans	-58.9	-43.5	178.2	-58.1	0	0	0	0	112	K331 M332 K333 G339 S340 L343 I347	K331-T335 WeakPolarHBondContact O-CB 3.43Å; K331-T335 PolarHBondContact O-N 3.25Å; K331-T335 PolarHBondContact O-OG1 2.78Å; M332-T335 WeakPolarHBondContact O-CB 3.29Å; M332-T335 PolarHBondContact O-N 3.26Å; K333-T335 VanDerWaalsContact C-N 3.3Å; K333-T335 PolarHBondContact O-N 3.39Å; T335-G339 VanDerWaalsContact O-CA 3.3Å; T335-G339 WeakPolarHBondContact O-CA 3.48Å; T335-G339 PolarHBondContact O-N 2.8Å; T335-S340 VanDerWaalsContact CG2-O 3.28Å; T335-S340 WeakPolarHBondContact CG2-O 3.38Å; T335-S340 PolarHBondContact O-N 3.05Å; T335-L343 HydrophobicContact CG2-CB 4.26Å; T335-L343 WeakPolarHBondContact OG1-CD2 3.39Å; T335-L343 WeakPolarHBondContact OG1-CG 3.27Å; T335-I347 VanDerWaalsContact OG1-CD1 3.24Å; T335-I347 WeakPolarHBondContact OG1-CD1 3.3Å
336	K	87.3	Confident	90.9	Very high	75 Å²	75	48.5 Å²	48.5	33%	0.326	25%	0.253	S	S	.	.	H	α-helix	trans	-68.4	-42	178.9	178.1	-179.4	170.2	-172.7	0	111.5	M332 K333 L334 D370 S372 A373	M332-K336 PolarHBondContact O-N 2.91Å; K333-K336 PolarHBondContact O-N 3.44Å; K333-K336 VanDerWaalsContact O-N 3.12Å; L334-K336 VanDerWaalsContact C-N 3.32Å; L334-K336 PolarHBondContact O-N 3.17Å; K336-D370 IonicContact NZ-OD1 3.8Å; K336-D370 PolarHBondContact NZ-OD1 3.34Å; K336-D370 VanDerWaalsContact NZ-OD1 3.15Å; K336-D370 IonicContact NZ-OD2 3.73Å; K336-D370 PolarHBondContact NZ-OD2 3.19Å; K336-S372 PolarHBondContact NZ-OG 2.92Å; K336-S372 VanDerWaalsContact NZ-OG 3.1Å; K336-A373 HydrophobicContact CD-CB 3.87Å
337	D	89.4	Confident	90.9	Very high	109 Å²	109	40 Å²	40	58%	0.583	22%	0.216	S	C	*	.	H	α-helix	trans	-64.9	-39.9	-179.6	-67.9	-16.2	0	0	0	111.6	K333 L334	K333-D337 VanDerWaalsContact O-CG 3.28Å; K333-D337 PolarHBondContact O-N 2.95Å; L334-D337 PolarHBondContact O-N 2.81Å
338	I	90.8	Very high	90.9	Very high	20 Å²	20	38.6 Å²	38.6	10%	0.103	21%	0.209	C	C	.	.	H	α-helix	trans	-86.8	-26.1	179.8	-63.3	-178.1	0	0	0	112.4	L300 Q301 H304 L334	L300-I338 HydrophobicContact CD2-CD1 3.83Å; L300-I338 HydrophobicContact CG-CD1 3.69Å; Q301-I338 HydrophobicContact CG-CD1 3.9Å; H304-I338 HydrophobicContact CB-CG2 4.21Å; H304-I338 PolarHBondContact CE1-O 3.37Å; L334-I338 HydrophobicContact CD1-CD1 3.55Å; L334-I338 HydrophobicContact CD1-CG1 4.19Å; L334-I338 HydrophobicContact CG-CD1 3.99Å; L334-I338 WeakPolarHBondContact O-CB 3.36Å; L334-I338 WeakPolarHBondContact O-CG1 3.4Å; L334-I338 PolarHBondContact O-N 2.95Å
339	G	89	Confident	90.9	Very high	54 Å²	54	42 Å²	42	56%	0.557	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	73.5	27.1	-172.8	0	0	0	0	0	113.7	T335 K341	T335-G339 VanDerWaalsContact O-CA 3.3Å; T335-G339 WeakPolarHBondContact O-CA 3.48Å; T335-G339 PolarHBondContact O-N 2.8Å; G339-K341 PolarHBondContact O-N 3.21Å
340	S	90.3	Very high	91.1	Very high	9 Å²	9	42.8 Å²	42.8	6%	0.063	22%	0.224	C	C	.	.			trans	-71.6	111.8	-178.9	171	0	0	0	0	111.9	E316 T335 V342 L343 S344	E316-S340 VanDerWaalsContact CD-OG 3.29Å; E316-S340 WeakPolarHBondContact OE1-CB 3.33Å; E316-S340 PolarHBondContact OE1-OG 2.66Å; T335-S340 VanDerWaalsContact CG2-O 3.28Å; T335-S340 WeakPolarHBondContact CG2-O 3.38Å; T335-S340 PolarHBondContact O-N 3.05Å; S340-V342 VanDerWaalsContact C-N 3.31Å; S340-V342 PolarHBondContact OG-N 3.39Å; S340-L343 WeakPolarHBondContact OG-CB 3.32Å; S340-L343 PolarHBondContact OG-N 3.06Å; S340-S344 WeakPolarHBondContact O-CB 3.34Å; S340-S344 PolarHBondContact O-N 3.49Å; S340-S344 VanDerWaalsContact O-N 3.12Å
341	K	90.1	Very high	91.2	Very high	176 Å²	176	40.5 Å²	40.5	77%	0.765	21%	0.208	S	C	*	.	H	α-helix	trans	-66.9	-35.3	173.4	-65.8	-176.6	-179.4	179.2	0	112.3	G339 Q345	G339-K341 PolarHBondContact O-N 3.21Å; K341-Q345 WeakPolarHBondContact O-CB 3.42Å; K341-Q345 PolarHBondContact O-N 3.33Å
342	V	91.6	Very high	91	Very high	31 Å²	31	41.1 Å²	41.1	19%	0.188	21%	0.212	C	C	.	.	H	α-helix	trans	-63.1	-52.1	179.2	163	0	0	0	0	110.8	E316 I320 S340 S344 Q345 G346	E316-V342 HydrophobicContact CB-CB 4.44Å; E316-V342 HydrophobicContact CB-CG1 3.62Å; E316-V342 HydrophobicContact CG-CB 4.41Å; E316-V342 HydrophobicContact CG-CG1 4.12Å; E316-V342 WeakPolarHBondContact OE2-CB 3.35Å; E316-V342 WeakPolarHBondContact OE2-CG1 3.43Å; E316-V342 WeakPolarHBondContact OE2-CG2 3.47Å; I320-V342 HydrophobicContact CD1-CG1 3.93Å; S340-V342 VanDerWaalsContact C-N 3.31Å; S340-V342 PolarHBondContact OG-N 3.39Å; V342-S344 VanDerWaalsContact C-N 3.3Å; V342-S344 PolarHBondContact O-N 3.25Å; V342-Q345 PolarHBondContact O-N 3.46Å; V342-G346 PolarHBondContact O-N 3.01Å
343	L	92.7	Very high	91.2	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-67	-38.6	-177.2	-172.2	57.8	0	0	0	110	L300 E316 L319 I320 L334 T335 S340 Q345 G346 I347	L300-L343 HydrophobicContact CD2-CD2 4.13Å; E316-L343 HydrophobicContact CG-CB 4.45Å; L319-L343 HydrophobicContact CB-CD1 3.98Å; L319-L343 HydrophobicContact CD1-CD2 4.19Å; I320-L343 HydrophobicContact CD1-CD1 4.39Å; I320-L343 HydrophobicContact CG1-CD1 3.63Å; L334-L343 HydrophobicContact CD2-CD2 4.24Å; T335-L343 HydrophobicContact CG2-CB 4.26Å; T335-L343 WeakPolarHBondContact OG1-CD2 3.39Å; T335-L343 WeakPolarHBondContact OG1-CG 3.27Å; S340-L343 WeakPolarHBondContact OG-CB 3.32Å; S340-L343 PolarHBondContact OG-N 3.06Å; L343-Q345 PolarHBondContact O-N 3.14Å; L343-G346 PolarHBondContact O-N 3.41Å; L343-I347 HydrophobicContact CD1-CD1 4.47Å; L343-I347 HydrophobicContact CG-CD1 4.07Å; L343-I347 VanDerWaalsContact O-CG1 3.29Å; L343-I347 WeakPolarHBondContact O-CG1 3.33Å; L343-I347 PolarHBondContact O-N 3.12Å
344	S	91.9	Very high	91.3	Very high	1 Å²	1	45.1 Å²	45.1	1%	0.007	23%	0.231	C	C	.	.	H	α-helix	trans	-53.5	-53	171	-172.9	0	0	0	0	111.6	S340 V342 G346 I347 S348	S340-S344 WeakPolarHBondContact O-CB 3.34Å; S340-S344 PolarHBondContact O-N 3.49Å; S340-S344 VanDerWaalsContact O-N 3.12Å; V342-S344 VanDerWaalsContact C-N 3.3Å; V342-S344 PolarHBondContact O-N 3.25Å; S344-G346 VanDerWaalsContact C-N 3.32Å; S344-G346 PolarHBondContact O-N 3.07Å; S344-I347 PolarHBondContact O-N 3.03Å; S344-S348 PolarHBondContact O-N 2.88Å; S344-S348 PolarHBondContact O-OG 3.15Å
345	Q	91.4	Very high	91.2	Very high	88 Å²	88	52.8 Å²	52.8	41%	0.411	26%	0.26	S	S	.	.	H	α-helix	trans	-62.6	-38.4	178.9	-170	179.4	17.3	0	0	112.3	K341 V342 L343 S348 N349	K341-Q345 WeakPolarHBondContact O-CB 3.42Å; K341-Q345 PolarHBondContact O-N 3.33Å; V342-Q345 PolarHBondContact O-N 3.46Å; L343-Q345 PolarHBondContact O-N 3.14Å; Q345-S348 PolarHBondContact O-N 3.09Å; Q345-N349 WeakPolarHBondContact O-CB 3.39Å; Q345-N349 VanDerWaalsContact O-CG 3.27Å; Q345-N349 PolarHBondContact O-N 2.99Å; Q345-N349 PolarHBondContact O-ND2 3.29Å; Q345-N349 VanDerWaalsContact O-ND2 3.17Å
346	G	93.1	Very high	91.3	Very high	8 Å²	8	58.1 Å²	58.1	8%	0.082	29%	0.285	C	S	.	.	H	α-helix	trans	-62.5	-44	175.3	0	0	0	0	0	112.9	V342 L343 S344 N349 Y350	V342-G346 PolarHBondContact O-N 3.01Å; L343-G346 PolarHBondContact O-N 3.41Å; S344-G346 VanDerWaalsContact C-N 3.32Å; S344-G346 PolarHBondContact O-N 3.07Å; G346-N349 PolarHBondContact O-N 2.94Å; G346-Y350 PolarHBondContact O-N 3.1Å
347	I	92.7	Very high	91.5	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-65.3	-46.3	176	-67.3	166.4	0	0	0	110.6	L323 I328 K331 M332 T335 L343 S344 N349 Y350 I351 I377	L323-I347 HydrophobicContact CD1-CG1 3.92Å; L323-I347 HydrophobicContact CD2-CG1 4Å; I328-I347 HydrophobicContact CD1-CG2 4.2Å; I328-I347 HydrophobicContact CG1-CG2 4.07Å; K331-I347 HydrophobicContact CB-CD1 4.1Å; M332-I347 HydrophobicContact CG-CD1 3.96Å; M332-I347 HydrophobicContact CG-CG2 3.83Å; M332-I347 HydrophobicContact SD-CG2 4.29Å; T335-I347 VanDerWaalsContact OG1-CD1 3.24Å; T335-I347 WeakPolarHBondContact OG1-CD1 3.3Å; L343-I347 HydrophobicContact CD1-CD1 4.47Å; L343-I347 HydrophobicContact CG-CD1 4.07Å; L343-I347 VanDerWaalsContact O-CG1 3.29Å; L343-I347 WeakPolarHBondContact O-CG1 3.33Å; L343-I347 PolarHBondContact O-N 3.12Å; S344-I347 PolarHBondContact O-N 3.03Å; I347-N349 VanDerWaalsContact C-N 3.34Å; I347-N349 PolarHBondContact O-N 3.38Å; I347-Y350 WeakPolarHBondContact O-CB 3.36Å; I347-Y350 PolarHBondContact O-N 3.42Å; I347-Y350 VanDerWaalsContact O-N 3.09Å; I347-I351 HydrophobicContact CG2-CD1 3.88Å; I347-I351 HydrophobicContact CG2-CG1 4.43Å; I347-I351 WeakPolarHBondContact O-CG1 3.33Å; I347-I351 PolarHBondContact O-N 3.37Å; I347-I377 HydrophobicContact CB-CD1 4Å; I347-I377 HydrophobicContact CB-CG1 4.43Å; I347-I377 HydrophobicContact CG2-CD1 3.8Å; I347-I377 HydrophobicContact CG2-CG1 3.69Å
348	S	91.6	Very high	91.5	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-55.6	-48.4	175	-70.1	0	0	0	0	111.7	S344 Q345 Y350 I351 I352 T381	S344-S348 PolarHBondContact O-N 2.88Å; S344-S348 PolarHBondContact O-OG 3.15Å; Q345-S348 PolarHBondContact O-N 3.09Å; S348-Y350 VanDerWaalsContact C-N 3.27Å; S348-Y350 PolarHBondContact O-N 3.31Å; S348-I351 PolarHBondContact O-N 3.33Å; S348-I352 VanDerWaalsContact O-CG1 3.26Å; S348-I352 WeakPolarHBondContact O-CG1 3.4Å; S348-I352 PolarHBondContact O-N 3.4Å; S348-T381 WeakPolarHBondContact CA-OG1 3.26Å; S348-T381 WeakPolarHBondContact CB-OG1 3.49Å; S348-T381 WeakPolarHBondContact OG-CA 3.5Å; S348-T381 PolarHBondContact OG-N 3.09Å; S348-T381 PolarHBondContact OG-OG1 2.94Å
349	N	92.3	Very high	91.5	Very high	71 Å²	71	55.5 Å²	55.5	38%	0.38	28%	0.281	S	S	.	.	H	α-helix	trans	-60.8	-36.3	176.6	-77	-32.8	0	0	0	112.8	Q345 G346 I347 K353	Q345-N349 WeakPolarHBondContact O-CB 3.39Å; Q345-N349 VanDerWaalsContact O-CG 3.27Å; Q345-N349 PolarHBondContact O-N 2.99Å; Q345-N349 PolarHBondContact O-ND2 3.29Å; Q345-N349 VanDerWaalsContact O-ND2 3.17Å; G346-N349 PolarHBondContact O-N 2.94Å; I347-N349 VanDerWaalsContact C-N 3.34Å; I347-N349 PolarHBondContact O-N 3.38Å; N349-K353 WeakPolarHBondContact O-CG 3.37Å; N349-K353 PolarHBondContact O-N 3.15Å
350	Y	93.2	Very high	91.7	Very high	45 Å²	45	53.3 Å²	53.3	18%	0.176	26%	0.257	C	S	.	.	H	α-helix	trans	-65.1	-46.4	174.7	178.3	-90.9	0	0	0	111.6	L323 D324 E325 I328 G346 I347 S348 K353 N354 V357	L323-Y350 HydrophobicContact CB-CD2 3.79Å; L323-Y350 HydrophobicContact CB-CE2 4.13Å; L323-Y350 HydrophobicContact CB-CG 4.02Å; L323-Y350 HydrophobicContact CD1-CG 4.28Å; L323-Y350 VanDerWaalsContact O-CE2 3.27Å; L323-Y350 WeakPolarHBondContact O-CE2 3.48Å; D324-Y350 WeakPolarHBondContact CA-OH 3.33Å; E325-Y350 PolarHBondContact N-OH 3.48Å; I328-Y350 HydrophobicContact CD1-CD1 3.84Å; I328-Y350 HydrophobicContact CD1-CE1 4.1Å; G346-Y350 PolarHBondContact O-N 3.1Å; I347-Y350 WeakPolarHBondContact O-CB 3.36Å; I347-Y350 PolarHBondContact O-N 3.42Å; I347-Y350 VanDerWaalsContact O-N 3.09Å; S348-Y350 VanDerWaalsContact C-N 3.27Å; S348-Y350 PolarHBondContact O-N 3.31Å; Y350-K353 PolarHBondContact O-N 3.01Å; Y350-N354 HydrophobicContact CE1-CB 4.21Å; Y350-N354 WeakPolarHBondContact CE2-ND2 3.4Å; Y350-N354 WeakPolarHBondContact O-CB 3.38Å; Y350-N354 PolarHBondContact O-N 3.03Å; Y350-N354 PolarHBondContact O-ND2 2.86Å; Y350-V357 HydrophobicContact CE1-CG2 4.03Å
351	I	92.1	Very high	91.8	Very high	4 Å²	4	58.8 Å²	58.8	2%	0.021	29%	0.286	C	S	.	.	H	α-helix	trans	-62.5	-44.3	178.5	-66.2	168	0	0	0	111.2	I328 I347 S348 K353 N354 R355 L358 W363 I377 T381	I328-I351 HydrophobicContact CD1-CD1 4Å; I328-I351 HydrophobicContact CD1-CG1 3.6Å; I347-I351 HydrophobicContact CG2-CD1 3.88Å; I347-I351 HydrophobicContact CG2-CG1 4.43Å; I347-I351 WeakPolarHBondContact O-CG1 3.33Å; I347-I351 PolarHBondContact O-N 3.37Å; S348-I351 PolarHBondContact O-N 3.33Å; I351-K353 PolarHBondContact O-N 2.79Å; I351-N354 CarbonylContact O-C 3.3Å; I351-N354 PolarHBondContact O-N 3.46Å; I351-N354 VanDerWaalsContact O-N 3.12Å; I351-R355 WeakPolarHBondContact O-CA 3.43Å; I351-R355 PolarHBondContact O-N 3.34Å; I351-R355 VanDerWaalsContact O-N 3.09Å; I351-L358 HydrophobicContact CG2-CD1 4.35Å; I351-L358 HydrophobicContact CG2-CD2 3.82Å; I351-L358 HydrophobicContact CG2-CG 4.11Å; I351-W363 HydrophobicContact CD1-CH2 3.82Å; I351-W363 HydrophobicContact CD1-CZ3 3.69Å; I351-W363 HydrophobicContact CG1-CZ3 4.39Å; I351-I377 HydrophobicContact CD1-CG1 4.1Å; I351-I377 HydrophobicContact CD1-CG2 4.22Å; I351-T381 HydrophobicContact CG2-CG2 4.48Å
352	I	90.2	Very high	91.7	Very high	40 Å²	40	52.6 Å²	52.6	21%	0.205	26%	0.262	C	S	.	.	H	α-helix	trans	-58.5	-39.7	179.3	-68.2	168.4	0	0	0	111.1	S348 R355 T381 L385	S348-I352 VanDerWaalsContact O-CG1 3.26Å; S348-I352 WeakPolarHBondContact O-CG1 3.4Å; S348-I352 PolarHBondContact O-N 3.4Å; I352-R355 WeakPolarHBondContact O-CG 3.44Å; I352-R355 PolarHBondContact O-NE 3.43Å; I352-T381 HydrophobicContact CD1-CG2 3.92Å; I352-T381 HydrophobicContact CG1-CG2 3.55Å; I352-L385 HydrophobicContact CD1-CD2 3.91Å; I352-L385 HydrophobicContact CD1-CG 4.19Å; I352-L385 HydrophobicContact CG1-CD2 3.96Å; I352-L385 HydrophobicContact CG1-CG 4.42Å; I352-L385 HydrophobicContact CG2-CD2 4.02Å
353	K	91.7	Very high	91.6	Very high	168 Å²	168	51.2 Å²	51.2	73%	0.73	25%	0.254	S	S	*	.	H	α-helix	trans	-77.8	-29	178	-69.7	177.1	-176.6	178.6	0	113	N349 Y350 I351	N349-K353 WeakPolarHBondContact O-CG 3.37Å; N349-K353 PolarHBondContact O-N 3.15Å; Y350-K353 PolarHBondContact O-N 3.01Å; I351-K353 PolarHBondContact O-N 2.79Å
354	N	92.6	Very high	91.6	Very high	44 Å²	44	56 Å²	56	24%	0.235	28%	0.275	C	S	.	.			trans	-121.2	54.6	-175	-61.1	-78.1	0	0	0	111.2	Y350 I351 Q356 V357	Y350-N354 HydrophobicContact CE1-CB 4.21Å; Y350-N354 WeakPolarHBondContact CE2-ND2 3.4Å; Y350-N354 WeakPolarHBondContact O-CB 3.38Å; Y350-N354 PolarHBondContact O-N 3.03Å; Y350-N354 PolarHBondContact O-ND2 2.86Å; I351-N354 CarbonylContact O-C 3.3Å; I351-N354 PolarHBondContact O-N 3.46Å; I351-N354 VanDerWaalsContact O-N 3.12Å; N354-Q356 VanDerWaalsContact CA-OE1 3.25Å; N354-Q356 PolarHBondContact O-N 3.29Å; N354-Q356 PolarHBondContact O-OE1 3.35Å; N354-Q356 PolarHBondContact OD1-NE2 3.37Å; N354-V357 HydrophobicContact CB-CG2 3.95Å; N354-V357 VanDerWaalsContact O-CB 3.3Å; N354-V357 WeakPolarHBondContact O-CB 3.3Å; N354-V357 VanDerWaalsContact O-CG2 3.26Å; N354-V357 WeakPolarHBondContact O-CG2 3.26Å; N354-V357 PolarHBondContact O-N 3.38Å
355	R	90.5	Very high	91.5	Very high	165 Å²	165	61.7 Å²	61.7	62%	0.623	30%	0.299	S	S	*	.	G	3₁₀ helix	trans	-55.5	-25.6	-173.1	-60.9	-176.3	-178.1	-172.5	-4	114.1	I351 I352 V357 L358	I351-R355 WeakPolarHBondContact O-CA 3.43Å; I351-R355 PolarHBondContact O-N 3.34Å; I351-R355 VanDerWaalsContact O-N 3.09Å; I352-R355 WeakPolarHBondContact O-CG 3.44Å; I352-R355 PolarHBondContact O-NE 3.43Å; R355-V357 PolarHBondContact O-N 3.45Å; R355-V357 VanDerWaalsContact O-N 3.16Å; R355-L358 WeakPolarHBondContact O-CB 3.5Å; R355-L358 PolarHBondContact O-N 2.98Å; R355-L358 VanDerWaalsContact O-N 3.11Å
356	Q	92.3	Very high	91.4	Very high	112 Å²	112	58.1 Å²	58.1	52%	0.523	28%	0.283	S	S	.	.	G	3₁₀ helix	trans	-57.4	-24.7	175	70.1	-78.4	3.2	0	0	113.4	N354 L358 S359 S360	N354-Q356 VanDerWaalsContact CA-OE1 3.25Å; N354-Q356 PolarHBondContact O-N 3.29Å; N354-Q356 PolarHBondContact O-OE1 3.35Å; N354-Q356 PolarHBondContact OD1-NE2 3.37Å; Q356-L358 PolarHBondContact O-N 3.19Å; Q356-S359 PolarHBondContact O-N 3.08Å; Q356-S360 PolarHBondContact O-N 3.21Å
357	V	91.8	Very high	91.3	Very high	0 Å²	0	61.9 Å²	61.9	0%	0	30%	0.298	C	S	.	.	G	3₁₀ helix	trans	-59.2	-33.2	176.4	172.2	0	0	0	0	111.2	E325 I328 Y350 N354 R355 S359 S360 W363	E325-V357 HydrophobicContact CB-CG2 4.25Å; E325-V357 HydrophobicContact CG-CG1 4.5Å; E325-V357 HydrophobicContact CG-CG2 4.23Å; I328-V357 HydrophobicContact CD1-CG1 3.99Å; I328-V357 HydrophobicContact CG2-CG1 4.23Å; Y350-V357 HydrophobicContact CE1-CG2 4.03Å; N354-V357 HydrophobicContact CB-CG2 3.95Å; N354-V357 VanDerWaalsContact O-CB 3.3Å; N354-V357 WeakPolarHBondContact O-CB 3.3Å; N354-V357 VanDerWaalsContact O-CG2 3.26Å; N354-V357 WeakPolarHBondContact O-CG2 3.26Å; N354-V357 PolarHBondContact O-N 3.38Å; R355-V357 PolarHBondContact O-N 3.45Å; R355-V357 VanDerWaalsContact O-N 3.16Å; V357-S359 PolarHBondContact O-N 2.96Å; V357-S359 VanDerWaalsContact O-N 3.16Å; V357-S360 VanDerWaalsContact O-CB 3.24Å; V357-S360 WeakPolarHBondContact O-CB 3.5Å; V357-S360 PolarHBondContact O-N 2.92Å; V357-S360 PolarHBondContact O-OG 2.9Å; V357-W363 HydrophobicContact CG1-CE3 4.17Å; V357-W363 WeakPolarHBondContact O-CB 3.23Å
358	L	89.3	Confident	91.2	Very high	63 Å²	63	67 Å²	67	33%	0.33	33%	0.33	S	S	.	.	G	3₁₀ helix	trans	-63.1	-21.1	177	-60.4	177.8	0	0	0	113	I351 R355 Q356 W363 L378	I351-L358 HydrophobicContact CG2-CD1 4.35Å; I351-L358 HydrophobicContact CG2-CD2 3.82Å; I351-L358 HydrophobicContact CG2-CG 4.11Å; R355-L358 WeakPolarHBondContact O-CB 3.5Å; R355-L358 PolarHBondContact O-N 2.98Å; R355-L358 VanDerWaalsContact O-N 3.11Å; Q356-L358 PolarHBondContact O-N 3.19Å; L358-W363 HydrophobicContact CD2-CD2 3.85Å; L358-W363 VanDerWaalsContact CD2-CE2 3.43Å; L358-W363 HydrophobicContact CD2-CE3 4.13Å; L358-W363 HydrophobicContact CD2-CH2 3.69Å; L358-W363 HydrophobicContact CD2-CZ2 3.36Å; L358-W363 HydrophobicContact CD2-CZ3 4.06Å; L358-W363 VanDerWaalsContact O-CD1 3.22Å; L358-L378 HydrophobicContact CD2-CD2 4.09Å
359	S	91.3	Very high	91.1	Very high	86 Å²	86	73.5 Å²	73.5	60%	0.601	36%	0.36	S	S	*	.	G	3₁₀ helix	trans	-97.5	-3.1	177.1	-59.2	0	0	0	0	113.2	Q356 V357 K364	Q356-S359 PolarHBondContact O-N 3.08Å; V357-S359 PolarHBondContact O-N 2.96Å; V357-S359 VanDerWaalsContact O-N 3.16Å; S359-K364 VanDerWaalsContact O-CE 3.26Å; S359-K364 WeakPolarHBondContact O-CE 3.43Å; S359-K364 PolarHBondContact O-NZ 2.93Å
360	S	92.5	Very high	90.9	Very high	8 Å²	8	72.2 Å²	72.2	6%	0.056	35%	0.353	C	S	.	.	S	Bend	trans	-68.8	154.4	-177.9	68.8	0	0	0	0	112.3	E325 Q356 V357 V362 W363 K364	E325-S360 WeakPolarHBondContact OE1-CB 3.36Å; Q356-S360 PolarHBondContact O-N 3.21Å; V357-S360 VanDerWaalsContact O-CB 3.24Å; V357-S360 WeakPolarHBondContact O-CB 3.5Å; V357-S360 PolarHBondContact O-N 2.92Å; V357-S360 PolarHBondContact O-OG 2.9Å; S360-V362 PolarHBondContact O-N 3.29Å; S360-W363 PolarHBondContact O-N 3.47Å; S360-W363 VanDerWaalsContact OG-CB 3.25Å; S360-W363 WeakPolarHBondContact OG-CB 3.35Å; S360-W363 PolarHBondContact OG-N 2.85Å; S360-K364 WeakPolarHBondContact O-CG 3.44Å; S360-K364 PolarHBondContact O-N 3.27Å
361	D	92.2	Very high	90.7	Very high	125 Å²	125	73.7 Å²	73.7	67%	0.668	37%	0.368	S	S	*	.	H	α-helix	trans	-67.3	-28.6	174.4	-63.7	-28.3	0	0	0	111.7	K364 K365	D361-K364 IonicContact OD1-NZ 3.3Å; D361-K364 PolarHBondContact OD1-NZ 3.12Å; D361-K365 VanDerWaalsContact O-CB 3.22Å; D361-K365 WeakPolarHBondContact O-CB 3.25Å; D361-K365 PolarHBondContact O-N 3.3Å
362	V	89.7	Confident	90.5	Very high	45 Å²	45	76.9 Å²	76.9	27%	0.273	39%	0.391	S	S	.	.	H	α-helix	trans	-62.3	-45.1	172.9	-178.2	0	0	0	0	110.5	E325 A329 S360 M366	E325-V362 WeakPolarHBondContact O-CG1 3.24Å; A329-V362 HydrophobicContact CB-CG1 4.18Å; S360-V362 PolarHBondContact O-N 3.29Å; V362-M366 WeakPolarHBondContact O-CB 3.35Å; V362-M366 PolarHBondContact O-N 3.36Å
363	W	89.3	Confident	90.2	Very high	2 Å²	2	75.1 Å²	75.1	1%	0.008	38%	0.382	C	S	.	.	H	α-helix	trans	-68	-47.9	179	-173.6	-86.1	0	0	0	112.5	I328 M332 I351 V357 L358 S360 K365 M366 E367 T374 I377 L378	I328-W363 HydrophobicContact CD1-CZ3 4.45Å; M332-W363 HydrophobicContact CE-CH2 4.41Å; M332-W363 HydrophobicContact CE-CZ3 4.46Å; M332-W363 HydrophobicContact SD-CH2 4.35Å; M332-W363 HydrophobicContact SD-CZ3 3.9Å; I351-W363 HydrophobicContact CD1-CH2 3.82Å; I351-W363 HydrophobicContact CD1-CZ3 3.69Å; I351-W363 HydrophobicContact CG1-CZ3 4.39Å; V357-W363 HydrophobicContact CG1-CE3 4.17Å; V357-W363 WeakPolarHBondContact O-CB 3.23Å; L358-W363 HydrophobicContact CD2-CD2 3.85Å; L358-W363 VanDerWaalsContact CD2-CE2 3.43Å; L358-W363 HydrophobicContact CD2-CE3 4.13Å; L358-W363 HydrophobicContact CD2-CH2 3.69Å; L358-W363 HydrophobicContact CD2-CZ2 3.36Å; L358-W363 HydrophobicContact CD2-CZ3 4.06Å; L358-W363 VanDerWaalsContact O-CD1 3.22Å; S360-W363 PolarHBondContact O-N 3.47Å; S360-W363 VanDerWaalsContact OG-CB 3.25Å; S360-W363 WeakPolarHBondContact OG-CB 3.35Å; S360-W363 PolarHBondContact OG-N 2.85Å; W363-K365 VanDerWaalsContact C-N 3.26Å; W363-K365 PolarHBondContact O-N 3.18Å; W363-M366 HydrophobicContact CD2-CE 3.67Å; W363-M366 HydrophobicContact CE3-CE 3.3Å; W363-M366 HydrophobicContact CG-CE 4.41Å; W363-M366 HydrophobicContact CH2-CE 3.9Å; W363-M366 HydrophobicContact CZ2-CE 4.2Å; W363-M366 HydrophobicContact CZ3-CE 3.44Å; W363-M366 VanDerWaalsContact CZ3-CE 3.44Å; W363-M366 WeakPolarHBondContact O-CA 3.44Å; W363-M366 WeakPolarHBondContact O-CB 3.24Å; W363-M366 PolarHBondContact O-N 2.97Å; W363-E367 PolarHBondContact NE1-OE1 3.32Å; W363-E367 PolarHBondContact O-N 3.02Å; W363-T374 HydrophobicContact CH2-CG2 4.18Å; W363-T374 HydrophobicContact CZ2-CG2 3.47Å; W363-T374 VanDerWaalsContact CZ2-CG2 3.47Å; W363-I377 HydrophobicContact CH2-CG2 3.66Å; W363-I377 HydrophobicContact CZ3-CG2 4.42Å; W363-L378 HydrophobicContact CH2-CD2 4.17Å; W363-L378 HydrophobicContact CH2-CG 4.36Å; W363-L378 HydrophobicContact CZ2-CD1 4.13Å; W363-L378 HydrophobicContact CZ2-CD2 3.76Å; W363-L378 HydrophobicContact CZ2-CG 3.88Å
364	K	91.4	Very high	90	Very high	102 Å²	102	67.3 Å²	67.3	44%	0.443	35%	0.349	S	S	.	.	H	α-helix	trans	-57.4	-41.1	176.3	-68.2	171.7	-165.2	154.4	0	111.9	S359 S360 D361 M366 E367 T368	S359-K364 VanDerWaalsContact O-CE 3.26Å; S359-K364 WeakPolarHBondContact O-CE 3.43Å; S359-K364 PolarHBondContact O-NZ 2.93Å; S360-K364 WeakPolarHBondContact O-CG 3.44Å; S360-K364 PolarHBondContact O-N 3.27Å; D361-K364 IonicContact OD1-NZ 3.3Å; D361-K364 PolarHBondContact OD1-NZ 3.12Å; K364-M366 VanDerWaalsContact C-N 3.34Å; K364-E367 PolarHBondContact O-N 3.4Å; K364-T368 PolarHBondContact O-N 3.48Å
365	K	91.3	Very high	89.8	Confident	119 Å²	119	68 Å²	68	52%	0.517	36%	0.361	S	S	.	.	H	α-helix	trans	-61.5	-45	175.3	-177.7	177.9	175.6	-177.1	0	110.9	D361 W363 E367 T368 E369	D361-K365 VanDerWaalsContact O-CB 3.22Å; D361-K365 WeakPolarHBondContact O-CB 3.25Å; D361-K365 PolarHBondContact O-N 3.3Å; W363-K365 VanDerWaalsContact C-N 3.26Å; W363-K365 PolarHBondContact O-N 3.18Å; K365-E367 PolarHBondContact O-N 3.13Å; K365-T368 PolarHBondContact O-N 3.02Å; K365-T368 VanDerWaalsContact O-N 3.09Å; K365-T368 PolarHBondContact O-OG1 3.42Å; K365-E369 WeakPolarHBondContact CE-OE1 3.33Å; K365-E369 VanDerWaalsContact CE-OE2 3.27Å; K365-E369 WeakPolarHBondContact CE-OE2 2.94Å; K365-E369 HydrophobicContact CG-CG 4.29Å; K365-E369 IonicContact NZ-OE1 2.77Å; K365-E369 PolarHBondContact O-N 3.37Å
366	M	88.8	Confident	89.5	Confident	13 Å²	13	64 Å²	64	6%	0.064	35%	0.348	C	S	.	.	H	α-helix	trans	-64.5	-37	178.2	-173.3	-177.7	58.6	0	0	113	A329 M332 V362 W363 K364 T368 E369 D370 T374	A329-M366 VanDerWaalsContact CA-SD 3.57Å; A329-M366 HydrophobicContact CB-CB 4.33Å; A329-M366 HydrophobicContact CB-CG 4.18Å; A329-M366 HydrophobicContact CB-SD 3.58Å; A329-M366 VanDerWaalsContact CB-SD 3.58Å; M332-M366 HydrophobicContact CE-CE 3.48Å; M332-M366 VanDerWaalsContact CE-CE 3.48Å; M332-M366 HydrophobicContact CE-SD 3.5Å; M332-M366 WeakPolarHBondContact CE-SD 3.48Å; M332-M366 HydrophobicContact SD-CE 3.63Å; M332-M366 HydrophobicContact SD-SD 3.68Å; M332-M366 VanDerWaalsContact SD-SD 3.68Å; V362-M366 WeakPolarHBondContact O-CB 3.35Å; V362-M366 PolarHBondContact O-N 3.36Å; W363-M366 HydrophobicContact CD2-CE 3.67Å; W363-M366 HydrophobicContact CE3-CE 3.3Å; W363-M366 HydrophobicContact CG-CE 4.41Å; W363-M366 HydrophobicContact CH2-CE 3.9Å; W363-M366 HydrophobicContact CZ2-CE 4.2Å; W363-M366 HydrophobicContact CZ3-CE 3.44Å; W363-M366 VanDerWaalsContact CZ3-CE 3.44Å; W363-M366 WeakPolarHBondContact O-CA 3.44Å; W363-M366 WeakPolarHBondContact O-CB 3.24Å; W363-M366 PolarHBondContact O-N 2.97Å; K364-M366 VanDerWaalsContact C-N 3.34Å; M366-T368 PolarHBondContact O-N 3.49Å; M366-E369 PolarHBondContact O-N 2.62Å; M366-D370 CarbonylContact O-C 3.46Å; M366-D370 VanDerWaalsContact O-C 3.3Å; M366-D370 PolarHBondContact O-N 2.9Å; M366-T374 HydrophobicContact CE-CG2 4.17Å; M366-T374 PolarHBondContact O-OG1 2.87Å
367	E	89.7	Confident	89.2	Confident	88 Å²	88	58.8 Å²	58.8	41%	0.411	32%	0.324	S	S	.	.	H	α-helix	trans	-57.9	-31.2	172.8	-76.3	177.3	162	0	0	112.2	W363 K364 K365 P371 T374	W363-E367 PolarHBondContact NE1-OE1 3.32Å; W363-E367 PolarHBondContact O-N 3.02Å; K364-E367 PolarHBondContact O-N 3.4Å; K365-E367 PolarHBondContact O-N 3.13Å; E367-P371 VanDerWaalsContact O-CG 3.3Å; E367-P371 WeakPolarHBondContact O-CG 3.27Å; E367-T374 HydrophobicContact CG-CG2 3.75Å
368	T	91.4	Very high	89	Confident	108 Å²	108	61.4 Å²	61.4	66%	0.663	34%	0.337	S	S	*	.	H	α-helix	trans	-86.5	-38	176.8	62	0	0	0	0	113.6	K364 K365 M366	K364-T368 PolarHBondContact O-N 3.48Å; K365-T368 PolarHBondContact O-N 3.02Å; K365-T368 VanDerWaalsContact O-N 3.09Å; K365-T368 PolarHBondContact O-OG1 3.42Å; M366-T368 PolarHBondContact O-N 3.49Å
369	E	89.8	Confident	88.8	Confident	136 Å²	136	65 Å²	65	64%	0.636	35%	0.35	S	S	*	.	H	α-helix	trans	-86.1	-38	-173.8	-70.7	-175.8	167.2	0	0	113.6	K365 M366	K365-E369 WeakPolarHBondContact CE-OE1 3.33Å; K365-E369 VanDerWaalsContact CE-OE2 3.27Å; K365-E369 WeakPolarHBondContact CE-OE2 2.94Å; K365-E369 HydrophobicContact CG-CG 4.29Å; K365-E369 IonicContact NZ-OE1 2.77Å; K365-E369 PolarHBondContact O-N 3.37Å; M366-E369 PolarHBondContact O-N 2.62Å
370	D	87.9	Confident	88.3	Confident	43 Å²	43	63.3 Å²	63.3	23%	0.23	33%	0.333	C	S	.	.			trans	-137.4	75.7	172.4	-166.4	-14.1	0	0	0	110.9	K336 M366 S372 A373 T374	K336-D370 IonicContact NZ-OD1 3.8Å; K336-D370 PolarHBondContact NZ-OD1 3.34Å; K336-D370 VanDerWaalsContact NZ-OD1 3.15Å; K336-D370 IonicContact NZ-OD2 3.73Å; K336-D370 PolarHBondContact NZ-OD2 3.19Å; M366-D370 CarbonylContact O-C 3.46Å; M366-D370 VanDerWaalsContact O-C 3.3Å; M366-D370 PolarHBondContact O-N 2.9Å; D370-S372 PolarHBondContact O-N 3.25Å; D370-S372 PolarHBondContact OD1-N 2.99Å; D370-A373 HydrophobicContact CB-CB 4.09Å; D370-A373 PolarHBondContact O-N 3.4Å; D370-A373 PolarHBondContact OD1-N 3.44Å; D370-A373 VanDerWaalsContact OD2-CB 3.23Å; D370-A373 WeakPolarHBondContact OD2-CB 2.77Å; D370-T374 PolarHBondContact O-N 3.31Å; D370-T374 VanDerWaalsContact O-N 3.13Å; D370-T374 PolarHBondContact O-OG1 3.01Å
371	P	88.8	Confident	87.9	Confident	76 Å²	76	63.3 Å²	63.3	49%	0.494	33%	0.333	S	S	.	.	H	α-helix	trans	-58.3	-30.5	176.5	-16.6	23.8	0	0	0	112.4	E367 T374 A375	E367-P371 VanDerWaalsContact O-CG 3.3Å; E367-P371 WeakPolarHBondContact O-CG 3.27Å; P371-T374 PolarHBondContact O-N 3.06Å; P371-A375 VanDerWaalsContact O-CB 3.3Å; P371-A375 WeakPolarHBondContact O-CB 3.24Å; P371-A375 PolarHBondContact O-N 2.98Å
372	S	87.3	Confident	87.4	Confident	71 Å²	71	62.8 Å²	62.8	50%	0.497	33%	0.328	S	S	.	.	H	α-helix	trans	-70.4	-44.9	-178.4	168.1	0	0	0	0	111.9	K336 D370 T374 F376	K336-S372 PolarHBondContact NZ-OG 2.92Å; K336-S372 VanDerWaalsContact NZ-OG 3.1Å; D370-S372 PolarHBondContact O-N 3.25Å; D370-S372 PolarHBondContact OD1-N 2.99Å; S372-T374 VanDerWaalsContact C-N 3.3Å; S372-F376 WeakPolarHBondContact O-CB 3.11Å; S372-F376 PolarHBondContact O-N 2.65Å
373	A	84	Confident	86.9	Confident	3 Å²	3	66.1 Å²	66.1	3%	0.025	34%	0.344	C	S	.	.	H	α-helix	trans	-64.4	-38.9	174.2	0	0	0	0	0	111.5	K336 D370 F376 I377	K336-A373 HydrophobicContact CD-CB 3.87Å; D370-A373 HydrophobicContact CB-CB 4.09Å; D370-A373 PolarHBondContact O-N 3.4Å; D370-A373 PolarHBondContact OD1-N 3.44Å; D370-A373 VanDerWaalsContact OD2-CB 3.23Å; D370-A373 WeakPolarHBondContact OD2-CB 2.77Å; A373-F376 WeakPolarHBondContact O-CB 3.41Å; A373-F376 PolarHBondContact O-N 3.27Å; A373-I377 PolarHBondContact O-N 3.04Å
374	T	87.3	Confident	85.9	Confident	4 Å²	4	69.9 Å²	69.9	3%	0.025	36%	0.362	C	S	.	.	H	α-helix	trans	-64.8	-46.9	177.6	-50	0	0	0	0	111.9	W363 M366 E367 D370 P371 S372 F376 I377 L378	W363-T374 HydrophobicContact CH2-CG2 4.18Å; W363-T374 HydrophobicContact CZ2-CG2 3.47Å; W363-T374 VanDerWaalsContact CZ2-CG2 3.47Å; M366-T374 HydrophobicContact CE-CG2 4.17Å; M366-T374 PolarHBondContact O-OG1 2.87Å; E367-T374 HydrophobicContact CG-CG2 3.75Å; D370-T374 PolarHBondContact O-N 3.31Å; D370-T374 VanDerWaalsContact O-N 3.13Å; D370-T374 PolarHBondContact O-OG1 3.01Å; P371-T374 PolarHBondContact O-N 3.06Å; S372-T374 VanDerWaalsContact C-N 3.3Å; T374-F376 VanDerWaalsContact C-N 3.32Å; T374-F376 PolarHBondContact O-N 3.11Å; T374-I377 WeakPolarHBondContact O-CG2 3.22Å; T374-I377 PolarHBondContact O-N 3.02Å; T374-L378 HydrophobicContact CG2-CD1 4.12Å; T374-L378 WeakPolarHBondContact O-CB 3.47Å; T374-L378 WeakPolarHBondContact O-CG 3.25Å; T374-L378 PolarHBondContact O-N 3.23Å
375	A	88.4	Confident	84.7	Confident	59 Å²	59	72.4 Å²	72.4	49%	0.488	38%	0.379	S	S	.	.	H	α-helix	trans	-62.1	-39.6	175.3	0	0	0	0	0	112.3	P371 L378 K379	P371-A375 VanDerWaalsContact O-CB 3.3Å; P371-A375 WeakPolarHBondContact O-CB 3.24Å; P371-A375 PolarHBondContact O-N 2.98Å; A375-L378 PolarHBondContact O-N 3.09Å; A375-K379 WeakPolarHBondContact O-CB 3.42Å; A375-K379 PolarHBondContact O-N 2.87Å
376	F	85.4	Confident	84.3	Confident	82 Å²	82	70.1 Å²	70.1	36%	0.36	37%	0.372	S	S	.	.	H	α-helix	trans	-58.2	-53.6	175.8	172.8	-99.2	0	0	0	111.3	S372 A373 T374 L378 K379 E380	S372-F376 WeakPolarHBondContact O-CB 3.11Å; S372-F376 PolarHBondContact O-N 2.65Å; A373-F376 WeakPolarHBondContact O-CB 3.41Å; A373-F376 PolarHBondContact O-N 3.27Å; T374-F376 VanDerWaalsContact C-N 3.32Å; T374-F376 PolarHBondContact O-N 3.11Å; F376-L378 VanDerWaalsContact C-N 3.35Å; F376-L378 PolarHBondContact O-N 3.01Å; F376-K379 PolarHBondContact O-N 3.16Å; F376-E380 HydrophobicContact CE1-CG 4.21Å; F376-E380 HydrophobicContact CE2-CG 4.16Å; F376-E380 HydrophobicContact CZ-CG 3.98Å; F376-E380 WeakPolarHBondContact O-CG 3.42Å; F376-E380 PolarHBondContact O-N 3.16Å
377	I	85.5	Confident	84.1	Confident	2 Å²	2	73.1 Å²	73.1	1%	0.01	39%	0.388	C	S	.	.	H	α-helix	trans	-68.2	-35.3	-177.6	-155.4	64.7	0	0	0	112.3	M332 I347 I351 W363 A373 T374 K379 E380 T381	M332-I377 HydrophobicContact CE-CB 3.67Å; M332-I377 HydrophobicContact CE-CG1 4.38Å; M332-I377 HydrophobicContact CE-CG2 3.15Å; M332-I377 HydrophobicContact CG-CG1 4.36Å; M332-I377 HydrophobicContact SD-CB 4.24Å; M332-I377 HydrophobicContact SD-CG1 4.31Å; M332-I377 HydrophobicContact SD-CG2 3.76Å; I347-I377 HydrophobicContact CB-CD1 4Å; I347-I377 HydrophobicContact CB-CG1 4.43Å; I347-I377 HydrophobicContact CG2-CD1 3.8Å; I347-I377 HydrophobicContact CG2-CG1 3.69Å; I351-I377 HydrophobicContact CD1-CG1 4.1Å; I351-I377 HydrophobicContact CD1-CG2 4.22Å; W363-I377 HydrophobicContact CH2-CG2 3.66Å; W363-I377 HydrophobicContact CZ3-CG2 4.42Å; A373-I377 PolarHBondContact O-N 3.04Å; T374-I377 WeakPolarHBondContact O-CG2 3.22Å; T374-I377 PolarHBondContact O-N 3.02Å; I377-K379 VanDerWaalsContact C-N 3.33Å; I377-E380 PolarHBondContact O-N 3.5Å; I377-T381 VanDerWaalsContact O-CB 3.25Å; I377-T381 WeakPolarHBondContact O-CB 3.48Å; I377-T381 PolarHBondContact O-N 3.36Å; I377-T381 PolarHBondContact O-OG1 3Å
378	L	86.9	Confident	83.8	Confident	54 Å²	54	72.2 Å²	72.2	28%	0.283	39%	0.387	S	S	.	.	H	α-helix	trans	-66	-40.9	178.6	-76	176.1	0	0	0	110.6	L358 W363 T374 A375 F376 T381 I382	L358-L378 HydrophobicContact CD2-CD2 4.09Å; W363-L378 HydrophobicContact CH2-CD2 4.17Å; W363-L378 HydrophobicContact CH2-CG 4.36Å; W363-L378 HydrophobicContact CZ2-CD1 4.13Å; W363-L378 HydrophobicContact CZ2-CD2 3.76Å; W363-L378 HydrophobicContact CZ2-CG 3.88Å; T374-L378 HydrophobicContact CG2-CD1 4.12Å; T374-L378 WeakPolarHBondContact O-CB 3.47Å; T374-L378 WeakPolarHBondContact O-CG 3.25Å; T374-L378 PolarHBondContact O-N 3.23Å; A375-L378 PolarHBondContact O-N 3.09Å; F376-L378 VanDerWaalsContact C-N 3.35Å; F376-L378 PolarHBondContact O-N 3.01Å; L378-T381 PolarHBondContact O-N 3.46Å; L378-I382 WeakPolarHBondContact O-CB 3.38Å; L378-I382 WeakPolarHBondContact O-CD1 3.3Å; L378-I382 VanDerWaalsContact O-CG1 3.24Å; L378-I382 WeakPolarHBondContact O-CG1 3.3Å; L378-I382 PolarHBondContact O-N 2.98Å
379	K	85.9	Confident	83.3	Confident	139 Å²	139	70.1 Å²	70.1	60%	0.604	37%	0.371	S	S	*	.	H	α-helix	trans	-60.1	-49.3	173.3	-177.5	-178.9	175.9	-175.2	0	111.3	A375 F376 I377 T381 I382 L383	A375-K379 WeakPolarHBondContact O-CB 3.42Å; A375-K379 PolarHBondContact O-N 2.87Å; F376-K379 PolarHBondContact O-N 3.16Å; I377-K379 VanDerWaalsContact C-N 3.33Å; K379-T381 VanDerWaalsContact C-N 3.31Å; K379-T381 PolarHBondContact O-N 2.68Å; K379-I382 PolarHBondContact O-N 2.89Å; K379-L383 HydrophobicContact CG-CD1 4.48Å; K379-L383 WeakPolarHBondContact O-CG 3.26Å; K379-L383 PolarHBondContact O-N 3.39Å; K379-L383 VanDerWaalsContact O-N 3.08Å
380	E	81.2	Confident	82.9	Confident	50 Å²	50	66 Å²	66	23%	0.234	35%	0.354	C	S	.	.	H	α-helix	trans	-60	-41.9	176.4	-69.2	-65.8	125.1	0	0	111.5	F376 I377 I382 L383 H384	F376-E380 HydrophobicContact CE1-CG 4.21Å; F376-E380 HydrophobicContact CE2-CG 4.16Å; F376-E380 HydrophobicContact CZ-CG 3.98Å; F376-E380 WeakPolarHBondContact O-CG 3.42Å; F376-E380 PolarHBondContact O-N 3.16Å; I377-E380 PolarHBondContact O-N 3.5Å; E380-I382 PolarHBondContact O-N 3.3Å; E380-L383 PolarHBondContact O-N 2.92Å; E380-H384 PolarHBondContact O-CD2 3.3Å; E380-H384 PolarHBondContact O-N 3.22Å
381	T	83.5	Confident	82.6	Confident	9 Å²	9	67.5 Å²	67.5	6%	0.055	36%	0.363	C	S	.	.	H	α-helix	trans	-64.8	-40.2	179	-54.2	0	0	0	0	112	S348 I351 I352 I377 L378 K379 H384 L385	S348-T381 WeakPolarHBondContact CA-OG1 3.26Å; S348-T381 WeakPolarHBondContact CB-OG1 3.49Å; S348-T381 WeakPolarHBondContact OG-CA 3.5Å; S348-T381 PolarHBondContact OG-N 3.09Å; S348-T381 PolarHBondContact OG-OG1 2.94Å; I351-T381 HydrophobicContact CG2-CG2 4.48Å; I352-T381 HydrophobicContact CD1-CG2 3.92Å; I352-T381 HydrophobicContact CG1-CG2 3.55Å; I377-T381 VanDerWaalsContact O-CB 3.25Å; I377-T381 WeakPolarHBondContact O-CB 3.48Å; I377-T381 PolarHBondContact O-N 3.36Å; I377-T381 PolarHBondContact O-OG1 3Å; L378-T381 PolarHBondContact O-N 3.46Å; K379-T381 VanDerWaalsContact C-N 3.31Å; K379-T381 PolarHBondContact O-N 2.68Å; T381-H384 PolarHBondContact O-N 3.46Å; T381-L385 PolarHBondContact O-N 3.3Å
382	I	83.2	Confident	82.2	Confident	113 Å²	113	66.9 Å²	66.9	58%	0.579	35%	0.353	S	S	*	.	H	α-helix	trans	-67.9	-36.4	177.1	-69.9	161.5	0	0	0	111.5	L378 K379 E380 H384 L385	L378-I382 WeakPolarHBondContact O-CB 3.38Å; L378-I382 WeakPolarHBondContact O-CD1 3.3Å; L378-I382 VanDerWaalsContact O-CG1 3.24Å; L378-I382 WeakPolarHBondContact O-CG1 3.3Å; L378-I382 PolarHBondContact O-N 2.98Å; K379-I382 PolarHBondContact O-N 2.89Å; E380-I382 PolarHBondContact O-N 3.3Å; I382-H384 PolarHBondContact O-N 2.83Å; I382-L385 PolarHBondContact O-N 3.27Å
383	L	77.7	Confident	81.8	Confident	115 Å²	115	66.6 Å²	66.6	60%	0.602	34%	0.342	S	S	*	.	H	α-helix	trans	-65.5	-16.2	175.6	-70.5	172.3	0	0	0	113.3	K379 E380	K379-L383 HydrophobicContact CG-CD1 4.48Å; K379-L383 WeakPolarHBondContact O-CG 3.26Å; K379-L383 PolarHBondContact O-N 3.39Å; K379-L383 VanDerWaalsContact O-N 3.08Å; E380-L383 PolarHBondContact O-N 2.92Å
384	H	69.2	Low	81.6	Confident	82 Å²	82	71.9 Å²	71.9	38%	0.38	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.8	-5.3	-179.1	-69.1	-47.2	0	0	0	114.6	E380 T381 I382	E380-H384 PolarHBondContact O-CD2 3.3Å; E380-H384 PolarHBondContact O-N 3.22Å; T381-H384 PolarHBondContact O-N 3.46Å; I382-H384 PolarHBondContact O-N 2.83Å
385	L	65	Low	81.1	Confident	154 Å²	154	78.1 Å²	78.1	81%	0.806	40%	0.4	S	S	*	.			trans	-81.6	0	169.5	-74.2	172.2	0	0	0	110.3	I352 T381 I382	I352-L385 HydrophobicContact CD1-CD2 3.91Å; I352-L385 HydrophobicContact CD1-CG 4.19Å; I352-L385 HydrophobicContact CG1-CD2 3.96Å; I352-L385 HydrophobicContact CG1-CG 4.42Å; I352-L385 HydrophobicContact CG2-CD2 4.02Å; T381-L385 PolarHBondContact O-N 3.3Å; I382-L385 PolarHBondContact O-N 3.27Å

Retrieved 385 of 385 residues in 284.1 ms (Link to these results)

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