A0A087YGR7_POEFO Loading...

Erythrocyte membrane protein band 4.1 like 4B

AlphaFold DB , UniProt , Accession A0A087YGR7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 772 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	29.2	Very low	28.2	Very low	233 Å²	233	175.1 Å²	175.1	100%	1.148	85%	0.845	S	S	*	*				0	120.4	0	-74.6	152.8	173.9	0	0	106.8
2	M	24.8	Very low	28.1	Very low	185 Å²	185	180.2 Å²	180.2	91%	0.911	85%	0.849	S	S	*	*				62.5	113.1	75.5	-64.2	-75	-79.2	0	0	110.4
3	G	28	Very low	27.9	Very low	61 Å²	61	173.6 Å²	173.6	63%	0.629	83%	0.834	S	S	*	*			cis	132.9	127.8	-3.5	0	0	0	0	0	111.4
4	F	26.2	Very low	27.7	Very low	194 Å²	194	177.4 Å²	177.4	85%	0.851	84%	0.836	S	S	*	*			trans	-137.5	110.6	-172.9	-96.5	-88.6	0	0	0	115
5	L	29.4	Very low	27.6	Very low	135 Å²	135	178.8 Å²	178.8	71%	0.707	84%	0.838	S	S	*	*			trans	44.5	111.5	143.5	-81.5	156.8	0	0	0	120.8
6	R	31.3	Very low	27.4	Very low	243 Å²	243	179.1 Å²	179.1	92%	0.917	84%	0.84	S	S	*	*			trans	-55	143.3	146.7	-68.7	179.9	173.2	-173.2	-2.7	109.6
7	R	29	Very low	27.2	Very low	209 Å²	209	175.9 Å²	175.9	79%	0.789	84%	0.835	S	S	*	*			trans	-130.6	123	160.5	-84.7	-174.2	170.2	167.6	-2.8	110.3	F9	R7-F9 HydrophobicContact CB-CD2 4.45Å; R7-F9 HydrophobicContact CB-CE2 4.26Å
8	T	31.9	Very low	27.1	Very low	136 Å²	136	175.2 Å²	175.2	83%	0.834	84%	0.835	S	S	*	*			trans	-77.8	138.3	168.5	43	0	0	0	0	109.7
9	F	26.9	Very low	27	Very low	172 Å²	172	174.9 Å²	174.9	75%	0.754	83%	0.833	S	S	*	*			trans	-138.9	96.5	167.7	-86.8	-69.7	0	0	0	110.6	R7 R11	R7-F9 HydrophobicContact CB-CD2 4.45Å; R7-F9 HydrophobicContact CB-CE2 4.26Å; F9-R11 PolarHBondContact O-N 3.29Å
10	S	28	Very low	26.9	Very low	125 Å²	125	177.9 Å²	177.9	87%	0.874	84%	0.835	S	S	*	*			trans	-74.1	119	158.8	-178.5	0	0	0	0	108.2
11	R	26.1	Very low	26.9	Very low	233 Å²	233	175 Å²	175	88%	0.879	83%	0.826	S	S	*	*			trans	-135.4	93.4	172.3	-133.4	179	-167	-123.3	1	111.6	F9 S13	F9-R11 PolarHBondContact O-N 3.29Å; R11-S13 PolarHBondContact O-N 3.32Å
12	R	26.7	Very low	26.7	Very low	236 Å²	236	172.5 Å²	172.5	89%	0.891	81%	0.811	S	S	*	*			trans	-56.6	117.3	170.6	-167.8	-176.2	-161	177.9	7	109.7
13	S	25.1	Very low	26.9	Very low	95 Å²	95	172.9 Å²	172.9	66%	0.664	80%	0.803	S	S	*	*			trans	-127	136.6	168.2	-166.3	0	0	0	0	109.5	R11	R11-S13 PolarHBondContact O-N 3.32Å
14	R	25.3	Very low	26.9	Very low	226 Å²	226	177.9 Å²	177.9	85%	0.853	82%	0.815	S	S	*	*			trans	-93.3	134.8	172.7	-56.8	177	-170.6	166.7	1.8	107.5
15	F	26.7	Very low	26.8	Very low	199 Å²	199	172.2 Å²	172.2	87%	0.873	81%	0.811	S	S	*	*			trans	-125.3	140.3	156	-95.3	-84.7	0	0	0	108.9
16	Q	24.6	Very low	26.5	Very low	184 Å²	184	170 Å²	170	86%	0.86	82%	0.821	S	S	*	*			trans	-86.4	144.8	-173.5	-70.8	166.1	-70	0	0	110.6
17	T	23.7	Very low	26.1	Very low	125 Å²	125	162.1 Å²	162.1	77%	0.767	82%	0.815	S	S	*	*			trans	-61.4	135.6	169.7	-37.8	0	0	0	0	110	E19	T17-E19 HydrophobicContact CG2-CG 4.11Å
18	I	25	Very low	26	Very low	162 Å²	162	159.4 Å²	159.4	83%	0.831	82%	0.821	S	S	*	*			trans	-120.4	116	156.3	-65.8	179.8	0	0	0	105.8
19	E	24.3	Very low	25.6	Very low	170 Å²	170	159.7 Å²	159.7	79%	0.794	82%	0.823	S	S	*	*			trans	-81	150.8	174.9	-62.1	-179.6	134.4	0	0	110.5	T17	T17-E19 HydrophobicContact CG2-CG 4.11Å
20	R	25.9	Very low	25.6	Very low	234 Å²	234	154.9 Å²	154.9	88%	0.883	82%	0.822	S	S	*	*			trans	-136.1	119.3	149.4	-85.5	-164.9	170.9	-162.6	-3.4	108.4
21	D	26.4	Very low	25.6	Very low	118 Å²	118	157 Å²	157	63%	0.631	82%	0.823	S	S	*	*			trans	-89.8	134.4	168.5	-172.3	14.5	0	0	0	107.8	R23	D21-R23 IonicContact OD1-NE 3.85Å; D21-R23 IonicContact OD2-NE 3.8Å; D21-R23 IonicContact OD2-NH2 2.73Å
22	E	25.9	Very low	25.9	Very low	180 Å²	180	151.4 Å²	151.4	84%	0.841	82%	0.818	S	S	*	*			trans	-153.9	136.9	166.2	-118.1	174.3	146.3	0	0	107.9
23	R	28.4	Very low	25.8	Very low	194 Å²	194	148.5 Å²	148.5	73%	0.732	82%	0.819	S	S	*	*			trans	-126.5	176.5	-167.8	-63.2	-169.7	-167.9	180	5.9	112.4	D21	D21-R23 IonicContact OD1-NE 3.85Å; D21-R23 IonicContact OD2-NE 3.8Å; D21-R23 IonicContact OD2-NH2 2.73Å
24	D	27.4	Very low	25.8	Very low	166 Å²	166	152.4 Å²	152.4	89%	0.888	83%	0.831	S	S	*	*			trans	71.7	143.1	170.5	-55.3	-19.4	0	0	0	115.3
25	G	24.3	Very low	25.9	Very low	75 Å²	75	149 Å²	149	77%	0.773	83%	0.829	S	S	*	*			cis	173.6	170.9	-6.1	0	0	0	0	0	112.4
26	G	24.3	Very low	25.9	Very low	89 Å²	89	145.3 Å²	145.3	92%	0.918	83%	0.825	S	S	*	*			trans	103.6	125.2	172.3	0	0	0	0	0	114.8
27	G	22.4	Very low	26.1	Very low	77 Å²	77	144.3 Å²	144.3	79%	0.794	82%	0.82	S	S	*	*			trans	-124.3	153.6	171.4	0	0	0	0	0	111.1
28	V	26	Very low	26.5	Very low	151 Å²	151	144.2 Å²	144.2	92%	0.915	81%	0.811	S	S	*	*			trans	-133.7	135.2	173.4	178.3	0	0	0	0	108.5
29	T	25.3	Very low	26.6	Very low	142 Å²	142	144.7 Å²	144.7	87%	0.871	81%	0.81	S	S	*	*			trans	-91.2	144.1	-176.3	46.3	0	0	0	0	112.4
30	G	25.2	Very low	27	Very low	71 Å²	71	140.4 Å²	140.4	73%	0.732	79%	0.79	S	S	*	*			trans	-168.3	106.3	173	0	0	0	0	0	112.9
31	N	27.8	Very low	27.1	Very low	169 Å²	169	133.5 Å²	133.5	90%	0.904	77%	0.774	S	S	*	*			trans	-79.8	148.1	168.9	-77.6	-25.3	0	0	0	110.4
32	P	32.7	Very low	27.4	Very low	117 Å²	117	132.6 Å²	132.6	76%	0.76	77%	0.772	S	S	*	*				-139.1	135.7	123.5	34.9	-22.5	0	0	0	115.1
33	L	24.8	Very low	27.6	Very low	174 Å²	174	130.6 Å²	130.6	91%	0.911	76%	0.762	S	S	*	*			trans	21.4	123.6	145	-71.9	153.8	0	0	0	119.9
34	L	26.1	Very low	27.8	Very low	177 Å²	177	123.9 Å²	123.9	93%	0.927	75%	0.748	S	S	*	*			trans	-78.3	144.4	175.1	-65.9	167.3	0	0	0	113.4
35	L	27.1	Very low	28.1	Very low	155 Å²	155	118.3 Å²	118.3	81%	0.812	72%	0.721	S	S	*	*			trans	-129.5	133.7	162.4	-88.8	156	0	0	0	107.9	H37	L35-H37 PolarHBondContact O-N 2.82Å
36	P	27.2	Very low	28.5	Very low	121 Å²	121	119.2 Å²	119.2	79%	0.786	72%	0.721	S	S	*	*			trans	-74.3	124.7	-176.6	29.2	-33.4	0	0	0	110.8
37	H	26.9	Very low	29.2	Very low	164 Å²	164	117.8 Å²	117.8	76%	0.759	70%	0.695	S	S	*	*			trans	-141.8	119	172.6	-104.4	51.9	0	0	0	112.4	L35 Q39	L35-H37 PolarHBondContact O-N 2.82Å; H37-Q39 PolarHBondContact O-N 3.34Å; H37-Q39 VanDerWaalsContact O-N 3.15Å
38	Q	32.1	Very low	29.9	Very low	123 Å²	123	119.2 Å²	119.2	58%	0.575	69%	0.688	S	S	*	*			trans	36	66.2	140.4	-162.8	171.4	30.1	0	0	117
39	Q	27.4	Very low	30.5	Very low	172 Å²	172	116 Å²	116	80%	0.804	67%	0.672	S	S	*	*			trans	-99.4	93.8	172.4	-131.2	170.9	15.6	0	0	110.9	H37 V41	H37-Q39 PolarHBondContact O-N 3.34Å; H37-Q39 VanDerWaalsContact O-N 3.15Å; Q39-V41 HydrophobicContact CB-CG2 3.94Å; Q39-V41 HydrophobicContact CG-CG2 4.01Å; Q39-V41 PolarHBondContact O-N 3.23Å
40	Q	34	Very low	31.3	Very low	80 Å²	80	112.8 Å²	112.8	37%	0.374	67%	0.667	S	S	.	*			trans	-75.3	81.5	167.1	-170.9	-178.9	15.2	0	0	107.2	V42 M257	Q40-V42 PolarHBondContact O-N 2.72Å; Q40-M257 PolarHBondContact NE2-O 2.57Å
41	V	26.8	Very low	32.6	Very low	89 Å²	89	110.4 Å²	110.4	54%	0.539	64%	0.642	S	S	.	*			trans	-72.6	70.6	-172.3	-167.9	0	0	0	0	111.5	Q39 H43	Q39-V41 HydrophobicContact CB-CG2 3.94Å; Q39-V41 HydrophobicContact CG-CG2 4.01Å; Q39-V41 PolarHBondContact O-N 3.23Å; V41-H43 VanDerWaalsContact C-N 3.26Å; V41-H43 PolarHBondContact O-N 3.26Å; V41-H43 VanDerWaalsContact O-N 3.12Å
42	V	33	Very low	34.2	Very low	98 Å²	98	105.9 Å²	105.9	59%	0.594	63%	0.629	S	S	*	*			trans	-75.8	88.4	156.4	-177.2	0	0	0	0	105.9	Q40 A44	Q40-V42 PolarHBondContact O-N 2.72Å; V42-A44 PolarHBondContact O-N 3.5Å
43	H	31.4	Very low	36.3	Very low	138 Å²	138	104.4 Å²	104.4	64%	0.639	62%	0.617	S	S	*	*			trans	-55.4	112.8	165.6	-77.7	-67.5	0	0	0	107.9	V41 P45	V41-H43 VanDerWaalsContact C-N 3.26Å; V41-H43 PolarHBondContact O-N 3.26Å; V41-H43 VanDerWaalsContact O-N 3.12Å; H43-P45 WeakPolarHBondContact O-CD 3.16Å
44	A	31.3	Very low	39.4	Very low	53 Å²	53	98.3 Å²	98.3	44%	0.438	59%	0.588	S	S	.	*			trans	-56.4	112.1	158.2	0	0	0	0	0	106	V42 A46 M112	V42-A44 PolarHBondContact O-N 3.5Å; A44-A46 PolarHBondContact O-N 3.43Å; A44-M112 HydrophobicContact CB-CE 4.26Å; A44-M112 HydrophobicContact CB-SD 3.98Å
45	P	34.3	Very low	42.6	Very low	49 Å²	49	94.8 Å²	94.8	32%	0.318	57%	0.566	S	S	.	*			trans	-62.6	140.4	-172.5	24.4	-32.5	0	0	0	108.5	H43 V47 Q168	H43-P45 WeakPolarHBondContact O-CD 3.16Å; P45-V47 HydrophobicContact CB-CG2 4.44Å; P45-V47 HydrophobicContact CG-CG2 4.25Å; P45-V47 PolarHBondContact O-N 2.7Å; P45-Q168 HydrophobicContact CG-CG 3.84Å
46	A	32.6	Very low	45.8	Very low	94 Å²	94	88.6 Å²	88.6	78%	0.777	53%	0.533	S	S	*	.			trans	-72.2	63.7	-179.5	0	0	0	0	0	111.4	A44 V48	A44-A46 PolarHBondContact O-N 3.43Å; A46-V48 PolarHBondContact O-N 3.06Å
47	V	37.9	Very low	49	Very low	60 Å²	60	87.5 Å²	87.5	36%	0.364	53%	0.527	S	S	.	.			trans	-67.9	88.5	167.6	-177.7	0	0	0	0	106.7	P45 S49 L71	P45-V47 HydrophobicContact CB-CG2 4.44Å; P45-V47 HydrophobicContact CG-CG2 4.25Å; P45-V47 PolarHBondContact O-N 2.7Å; V47-S49 PolarHBondContact O-N 3.25Å; V47-L71 HydrophobicContact CB-CD2 4.27Å; V47-L71 HydrophobicContact CG1-CD2 4.26Å
48	V	37	Very low	52	Low	107 Å²	107	81.2 Å²	81.2	65%	0.648	50%	0.503	S	S	*	.			trans	-57.4	108.9	170.9	176.9	0	0	0	0	107.7	A46 G50	A46-V48 PolarHBondContact O-N 3.06Å; V48-G50 VanDerWaalsContact C-N 3.26Å; V48-G50 PolarHBondContact O-N 3.23Å
49	S	39.3	Very low	54.5	Low	83 Å²	83	75.7 Å²	75.7	58%	0.58	48%	0.479	S	S	*	.			trans	-66.8	79.2	-177.6	-60.6	0	0	0	0	112.3	V47	V47-S49 PolarHBondContact O-N 3.25Å
50	G	42.5	Very low	57.4	Low	74 Å²	74	71.1 Å²	71.1	76%	0.763	48%	0.478	S	S	*	.			trans	-96.5	2.7	166.3	0	0	0	0	0	113.6	V48	V48-G50 VanDerWaalsContact C-N 3.26Å; V48-G50 PolarHBondContact O-N 3.23Å
51	G	51.8	Low	59.8	Low	21 Å²	21	74.5 Å²	74.5	22%	0.216	50%	0.504	C	S	.	.	S	Bend	trans	-72.3	146.4	176.4	0	0	0	0	0	112.2	T53	G51-T53 PolarHBondContact O-N 3.43Å
52	A	60.9	Low	62.7	Low	75 Å²	75	72 Å²	72	62%	0.62	49%	0.493	S	S	*	.	P	Polyproline II helix	trans	-60.1	127	173.1	0	0	0	0	0	110.7	V54	A52-V54 PolarHBondContact O-N 3.04Å
53	T	77.5	Confident	65.1	Low	85 Å²	85	79.9 Å²	79.9	52%	0.521	51%	0.512	S	S	.	.	P	Polyproline II helix	trans	-74.9	121.1	176.1	-50.1	0	0	0	0	110.1	G51 D77	G51-T53 PolarHBondContact O-N 3.43Å; T53-D77 WeakPolarHBondContact CA-O 3.32Å
54	V	90.8	Very high	68	Low	47 Å²	47	76.4 Å²	76.4	29%	0.285	50%	0.504	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	139.6	170.4	-177.6	0	0	0	0	108.7	A52 I56 T76 D77 V78 S79	A52-V54 PolarHBondContact O-N 3.04Å; V54-I56 HydrophobicContact CG1-CG1 4.42Å; V54-T76 HydrophobicContact CG2-CG2 3.95Å; V54-D77 PolarHBondContact N-O 3.4Å; V54-V78 HydrophobicContact CB-CG1 4.46Å; V54-V78 HydrophobicContact CB-CG2 4.38Å; V54-S79 PolarHBondContact O-N 3.35Å
55	H	93.8	Very high	70.9	Confident	102 Å²	102	77.2 Å²	77.2	47%	0.472	50%	0.503	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	132.9	175	-175.3	-99	0	0	0	111.1	S79 D81	H55-S79 WeakPolarHBondContact CA-O 3.47Å; H55-S79 PolarHBondContact CD2-O 3.23Å; H55-D81 IonicContact CD2-OD2 3.99Å; H55-D81 IonicContact CE1-OD2 3.84Å; H55-D81 PolarHBondContact CE1-OD2 3.21Å; H55-D81 IonicContact NE2-OD2 2.73Å; H55-D81 PolarHBondContact NE2-OD2 3.48Å
56	I	94.3	Very high	73.8	Confident	25 Å²	25	75.3 Å²	75.3	13%	0.128	49%	0.49	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	103	179.5	-55.6	-175.5	0	0	0	108.6	V54 A58 V78 S79 V80 D81 H98	V54-I56 HydrophobicContact CG1-CG1 4.42Å; I56-A58 HydrophobicContact CG2-CB 4.24Å; I56-A58 PolarHBondContact O-N 3.08Å; I56-V78 HydrophobicContact CD1-CG1 3.61Å; I56-V78 HydrophobicContact CG1-CG1 4.04Å; I56-S79 PolarHBondContact N-O 3.04Å; I56-V80 HydrophobicContact CB-CB 4.46Å; I56-V80 HydrophobicContact CB-CG1 4.17Å; I56-V80 HydrophobicContact CB-CG2 4.3Å; I56-V80 HydrophobicContact CD1-CG2 4.23Å; I56-V80 HydrophobicContact CG2-CG1 4.23Å; I56-D81 PolarHBondContact O-N 3.1Å; I56-H98 HydrophobicContact CD1-CB 3.74Å
57	P	92.4	Very high	76.7	Confident	99 Å²	99	72.8 Å²	72.8	64%	0.643	47%	0.465	S	S	*	.			trans	-80.7	56	-176.7	33.2	-36.6	0	0	0	112.8	G59	P57-G59 PolarHBondContact O-N 3.01Å; P57-G59 VanDerWaalsContact O-N 3.12Å
58	A	91.7	Very high	79.5	Confident	31 Å²	31	69.9 Å²	69.9	26%	0.256	45%	0.447	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.1	6.6	-179	0	0	0	0	0	114.6	I56 G60 V80 D81 L82 Q94	I56-A58 HydrophobicContact CG2-CB 4.24Å; I56-A58 PolarHBondContact O-N 3.08Å; A58-G60 VanDerWaalsContact C-N 3.31Å; A58-G60 PolarHBondContact O-N 2.82Å; A58-V80 HydrophobicContact CB-CG1 4.23Å; A58-D81 CarbonylContact C-O 3.36Å; A58-D81 WeakPolarHBondContact CA-O 3.47Å; A58-D81 WeakPolarHBondContact CB-O 3.26Å; A58-D81 PolarHBondContact N-O 2.98Å; A58-L82 HydrophobicContact CB-CD2 3.87Å; A58-Q94 HydrophobicContact CB-CG 3.94Å
59	G	83.8	Confident	82.3	Confident	8 Å²	8	69.6 Å²	69.6	8%	0.082	44%	0.435	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70	-22.2	178.2	0	0	0	0	0	114.6	P57 T61 A62 D81	P57-G59 PolarHBondContact O-N 3.01Å; P57-G59 VanDerWaalsContact O-N 3.12Å; G59-T61 PolarHBondContact O-N 2.76Å; G59-A62 WeakPolarHBondContact O-CB 3.28Å; G59-A62 PolarHBondContact O-N 3.26Å; G59-A62 VanDerWaalsContact O-N 3.16Å; G59-D81 PolarHBondContact N-O 3.16Å
60	G	87.8	Confident	85.1	Confident	75 Å²	75	65.6 Å²	65.6	77%	0.773	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.9	-131.9	-179.5	0	0	0	0	0	112.8	A58	A58-G60 VanDerWaalsContact C-N 3.31Å; A58-G60 PolarHBondContact O-N 2.82Å
61	T	85.8	Confident	87.7	Confident	151 Å²	151	63.1 Å²	63.1	93%	0.926	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.6	19.1	178.1	54.1	0	0	0	0	113.6	G59 R63	G59-T61 PolarHBondContact O-N 2.76Å; T61-R63 PolarHBondContact O-N 3.14Å
62	A	87	Confident	89.8	Confident	38 Å²	38	62.8 Å²	62.8	31%	0.314	37%	0.369	S	S	.	.			trans	-67.2	127.8	-176.5	0	0	0	0	0	112.4	G59 S64 P83	G59-A62 WeakPolarHBondContact O-CB 3.28Å; G59-A62 PolarHBondContact O-N 3.26Å; G59-A62 VanDerWaalsContact O-N 3.16Å; A62-S64 PolarHBondContact O-N 3.07Å; A62-P83 HydrophobicContact CB-CB 3.9Å; A62-P83 HydrophobicContact CB-CG 4.06Å
63	R	83.4	Confident	91.5	Very high	263 Å²	263	59.9 Å²	59.9	99%	0.992	34%	0.343	S	S	*	.	S	Bend	trans	-61	-8.8	176.7	-63.2	-173.8	-178.9	-173.5	-0.3	115.1	T61	T61-R63 PolarHBondContact O-N 3.14Å
64	S	91.5	Very high	92.2	Very high	65 Å²	65	58.1 Å²	58.1	46%	0.455	33%	0.33	S	S	.	.	S	Bend	trans	-159.5	123.2	179.7	165.4	0	0	0	0	108	A62 S84	A62-S64 PolarHBondContact O-N 3.07Å; S64-S84 WeakPolarHBondContact CB-OG 3.47Å; S64-S84 WeakPolarHBondContact O-CB 3.2Å; S64-S84 PolarHBondContact O-N 2.83Å; S64-S84 PolarHBondContact O-OG 2.83Å; S64-S84 VanDerWaalsContact OG-CB 3.26Å; S64-S84 WeakPolarHBondContact OG-CB 3.18Å; S64-S84 PolarHBondContact OG-OG 3.16Å
65	T	93.2	Very high	92.2	Very high	69 Å²	69	56.6 Å²	56.6	42%	0.423	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	170.6	177.3	49.7	0	0	0	0	111.6	L82	T65-L82 CarbonylContact C-O 3.05Å; T65-L82 WeakPolarHBondContact CA-O 3.28Å; T65-L82 WeakPolarHBondContact CB-O 3.39Å
66	I	94.1	Very high	92.2	Very high	10 Å²	10	52.5 Å²	52.5	5%	0.051	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	135.6	167.9	50.9	175.9	0	0	0	108.6	D81 L82 L127 Y137	I66-D81 WeakPolarHBondContact O-CA 3.35Å; I66-L82 HydrophobicContact CG1-CB 4.22Å; I66-L82 PolarHBondContact N-O 2.89Å; I66-L82 PolarHBondContact O-N 2.92Å; I66-L127 HydrophobicContact CD1-CB 4.03Å; I66-L127 HydrophobicContact CD1-CD1 3.84Å; I66-Y137 HydrophobicContact CB-CD2 4.42Å; I66-Y137 HydrophobicContact CB-CE2 3.86Å; I66-Y137 HydrophobicContact CD1-CD2 4.5Å; I66-Y137 HydrophobicContact CD1-CE2 3.96Å; I66-Y137 HydrophobicContact CG1-CE2 4.44Å; I66-Y137 HydrophobicContact CG2-CE2 3.93Å
67	T	94.9	Very high	92.2	Very high	40 Å²	40	52.1 Å²	52.1	25%	0.245	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	128	175.1	-49.4	0	0	0	0	109.9	S79 D81 P136 Y137	T67-S79 VanDerWaalsContact CG2-OG 3.23Å; T67-S79 WeakPolarHBondContact CG2-OG 3.22Å; T67-D81 WeakPolarHBondContact CA-OD1 3.39Å; T67-D81 VanDerWaalsContact CB-OD1 3.24Å; T67-D81 WeakPolarHBondContact CB-OD1 3.34Å; T67-D81 WeakPolarHBondContact CG2-OD1 3.38Å; T67-D81 PolarHBondContact OG1-OD1 3.45Å; T67-P136 HydrophobicContact CG2-CB 4.37Å; T67-P136 WeakPolarHBondContact O-CA 3.4Å; T67-Y137 PolarHBondContact O-N 3.46Å
68	C	96.2	Very high	92.4	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	118.9	174.7	-54.8	0	0	0	0	108.6	V80 L91 Y137 L139	C68-V80 PolarHBondContact N-O 3.19Å; C68-V80 PolarHBondContact O-N 2.78Å; C68-L91 HydrophobicContact CB-CD1 3.74Å; C68-L91 HydrophobicContact CB-CD2 3.78Å; C68-L91 HydrophobicContact CB-CG 4.43Å; C68-Y137 CarbonylContact C-O 3.49Å; C68-Y137 WeakPolarHBondContact CA-O 3.42Å; C68-L139 HydrophobicContact CB-CD1 4.23Å
69	R	96	Very high	92.6	Very high	100 Å²	100	46.5 Å²	46.5	38%	0.377	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	125.6	172.5	-75.1	-172	-177.7	-135.4	8.2	109.7	D77 V78 P136 Y137 L139	R69-D77 WeakPolarHBondContact CB-OD1 3.49Å; R69-D77 IonicContact CZ-OD2 3.76Å; R69-D77 IonicContact NH1-OD2 3.94Å; R69-D77 PolarHBondContact NH1-OD2 2.66Å; R69-V78 WeakPolarHBondContact CA-O 3.38Å; R69-P136 HydrophobicContact CG-CB 4.47Å; R69-Y137 PolarHBondContact N-O 3.33Å; R69-L139 PolarHBondContact O-N 3.18Å
70	V	97.3	Very high	93.2	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	112.3	-178.6	-176.5	0	0	0	0	108.7	L72 V78 L91 I95 L109 L139 F141	V70-L72 HydrophobicContact CG1-CD2 4.19Å; V70-L72 PolarHBondContact O-N 2.88Å; V70-V78 PolarHBondContact N-O 2.93Å; V70-V78 PolarHBondContact O-N 2.73Å; V70-L91 HydrophobicContact CG2-CD1 4.12Å; V70-L91 HydrophobicContact CG2-CD2 4.31Å; V70-L91 HydrophobicContact CG2-CG 4.45Å; V70-I95 HydrophobicContact CB-CD1 3.8Å; V70-I95 HydrophobicContact CB-CG1 4.33Å; V70-I95 HydrophobicContact CG1-CD1 4.08Å; V70-I95 HydrophobicContact CG1-CG1 4.24Å; V70-I95 HydrophobicContact CG2-CD1 3.81Å; V70-I95 HydrophobicContact CG2-CG1 4.03Å; V70-L109 HydrophobicContact CG1-CD2 3.51Å; V70-L109 HydrophobicContact CG2-CD2 4.38Å; V70-L139 WeakPolarHBondContact CA-O 3.38Å; V70-L139 HydrophobicContact CG2-CB 4.36Å; V70-F141 HydrophobicContact CG1-CB 4.13Å
71	L	96.8	Very high	93.6	Very high	21 Å²	21	44.1 Å²	44.1	11%	0.11	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	116.6	171.1	-175	64.1	0	0	0	109.4	V47 L139 F140 F141	V47-L71 HydrophobicContact CB-CD2 4.27Å; V47-L71 HydrophobicContact CG1-CD2 4.26Å; L71-L139 PolarHBondContact N-O 2.89Å; L71-F140 HydrophobicContact CB-CD1 3.95Å; L71-F140 HydrophobicContact CB-CE1 4.36Å; L71-F140 HydrophobicContact CD2-CD1 3.96Å; L71-F140 HydrophobicContact CD2-CE1 3.96Å; L71-F140 HydrophobicContact CG-CD1 4.48Å; L71-F141 PolarHBondContact O-N 3.03Å
72	L	96.8	Very high	94	Very high	14 Å²	14	37.2 Å²	37.2	7%	0.073	19%	0.191	C	C	.	.			trans	-78.8	166.3	177	-64.3	-173	0	0	0	112.4	V70 D74 G75 T76 V78 I95 I99 F141	V70-L72 HydrophobicContact CG1-CD2 4.19Å; V70-L72 PolarHBondContact O-N 2.88Å; L72-D74 WeakPolarHBondContact CB-OD1 3.46Å; L72-D74 PolarHBondContact O-N 2.86Å; L72-G75 PolarHBondContact O-N 3.08Å; L72-T76 HydrophobicContact CD1-CG2 4.47Å; L72-T76 PolarHBondContact N-O 2.84Å; L72-V78 HydrophobicContact CD1-CG2 3.63Å; L72-V78 HydrophobicContact CG-CG2 3.86Å; L72-I95 HydrophobicContact CD2-CG2 3.88Å; L72-I99 HydrophobicContact CD1-CG2 3.8Å; L72-F141 HydrophobicContact CD2-CB 3.8Å; L72-F141 HydrophobicContact CD2-CD1 4.08Å; L72-F141 HydrophobicContact CD2-CG 4.08Å
73	L	95.8	Very high	94.4	Very high	15 Å²	15	37.4 Å²	37.4	8%	0.079	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67	-23.5	-178.9	-73.7	167.2	0	0	0	113.3	G75 F107 F141 L161 L164 Q165	L73-G75 VanDerWaalsContact C-N 3.28Å; L73-F107 HydrophobicContact CD1-CD1 4.35Å; L73-F107 HydrophobicContact CD1-CE1 4.02Å; L73-F141 HydrophobicContact CD1-CD1 3.94Å; L73-F141 HydrophobicContact CD1-CE1 3.97Å; L73-F141 HydrophobicContact CG-CD1 4.04Å; L73-L161 HydrophobicContact CB-CD2 4.14Å; L73-L161 HydrophobicContact CD1-CB 4.14Å; L73-L161 HydrophobicContact CD1-CD2 4.19Å; L73-L164 HydrophobicContact CB-CB 4.17Å; L73-L164 HydrophobicContact CB-CD1 4.23Å; L73-Q165 HydrophobicContact CD1-CB 4.5Å; L73-Q165 HydrophobicContact CD2-CB 3.92Å
74	D	92.6	Very high	94.9	Very high	47 Å²	47	26.8 Å²	26.8	25%	0.251	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.5	-0.6	173.5	78.6	-40.8	0	0	0	113	L72 T76 L164 R393	L72-D74 WeakPolarHBondContact CB-OD1 3.46Å; L72-D74 PolarHBondContact O-N 2.86Å; D74-T76 VanDerWaalsContact OD1-CB 3.29Å; D74-T76 WeakPolarHBondContact OD1-CB 3.32Å; D74-T76 PolarHBondContact OD1-N 3.43Å; D74-T76 PolarHBondContact OD1-OG1 2.82Å; D74-T76 WeakPolarHBondContact OD2-CB 3.48Å; D74-T76 PolarHBondContact OD2-OG1 3.4Å; D74-L164 HydrophobicContact CB-CD1 4.14Å; D74-R393 HydrophobicContact CB-CB 4.38Å; D74-R393 WeakPolarHBondContact O-CD 3.32Å; D74-R393 PolarHBondContact O-NH1 2.9Å; D74-R393 IonicContact OD2-CZ 2.71Å; D74-R393 IonicContact OD2-NH1 2.64Å; D74-R393 PolarHBondContact OD2-NH1 3.27Å
75	G	92.1	Very high	95	Very high	16 Å²	16	32 Å²	32	17%	0.165	17%	0.17	C	C	.	.	S	Bend	trans	83.1	10.7	-175.2	0	0	0	0	0	115.8	L72 L73	L72-G75 PolarHBondContact O-N 3.08Å; L73-G75 VanDerWaalsContact C-N 3.28Å
76	T	92.6	Very high	95.1	Very high	15 Å²	15	29.1 Å²	29.1	9%	0.092	15%	0.153	C	C	.	.			trans	-77.9	132.2	173.4	-67.2	0	0	0	0	111.3	V54 L72 D74 V78 R393	V54-T76 HydrophobicContact CG2-CG2 3.95Å; L72-T76 HydrophobicContact CD1-CG2 4.47Å; L72-T76 PolarHBondContact N-O 2.84Å; D74-T76 VanDerWaalsContact OD1-CB 3.29Å; D74-T76 WeakPolarHBondContact OD1-CB 3.32Å; D74-T76 PolarHBondContact OD1-N 3.43Å; D74-T76 PolarHBondContact OD1-OG1 2.82Å; D74-T76 WeakPolarHBondContact OD2-CB 3.48Å; D74-T76 PolarHBondContact OD2-OG1 3.4Å; T76-V78 HydrophobicContact CG2-CG2 3.94Å; T76-R393 PolarHBondContact OG1-NH1 3.1Å
77	D	93.9	Very high	95.2	Very high	18 Å²	18	33.5 Å²	33.5	10%	0.096	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	112	172.2	-177.5	10.2	0	0	0	109.3	T53 V54 R69	T53-D77 WeakPolarHBondContact CA-O 3.32Å; V54-D77 PolarHBondContact N-O 3.4Å; R69-D77 WeakPolarHBondContact CB-OD1 3.49Å; R69-D77 IonicContact CZ-OD2 3.76Å; R69-D77 IonicContact NH1-OD2 3.94Å; R69-D77 PolarHBondContact NH1-OD2 2.66Å
78	V	96.1	Very high	95.2	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	111.1	179.4	-174.8	0	0	0	0	109.5	V54 I56 R69 V70 L72 T76 V80 I95	V54-V78 HydrophobicContact CB-CG1 4.46Å; V54-V78 HydrophobicContact CB-CG2 4.38Å; I56-V78 HydrophobicContact CD1-CG1 3.61Å; I56-V78 HydrophobicContact CG1-CG1 4.04Å; R69-V78 WeakPolarHBondContact CA-O 3.38Å; V70-V78 PolarHBondContact N-O 2.93Å; V70-V78 PolarHBondContact O-N 2.73Å; L72-V78 HydrophobicContact CD1-CG2 3.63Å; L72-V78 HydrophobicContact CG-CG2 3.86Å; T76-V78 HydrophobicContact CG2-CG2 3.94Å; V78-V80 HydrophobicContact CG1-CG2 3.98Å; V78-I95 HydrophobicContact CB-CD1 4.03Å; V78-I95 HydrophobicContact CG1-CD1 3.78Å
79	S	96.5	Very high	95.2	Very high	12 Å²	12	34.8 Å²	34.8	8%	0.084	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	102.4	177.4	-173.7	0	0	0	0	110.5	V54 H55 I56 T67	V54-S79 PolarHBondContact O-N 3.35Å; H55-S79 WeakPolarHBondContact CA-O 3.47Å; H55-S79 PolarHBondContact CD2-O 3.23Å; I56-S79 PolarHBondContact N-O 3.04Å; T67-S79 VanDerWaalsContact CG2-OG 3.23Å; T67-S79 WeakPolarHBondContact CG2-OG 3.22Å
80	V	96.4	Very high	95.3	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	120.2	177.6	-166.6	0	0	0	0	109.8	I56 A58 C68 V78 L82 L91 Q94 I95	I56-V80 HydrophobicContact CB-CB 4.46Å; I56-V80 HydrophobicContact CB-CG1 4.17Å; I56-V80 HydrophobicContact CB-CG2 4.3Å; I56-V80 HydrophobicContact CD1-CG2 4.23Å; I56-V80 HydrophobicContact CG2-CG1 4.23Å; A58-V80 HydrophobicContact CB-CG1 4.23Å; C68-V80 PolarHBondContact N-O 3.19Å; C68-V80 PolarHBondContact O-N 2.78Å; V78-V80 HydrophobicContact CG1-CG2 3.98Å; V80-L82 HydrophobicContact CG1-CD1 4.43Å; V80-L82 HydrophobicContact CG1-CD2 4.1Å; V80-L82 HydrophobicContact CG1-CG 3.95Å; V80-L91 HydrophobicContact CB-CD1 3.76Å; V80-L91 HydrophobicContact CG1-CD1 4.16Å; V80-L91 HydrophobicContact CG2-CD1 3.83Å; V80-Q94 HydrophobicContact CG1-CB 3.97Å; V80-Q94 HydrophobicContact CG1-CG 4.09Å; V80-I95 HydrophobicContact CG2-CD1 3.74Å
81	D	95.8	Very high	95.3	Very high	32 Å²	32	32.7 Å²	32.7	17%	0.171	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	127.3	168.1	-73.5	-34.2	0	0	0	109.8	H55 I56 A58 G59 I66 T67	H55-D81 IonicContact CD2-OD2 3.99Å; H55-D81 IonicContact CE1-OD2 3.84Å; H55-D81 PolarHBondContact CE1-OD2 3.21Å; H55-D81 IonicContact NE2-OD2 2.73Å; H55-D81 PolarHBondContact NE2-OD2 3.48Å; I56-D81 PolarHBondContact O-N 3.1Å; A58-D81 CarbonylContact C-O 3.36Å; A58-D81 WeakPolarHBondContact CA-O 3.47Å; A58-D81 WeakPolarHBondContact CB-O 3.26Å; A58-D81 PolarHBondContact N-O 2.98Å; G59-D81 PolarHBondContact N-O 3.16Å; I66-D81 WeakPolarHBondContact O-CA 3.35Å; T67-D81 WeakPolarHBondContact CA-OD1 3.39Å; T67-D81 VanDerWaalsContact CB-OD1 3.24Å; T67-D81 WeakPolarHBondContact CB-OD1 3.34Å; T67-D81 WeakPolarHBondContact CG2-OD1 3.38Å; T67-D81 PolarHBondContact OG1-OD1 3.45Å
82	L	95.6	Very high	95.3	Very high	6 Å²	6	32.1 Å²	32.1	3%	0.031	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	159.1	-178.5	-70	169.8	0	0	0	111	A58 T65 I66 V80 L91 Q94 L127	A58-L82 HydrophobicContact CB-CD2 3.87Å; T65-L82 CarbonylContact C-O 3.05Å; T65-L82 WeakPolarHBondContact CA-O 3.28Å; T65-L82 WeakPolarHBondContact CB-O 3.39Å; I66-L82 HydrophobicContact CG1-CB 4.22Å; I66-L82 PolarHBondContact N-O 2.89Å; I66-L82 PolarHBondContact O-N 2.92Å; V80-L82 HydrophobicContact CG1-CD1 4.43Å; V80-L82 HydrophobicContact CG1-CD2 4.1Å; V80-L82 HydrophobicContact CG1-CG 3.95Å; L82-L91 HydrophobicContact CD1-CB 3.67Å; L82-L91 HydrophobicContact CD1-CD1 3.91Å; L82-L91 HydrophobicContact CD1-CG 4.35Å; L82-Q94 HydrophobicContact CD2-CG 4.15Å; L82-L127 HydrophobicContact CD1-CD1 3.88Å
83	P	95.6	Very high	95.2	Very high	42 Å²	42	34.8 Å²	34.8	27%	0.273	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-54.9	140.6	167.5	-24.3	34.8	0	0	0	111.9	A62 K85 S86	A62-P83 HydrophobicContact CB-CB 3.9Å; A62-P83 HydrophobicContact CB-CG 4.06Å; P83-K85 PolarHBondContact O-N 3.12Å; P83-S86 VanDerWaalsContact O-CB 3.28Å; P83-S86 WeakPolarHBondContact O-CB 3.4Å; P83-S86 PolarHBondContact O-N 3.14Å; P83-S86 PolarHBondContact O-OG 2.84Å
84	S	92.4	Very high	95.3	Very high	40 Å²	40	36.9 Å²	36.9	28%	0.28	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-1.5	-176.1	63.5	0	0	0	0	115.8	S64	S64-S84 WeakPolarHBondContact CB-OG 3.47Å; S64-S84 WeakPolarHBondContact O-CB 3.2Å; S64-S84 PolarHBondContact O-N 2.83Å; S64-S84 PolarHBondContact O-OG 2.83Å; S64-S84 VanDerWaalsContact OG-CB 3.26Å; S64-S84 WeakPolarHBondContact OG-CB 3.18Å; S64-S84 PolarHBondContact OG-OG 3.16Å
85	K	93.4	Very high	95.5	Very high	175 Å²	175	34.7 Å²	34.7	76%	0.761	18%	0.179	S	C	*	.	T	Hydrogen-bonded Turn	trans	-107.2	14.7	171.8	-62.4	-177.9	-178.7	177	0	113.2	P83 L126	P83-K85 PolarHBondContact O-N 3.12Å; K85-L126 WeakPolarHBondContact O-CD2 3.33Å
86	S	95.6	Very high	95.6	Very high	9 Å²	9	34.2 Å²	34.2	6%	0.063	17%	0.173	C	C	.	.			trans	-73.3	151.1	179.8	-88.2	0	0	0	0	114.5	P83 D90 L126 L127	P83-S86 VanDerWaalsContact O-CB 3.28Å; P83-S86 WeakPolarHBondContact O-CB 3.4Å; P83-S86 PolarHBondContact O-N 3.14Å; P83-S86 PolarHBondContact O-OG 2.84Å; S86-D90 WeakPolarHBondContact CA-OD2 3.42Å; S86-D90 WeakPolarHBondContact CB-OD2 3.36Å; S86-D90 PolarHBondContact OG-OD2 3.46Å; S86-L126 WeakPolarHBondContact O-CA 3.32Å; S86-L127 PolarHBondContact O-N 2.84Å; S86-L127 VanDerWaalsContact O-N 3.1Å
87	K	96.4	Very high	95.7	Very high	102 Å²	102	42.9 Å²	42.9	44%	0.443	21%	0.205	S	C	.	.	B	Isolated β-bridge	trans	-90.4	170.2	174.8	-61.3	174.2	-178.8	171.2	0	111.7	Q89 D90 K125 L126	K87-Q89 PolarHBondContact O-N 3.14Å; K87-D90 PolarHBondContact N-OD2 3.49Å; K87-D90 PolarHBondContact O-N 2.95Å; K87-K125 CarbonylContact C-O 3.47Å; K87-K125 VanDerWaalsContact CA-O 3.23Å; K87-K125 WeakPolarHBondContact CA-O 3.49Å; K87-L126 HydrophobicContact CG-CD2 4.18Å
88	G	95.8	Very high	95.6	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-62.2	-31.5	170.1	0	0	0	0	0	113.3	L91 F92 K125	G88-L91 PolarHBondContact O-N 3.02Å; G88-F92 WeakPolarHBondContact O-CB 3.33Å; G88-F92 PolarHBondContact O-N 2.98Å; G88-K125 PolarHBondContact N-O 3.38Å
89	Q	96	Very high	95.5	Very high	67 Å²	67	46.8 Å²	46.8	31%	0.313	22%	0.223	S	C	.	.	H	α-helix	trans	-59.1	-49.8	173.4	-166.4	69.5	57.6	0	0	111.4	K87 L91 F92 D93 M123	K87-Q89 PolarHBondContact O-N 3.14Å; Q89-L91 PolarHBondContact O-N 2.79Å; Q89-L91 VanDerWaalsContact O-N 3.17Å; Q89-F92 WeakPolarHBondContact O-CA 3.42Å; Q89-F92 WeakPolarHBondContact O-CB 3.3Å; Q89-F92 PolarHBondContact O-N 2.7Å; Q89-D93 PolarHBondContact NE2-OD1 2.83Å; Q89-D93 VanDerWaalsContact O-CG 3.23Å; Q89-D93 PolarHBondContact O-N 3.21Å; Q89-M123 HydrophobicContact CB-CB 4.18Å; Q89-M123 WeakPolarHBondContact CB-O 3.21Å; Q89-M123 PolarHBondContact N-O 2.93Å
90	D	96.7	Very high	95.3	Very high	55 Å²	55	50.2 Å²	50.2	29%	0.294	24%	0.241	S	C	.	.	H	α-helix	trans	-56.2	-37.7	-178.2	-41.2	-3.6	0	0	0	111.9	S86 K87 Q94	S86-D90 WeakPolarHBondContact CA-OD2 3.42Å; S86-D90 WeakPolarHBondContact CB-OD2 3.36Å; S86-D90 PolarHBondContact OG-OD2 3.46Å; K87-D90 PolarHBondContact N-OD2 3.49Å; K87-D90 PolarHBondContact O-N 2.95Å; D90-Q94 WeakPolarHBondContact O-CG 3.19Å; D90-Q94 PolarHBondContact O-N 2.8Å
91	L	97.3	Very high	95.1	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-72.1	-45	174	179.3	61.4	0	0	0	112.3	C68 V70 V80 L82 G88 Q89 D93 Q94 I95 L109 L127 L139	C68-L91 HydrophobicContact CB-CD1 3.74Å; C68-L91 HydrophobicContact CB-CD2 3.78Å; C68-L91 HydrophobicContact CB-CG 4.43Å; V70-L91 HydrophobicContact CG2-CD1 4.12Å; V70-L91 HydrophobicContact CG2-CD2 4.31Å; V70-L91 HydrophobicContact CG2-CG 4.45Å; V80-L91 HydrophobicContact CB-CD1 3.76Å; V80-L91 HydrophobicContact CG1-CD1 4.16Å; V80-L91 HydrophobicContact CG2-CD1 3.83Å; L82-L91 HydrophobicContact CD1-CB 3.67Å; L82-L91 HydrophobicContact CD1-CD1 3.91Å; L82-L91 HydrophobicContact CD1-CG 4.35Å; G88-L91 PolarHBondContact O-N 3.02Å; Q89-L91 PolarHBondContact O-N 2.79Å; Q89-L91 VanDerWaalsContact O-N 3.17Å; L91-D93 VanDerWaalsContact C-N 3.33Å; L91-D93 PolarHBondContact O-N 3.24Å; L91-Q94 PolarHBondContact O-N 3.09Å; L91-I95 HydrophobicContact CD1-CG1 4.47Å; L91-I95 WeakPolarHBondContact O-CG1 3.36Å; L91-I95 PolarHBondContact O-N 2.89Å; L91-I95 VanDerWaalsContact O-N 3.11Å; L91-L109 HydrophobicContact CD2-CD1 3.93Å; L91-L109 HydrophobicContact CG-CD1 3.88Å; L91-L127 HydrophobicContact CB-CD1 4.28Å; L91-L127 HydrophobicContact CB-CD2 4.42Å; L91-L127 HydrophobicContact CD2-CD2 3.81Å; L91-L139 HydrophobicContact CD2-CD1 3.94Å; L91-L139 HydrophobicContact CD2-CD2 3.86Å
92	F	97.1	Very high	94.7	Very high	10 Å²	10	52.4 Å²	52.4	4%	0.044	26%	0.255	C	S	.	.	H	α-helix	trans	-58.3	-46.7	178.6	-172.7	-97.3	0	0	0	111	G88 Q89 Q94 I95 M96 M104 L109 M123	G88-F92 WeakPolarHBondContact O-CB 3.33Å; G88-F92 PolarHBondContact O-N 2.98Å; Q89-F92 WeakPolarHBondContact O-CA 3.42Å; Q89-F92 WeakPolarHBondContact O-CB 3.3Å; Q89-F92 PolarHBondContact O-N 2.7Å; F92-Q94 PolarHBondContact O-N 2.85Å; F92-I95 PolarHBondContact O-N 2.61Å; F92-I95 VanDerWaalsContact O-N 3.14Å; F92-M96 HydrophobicContact CD1-CG 3.73Å; F92-M96 HydrophobicContact CD2-CE 4.09Å; F92-M96 HydrophobicContact CE1-CE 4.34Å; F92-M96 HydrophobicContact CE1-CG 3.46Å; F92-M96 VanDerWaalsContact CE1-CG 3.46Å; F92-M96 HydrophobicContact CE1-SD 3.94Å; F92-M96 HydrophobicContact CE2-CE 3.77Å; F92-M96 HydrophobicContact CE2-SD 4.23Å; F92-M96 HydrophobicContact CG-CG 4.4Å; F92-M96 HydrophobicContact CZ-CE 3.92Å; F92-M96 HydrophobicContact CZ-CG 3.92Å; F92-M96 HydrophobicContact CZ-SD 3.74Å; F92-M96 WeakPolarHBondContact O-CG 3.16Å; F92-M96 PolarHBondContact O-N 3.24Å; F92-M104 HydrophobicContact CE1-CB 4.14Å; F92-M104 HydrophobicContact CE1-CG 4.45Å; F92-M104 HydrophobicContact CE1-SD 4.29Å; F92-M104 HydrophobicContact CZ-CB 4.2Å; F92-L109 HydrophobicContact CB-CD1 4.31Å; F92-L109 HydrophobicContact CD2-CD1 4.27Å; F92-L109 HydrophobicContact CD2-CG 4.18Å; F92-M123 HydrophobicContact CB-SD 4.2Å; F92-M123 HydrophobicContact CD1-SD 3.95Å; F92-M123 HydrophobicContact CD2-SD 4.18Å; F92-M123 HydrophobicContact CE1-SD 4.34Å; F92-M123 HydrophobicContact CG-SD 3.85Å
93	D	96.1	Very high	94.5	Very high	70 Å²	70	52.6 Å²	52.6	37%	0.374	26%	0.255	S	S	.	.	H	α-helix	trans	-62	-39.9	179.8	-63.5	-8.9	0	0	0	112.1	Q89 L91 M96 Y97	Q89-D93 PolarHBondContact NE2-OD1 2.83Å; Q89-D93 VanDerWaalsContact O-CG 3.23Å; Q89-D93 PolarHBondContact O-N 3.21Å; L91-D93 VanDerWaalsContact C-N 3.33Å; L91-D93 PolarHBondContact O-N 3.24Å; D93-M96 PolarHBondContact O-N 3.09Å; D93-Y97 VanDerWaalsContact O-CB 3.27Å; D93-Y97 WeakPolarHBondContact O-CB 3.42Å; D93-Y97 PolarHBondContact O-N 2.82Å
94	Q	96.9	Very high	94.4	Very high	59 Å²	59	53.1 Å²	53.1	28%	0.276	26%	0.255	S	S	.	.	H	α-helix	trans	-64	-40.5	174	-71.4	-55.7	-67.2	0	0	112.3	A58 V80 L82 D90 L91 F92 H98	A58-Q94 HydrophobicContact CB-CG 3.94Å; V80-Q94 HydrophobicContact CG1-CB 3.97Å; V80-Q94 HydrophobicContact CG1-CG 4.09Å; L82-Q94 HydrophobicContact CD2-CG 4.15Å; D90-Q94 WeakPolarHBondContact O-CG 3.19Å; D90-Q94 PolarHBondContact O-N 2.8Å; L91-Q94 PolarHBondContact O-N 3.09Å; F92-Q94 PolarHBondContact O-N 2.85Å; Q94-H98 WeakPolarHBondContact O-CB 3.5Å; Q94-H98 PolarHBondContact O-N 3.25Å
95	I	97	Very high	94.4	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-68	-44.7	176.3	-62.1	-63.4	0	0	0	110.7	V70 L72 V78 V80 L91 F92 Y97 H98 I99	V70-I95 HydrophobicContact CB-CD1 3.8Å; V70-I95 HydrophobicContact CB-CG1 4.33Å; V70-I95 HydrophobicContact CG1-CD1 4.08Å; V70-I95 HydrophobicContact CG1-CG1 4.24Å; V70-I95 HydrophobicContact CG2-CD1 3.81Å; V70-I95 HydrophobicContact CG2-CG1 4.03Å; L72-I95 HydrophobicContact CD2-CG2 3.88Å; V78-I95 HydrophobicContact CB-CD1 4.03Å; V78-I95 HydrophobicContact CG1-CD1 3.78Å; V80-I95 HydrophobicContact CG2-CD1 3.74Å; L91-I95 HydrophobicContact CD1-CG1 4.47Å; L91-I95 WeakPolarHBondContact O-CG1 3.36Å; L91-I95 PolarHBondContact O-N 2.89Å; L91-I95 VanDerWaalsContact O-N 3.11Å; F92-I95 PolarHBondContact O-N 2.61Å; F92-I95 VanDerWaalsContact O-N 3.14Å; I95-Y97 VanDerWaalsContact C-N 3.32Å; I95-Y97 PolarHBondContact O-N 2.94Å; I95-H98 WeakPolarHBondContact O-CB 3.3Å; I95-H98 PolarHBondContact O-N 2.77Å; I95-H98 VanDerWaalsContact O-N 3.17Å; I95-I99 WeakPolarHBondContact O-CG1 3.24Å; I95-I99 PolarHBondContact O-N 3.08Å; I95-I99 VanDerWaalsContact O-N 3.13Å
96	M	94.7	Very high	94.5	Very high	7 Å²	7	44.2 Å²	44.2	3%	0.034	21%	0.213	C	C	.	.	H	α-helix	trans	-62.1	-41.3	179.6	-67	-46.2	99.7	0	0	111.5	F92 D93 I99 D100 L101 M104 F141	F92-M96 HydrophobicContact CD1-CG 3.73Å; F92-M96 HydrophobicContact CD2-CE 4.09Å; F92-M96 HydrophobicContact CE1-CE 4.34Å; F92-M96 HydrophobicContact CE1-CG 3.46Å; F92-M96 VanDerWaalsContact CE1-CG 3.46Å; F92-M96 HydrophobicContact CE1-SD 3.94Å; F92-M96 HydrophobicContact CE2-CE 3.77Å; F92-M96 HydrophobicContact CE2-SD 4.23Å; F92-M96 HydrophobicContact CG-CG 4.4Å; F92-M96 HydrophobicContact CZ-CE 3.92Å; F92-M96 HydrophobicContact CZ-CG 3.92Å; F92-M96 HydrophobicContact CZ-SD 3.74Å; F92-M96 WeakPolarHBondContact O-CG 3.16Å; F92-M96 PolarHBondContact O-N 3.24Å; D93-M96 PolarHBondContact O-N 3.09Å; M96-I99 HydrophobicContact CE-CD1 4.4Å; M96-D100 PolarHBondContact O-N 2.79Å; M96-D100 VanDerWaalsContact O-N 3.12Å; M96-L101 PolarHBondContact O-N 3.39Å; M96-L101 HydrophobicContact SD-CB 4.35Å; M96-L101 HydrophobicContact SD-CD2 3.92Å; M96-L101 HydrophobicContact SD-CG 4.44Å; M96-M104 HydrophobicContact CB-CE 4.09Å; M96-M104 HydrophobicContact CG-CB 3.92Å; M96-M104 HydrophobicContact CG-CE 4.15Å; M96-M104 HydrophobicContact CG-SD 4.29Å; M96-M104 HydrophobicContact SD-CB 3.6Å; M96-M104 VanDerWaalsContact SD-CB 3.6Å; M96-F141 HydrophobicContact CE-CD2 4.02Å; M96-F141 HydrophobicContact CE-CE2 3.35Å; M96-F141 HydrophobicContact CE-CZ 3.99Å; M96-F141 HydrophobicContact SD-CE2 4.35Å
97	Y	93.4	Very high	94.5	Very high	196 Å²	196	44.2 Å²	44.2	77%	0.769	21%	0.211	S	C	*	.	H	α-helix	trans	-65.4	-39.6	174.8	-179.4	-99.9	0	0	0	112.5	D93 I95 I99	D93-Y97 VanDerWaalsContact O-CB 3.27Å; D93-Y97 WeakPolarHBondContact O-CB 3.42Å; D93-Y97 PolarHBondContact O-N 2.82Å; I95-Y97 VanDerWaalsContact C-N 3.32Å; I95-Y97 PolarHBondContact O-N 2.94Å; Y97-I99 VanDerWaalsContact C-N 3.33Å; Y97-I99 PolarHBondContact O-N 3.05Å
98	H	93.3	Very high	94.5	Very high	75 Å²	75	39.7 Å²	39.7	35%	0.347	19%	0.194	S	C	.	.	H	α-helix	trans	-63.1	-37.9	178.5	176.2	34.4	0	0	0	112.9	I56 Q94 I95	I56-H98 HydrophobicContact CD1-CB 3.74Å; Q94-H98 WeakPolarHBondContact O-CB 3.5Å; Q94-H98 PolarHBondContact O-N 3.25Å; I95-H98 WeakPolarHBondContact O-CB 3.3Å; I95-H98 PolarHBondContact O-N 2.77Å; I95-H98 VanDerWaalsContact O-N 3.17Å
99	I	93.1	Very high	94.6	Very high	26 Å²	26	39.9 Å²	39.9	13%	0.133	20%	0.195	C	C	.	.	H	α-helix	trans	-99.7	2.6	-175.2	72.6	178.1	0	0	0	114.5	L72 I95 M96 Y97 L101 F141 F157	L72-I99 HydrophobicContact CD1-CG2 3.8Å; I95-I99 WeakPolarHBondContact O-CG1 3.24Å; I95-I99 PolarHBondContact O-N 3.08Å; I95-I99 VanDerWaalsContact O-N 3.13Å; M96-I99 HydrophobicContact CE-CD1 4.4Å; Y97-I99 VanDerWaalsContact C-N 3.33Å; Y97-I99 PolarHBondContact O-N 3.05Å; I99-L101 VanDerWaalsContact C-N 3.27Å; I99-L101 HydrophobicContact CD1-CB 3.87Å; I99-L101 HydrophobicContact CD1-CD2 3.99Å; I99-L101 HydrophobicContact CG1-CB 3.71Å; I99-L101 PolarHBondContact O-N 2.94Å; I99-F141 HydrophobicContact CD1-CE1 3.91Å; I99-F141 HydrophobicContact CD1-CZ 3.92Å; I99-F157 HydrophobicContact CB-CE1 4.13Å; I99-F157 HydrophobicContact CB-CZ 4.27Å; I99-F157 HydrophobicContact CD1-CE1 4.41Å; I99-F157 HydrophobicContact CG1-CE1 4.25Å; I99-F157 WeakPolarHBondContact O-CE1 3.36Å
100	D	92.3	Very high	94.6	Very high	84 Å²	84	38.7 Å²	38.7	45%	0.449	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.9	36.8	-179	-172.2	50.7	0	0	0	114.5	M96 R385 S388	M96-D100 PolarHBondContact O-N 2.79Å; M96-D100 VanDerWaalsContact O-N 3.12Å; D100-R385 PolarHBondContact O-NH1 3.47Å; D100-R385 PolarHBondContact O-NH2 3.19Å; D100-R385 IonicContact OD1-NH1 2.76Å; D100-R385 PolarHBondContact OD1-NH1 3.26Å; D100-R385 IonicContact OD2-CZ 2.65Å; D100-R385 IonicContact OD2-NH1 3.05Å; D100-R385 PolarHBondContact OD2-NH1 2.93Å; D100-R385 IonicContact OD2-NH2 2.61Å; D100-S388 PolarHBondContact OD2-OG 3.28Å
101	L	91.8	Very high	94.5	Very high	7 Å²	7	36.6 Å²	36.6	4%	0.037	18%	0.177	C	C	.	.			trans	-88.2	116.3	-177.6	179.5	61.4	0	0	0	112.2	M96 I99 M104 F107 F141 F157 L161	M96-L101 PolarHBondContact O-N 3.39Å; M96-L101 HydrophobicContact SD-CB 4.35Å; M96-L101 HydrophobicContact SD-CD2 3.92Å; M96-L101 HydrophobicContact SD-CG 4.44Å; I99-L101 VanDerWaalsContact C-N 3.27Å; I99-L101 HydrophobicContact CD1-CB 3.87Å; I99-L101 HydrophobicContact CD1-CD2 3.99Å; I99-L101 HydrophobicContact CG1-CB 3.71Å; I99-L101 PolarHBondContact O-N 2.94Å; L101-M104 WeakPolarHBondContact O-CE 3.32Å; L101-F107 HydrophobicContact CD1-CE2 4.25Å; L101-F107 HydrophobicContact CD2-CD2 3.65Å; L101-F107 HydrophobicContact CD2-CE2 3.75Å; L101-F107 HydrophobicContact CD2-CG 4.11Å; L101-F107 HydrophobicContact CD2-CZ 4.28Å; L101-F141 HydrophobicContact CD2-CZ 3.77Å; L101-F157 HydrophobicContact CB-CE1 4.4Å; L101-F157 HydrophobicContact CD1-CD1 4.22Å; L101-L161 HydrophobicContact CD1-CD1 4.15Å; L101-L161 HydrophobicContact CD2-CD1 4.09Å
102	V	88.6	Confident	94.2	Very high	70 Å²	70	39.2 Å²	39.2	42%	0.424	19%	0.19	S	C	.	.	S	Bend	trans	-83.3	-45.2	178.5	172.8	0	0	0	0	112.3	M104 E155 R385	V102-M104 PolarHBondContact O-N 3.5Å; V102-E155 HydrophobicContact CB-CG 4.44Å; V102-R385 VanDerWaalsContact CG2-CZ 3.46Å
103	E	91.8	Very high	93.7	Very high	10 Å²	10	39.3 Å²	39.3	5%	0.047	19%	0.191	C	C	.	.			trans	-83.4	43.8	-176.8	-59.9	176.8	114.2	0	0	111.7	D105 Y106 R154 E155 T158	E103-D105 PolarHBondContact O-N 2.99Å; E103-D105 VanDerWaalsContact O-N 3.12Å; E103-Y106 HydrophobicContact CB-CD2 4.02Å; E103-Y106 HydrophobicContact CB-CE2 4.17Å; E103-Y106 WeakPolarHBondContact O-CD2 3.34Å; E103-Y106 PolarHBondContact O-N 3.15Å; E103-R154 WeakPolarHBondContact OE1-CB 3.47Å; E103-R154 PolarHBondContact OE1-N 3.09Å; E103-R154 PolarHBondContact OE2-N 2.92Å; E103-E155 HydrophobicContact CG-CG 4.33Å; E103-E155 WeakPolarHBondContact OE2-CB 3.31Å; E103-E155 PolarHBondContact OE2-N 2.81Å; E103-T158 HydrophobicContact CB-CG2 4.17Å; E103-T158 WeakPolarHBondContact OE2-CB 3.46Å; E103-T158 PolarHBondContact OE2-OG1 3.45Å
104	M	92.9	Very high	93.2	Very high	54 Å²	54	40.2 Å²	40.2	27%	0.266	20%	0.2	S	C	.	.	G	3₁₀ helix	trans	-59.1	-23.3	-175	62.4	-178.1	64.9	0	0	114.5	F92 M96 L101 V102 Y106 F107	F92-M104 HydrophobicContact CE1-CB 4.14Å; F92-M104 HydrophobicContact CE1-CG 4.45Å; F92-M104 HydrophobicContact CE1-SD 4.29Å; F92-M104 HydrophobicContact CZ-CB 4.2Å; M96-M104 HydrophobicContact CB-CE 4.09Å; M96-M104 HydrophobicContact CG-CB 3.92Å; M96-M104 HydrophobicContact CG-CE 4.15Å; M96-M104 HydrophobicContact CG-SD 4.29Å; M96-M104 HydrophobicContact SD-CB 3.6Å; M96-M104 VanDerWaalsContact SD-CB 3.6Å; L101-M104 WeakPolarHBondContact O-CE 3.32Å; V102-M104 PolarHBondContact O-N 3.5Å; M104-Y106 PolarHBondContact O-N 3.38Å; M104-F107 PolarHBondContact O-N 3Å
105	D	92.3	Very high	92.6	Very high	28 Å²	28	42.3 Å²	42.3	15%	0.15	21%	0.213	C	C	.	.	G	3₁₀ helix	trans	-65.5	-21.5	-174.6	-55.6	-81.7	0	0	0	113.5	E103 F107 F145 F345 K373 A378	E103-D105 PolarHBondContact O-N 2.99Å; E103-D105 VanDerWaalsContact O-N 3.12Å; D105-F107 VanDerWaalsContact C-N 3.28Å; D105-F107 PolarHBondContact O-N 2.83Å; D105-F145 WeakPolarHBondContact O-CD2 3.47Å; D105-F345 HydrophobicContact CB-CE2 4.24Å; D105-K373 HydrophobicContact CB-CB 4.43Å; D105-K373 WeakPolarHBondContact OD1-CB 3.42Å; D105-K373 VanDerWaalsContact OD1-CG 3.3Å; D105-K373 WeakPolarHBondContact OD1-CG 3.28Å; D105-K373 IonicContact OD1-NZ 2.8Å; D105-K373 PolarHBondContact OD1-NZ 3.41Å; D105-K373 IonicContact OD2-NZ 3.72Å; D105-K373 PolarHBondContact OD2-NZ 2.92Å; D105-A378 HydrophobicContact CB-CB 4.37Å
106	Y	95.1	Very high	92.1	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	24%	0.238	C	C	.	.	G	3₁₀ helix	trans	-75.1	-12.5	173.2	-64.8	-74.2	0	0	0	113.7	E103 M104 K144 F145 L153 F162 F345 E375 A378	E103-Y106 HydrophobicContact CB-CD2 4.02Å; E103-Y106 HydrophobicContact CB-CE2 4.17Å; E103-Y106 WeakPolarHBondContact O-CD2 3.34Å; E103-Y106 PolarHBondContact O-N 3.15Å; M104-Y106 PolarHBondContact O-N 3.38Å; Y106-K144 WeakPolarHBondContact O-CA 3.32Å; Y106-K144 PolarHBondContact O-N 3.27Å; Y106-F145 WeakPolarHBondContact CD1-O 3.49Å; Y106-F145 PolarHBondContact O-N 3.11Å; Y106-L153 HydrophobicContact CD1-CD2 4.45Å; Y106-L153 HydrophobicContact CD2-CD2 3.92Å; Y106-L153 HydrophobicContact CE1-CD2 4.08Å; Y106-L153 HydrophobicContact CE2-CD2 3.5Å; Y106-L153 VanDerWaalsContact CE2-CD2 3.5Å; Y106-L153 HydrophobicContact CG-CD2 4.38Å; Y106-F162 HydrophobicContact CD1-CZ 4.25Å; Y106-F162 HydrophobicContact CG-CE2 4.34Å; Y106-F162 HydrophobicContact CG-CZ 4.19Å; Y106-F345 AromaticContact CD1-CE1 3.95Å; Y106-F345 HydrophobicContact CD1-CE1 3.95Å; Y106-F345 AromaticContact CD1-CZ 3.58Å; Y106-F345 HydrophobicContact CD1-CZ 3.58Å; Y106-F345 AromaticContact CE1-CE1 3.95Å; Y106-F345 HydrophobicContact CE1-CE1 3.95Å; Y106-F345 AromaticContact CE1-CZ 3.68Å; Y106-F345 HydrophobicContact CE1-CZ 3.68Å; Y106-F345 HydrophobicContact CG-CZ 4.36Å; Y106-E375 HydrophobicContact CE1-CG 4.14Å; Y106-A378 HydrophobicContact CE2-CB 4.47Å
107	F	96.6	Very high	91.6	Very high	9 Å²	9	49.5 Å²	49.5	4%	0.039	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	167.7	-167.1	-61.9	-96.6	0	0	0	113.3	L73 L101 M104 D105 F141 R142 V143 T158 L161 F162	L73-F107 HydrophobicContact CD1-CD1 4.35Å; L73-F107 HydrophobicContact CD1-CE1 4.02Å; L101-F107 HydrophobicContact CD1-CE2 4.25Å; L101-F107 HydrophobicContact CD2-CD2 3.65Å; L101-F107 HydrophobicContact CD2-CE2 3.75Å; L101-F107 HydrophobicContact CD2-CG 4.11Å; L101-F107 HydrophobicContact CD2-CZ 4.28Å; M104-F107 PolarHBondContact O-N 3Å; D105-F107 VanDerWaalsContact C-N 3.28Å; D105-F107 PolarHBondContact O-N 2.83Å; F107-F141 HydrophobicContact CB-CE2 3.49Å; F107-F141 VanDerWaalsContact CB-CE2 3.49Å; F107-F141 HydrophobicContact CB-CZ 3.63Å; F107-F141 AromaticContact CD1-CE1 3.75Å; F107-F141 HydrophobicContact CD1-CE1 3.75Å; F107-F141 HydrophobicContact CD1-CE2 4.01Å; F107-F141 AromaticContact CD1-CZ 3.34Å; F107-F141 HydrophobicContact CD1-CZ 3.34Å; F107-F141 HydrophobicContact CD2-CZ 4.42Å; F107-F141 HydrophobicContact CE1-CE1 4.16Å; F107-F141 HydrophobicContact CE1-CZ 4.07Å; F107-F141 HydrophobicContact CG-CE1 4.4Å; F107-F141 AromaticContact CG-CE2 3.98Å; F107-F141 HydrophobicContact CG-CE2 3.98Å; F107-F141 AromaticContact CG-CZ 3.55Å; F107-F141 HydrophobicContact CG-CZ 3.55Å; F107-R142 WeakPolarHBondContact CA-O 3.44Å; F107-V143 HydrophobicContact CD1-CG2 4.09Å; F107-V143 HydrophobicContact CE1-CG2 3.7Å; F107-V143 HydrophobicContact CZ-CG2 4.45Å; F107-T158 HydrophobicContact CE2-CG2 4.01Å; F107-T158 HydrophobicContact CZ-CG2 4.16Å; F107-L161 HydrophobicContact CE1-CB 3.88Å; F107-L161 HydrophobicContact CE1-CD1 4.13Å; F107-L161 HydrophobicContact CZ-CB 3.9Å; F107-L161 HydrophobicContact CZ-CD1 3.97Å; F107-F162 HydrophobicContact CE1-CD2 4.41Å; F107-F162 HydrophobicContact CE1-CE2 4.45Å; F107-F162 HydrophobicContact CE2-CE2 4.17Å; F107-F162 AromaticContact CZ-CD2 3.87Å; F107-F162 HydrophobicContact CZ-CD2 3.87Å; F107-F162 AromaticContact CZ-CE2 3.84Å; F107-F162 HydrophobicContact CZ-CE2 3.84Å
108	G	96.7	Very high	91.4	Very high	7 Å²	7	41.8 Å²	41.8	7%	0.072	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158	171.8	174.9	0	0	0	0	0	113.1	R142	G108-R142 PolarHBondContact N-O 2.89Å; G108-R142 PolarHBondContact O-N 2.85Å
109	L	97.4	Very high	91.2	Very high	4 Å²	4	39.7 Å²	39.7	2%	0.021	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	127.9	167.8	-66	170.1	0	0	0	108.9	V70 L91 F92 L121 L139 F140 F141	V70-L109 HydrophobicContact CG1-CD2 3.51Å; V70-L109 HydrophobicContact CG2-CD2 4.38Å; L91-L109 HydrophobicContact CD2-CD1 3.93Å; L91-L109 HydrophobicContact CG-CD1 3.88Å; F92-L109 HydrophobicContact CB-CD1 4.31Å; F92-L109 HydrophobicContact CD2-CD1 4.27Å; F92-L109 HydrophobicContact CD2-CG 4.18Å; L109-L121 HydrophobicContact CB-CB 4.1Å; L109-L121 HydrophobicContact CB-CD2 4.01Å; L109-L121 HydrophobicContact CD1-CD2 3.91Å; L109-L121 WeakPolarHBondContact O-CB 3.47Å; L109-L121 PolarHBondContact O-N 2.88Å; L109-L139 HydrophobicContact CB-CD2 4.02Å; L109-L139 HydrophobicContact CD1-CD2 4.37Å; L109-F140 WeakPolarHBondContact CA-O 3.33Å; L109-F141 HydrophobicContact CD2-CB 4.25Å; L109-F141 HydrophobicContact CD2-CD2 4.32Å
110	Q	95.7	Very high	91.3	Very high	41 Å²	41	40.7 Å²	40.7	19%	0.192	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	152.4	168.7	-67.2	-171.6	-14	0	0	110.7	S118 H119 W120 L139 F140 R142	Q110-S118 PolarHBondContact OE1-OG 2.91Å; Q110-H119 CarbonylContact C-O 3.59Å; Q110-H119 VanDerWaalsContact CA-O 3.31Å; Q110-H119 WeakPolarHBondContact CA-O 3.32Å; Q110-W120 HydrophobicContact CG-CD2 3.89Å; Q110-W120 HydrophobicContact CG-CE3 3.47Å; Q110-W120 VanDerWaalsContact CG-CE3 3.47Å; Q110-W120 HydrophobicContact CG-CH2 3.79Å; Q110-W120 HydrophobicContact CG-CZ2 4.19Å; Q110-W120 HydrophobicContact CG-CZ3 3.42Å; Q110-W120 VanDerWaalsContact CG-CZ3 3.42Å; Q110-W120 VanDerWaalsContact NE2-CH2 3.29Å; Q110-L139 CarbonylContact O-C 3.57Å; Q110-L139 WeakPolarHBondContact O-CA 3.45Å; Q110-L139 WeakPolarHBondContact O-CB 3.49Å; Q110-F140 HydrophobicContact CB-CB 4.5Å; Q110-F140 PolarHBondContact N-O 3.36Å; Q110-F140 PolarHBondContact O-N 3.09Å; Q110-R142 HydrophobicContact CG-CB 4.44Å; Q110-R142 HydrophobicContact CG-CG 4.19Å
111	F	94.3	Very high	91.4	Very high	12 Å²	12	37.4 Å²	37.4	5%	0.053	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	155.6	163.9	66.8	-83.1	0	0	0	108.8	H119 L121 Q130 I131 L139	F111-H119 HydrophobicContact CD1-CB 4.35Å; F111-H119 VanDerWaalsContact CD1-O 3.3Å; F111-H119 WeakPolarHBondContact CD1-O 3.22Å; F111-H119 HydrophobicContact CE1-CB 3.86Å; F111-H119 HydrophobicContact CE2-CB 4.16Å; F111-H119 HydrophobicContact CZ-CB 3.76Å; F111-H119 PolarHBondContact N-O 3.24Å; F111-H119 PolarHBondContact O-N 2.83Å; F111-L121 HydrophobicContact CD1-CD1 4.36Å; F111-L121 HydrophobicContact CE1-CD1 4.41Å; F111-Q130 HydrophobicContact CE1-CB 4.43Å; F111-Q130 WeakPolarHBondContact CE2-O 3.42Å; F111-Q130 HydrophobicContact CZ-CB 4.24Å; F111-I131 HydrophobicContact CB-CD1 3.86Å; F111-I131 HydrophobicContact CB-CG1 4.19Å; F111-I131 HydrophobicContact CD1-CD1 4.26Å; F111-I131 HydrophobicContact CD1-CG1 4.06Å; F111-I131 HydrophobicContact CD2-CB 4.41Å; F111-I131 HydrophobicContact CD2-CD1 4.42Å; F111-I131 HydrophobicContact CD2-CG1 3.79Å; F111-I131 HydrophobicContact CD2-CG2 4.29Å; F111-I131 HydrophobicContact CE1-CG1 4.4Å; F111-I131 HydrophobicContact CE2-CG1 4.14Å; F111-I131 HydrophobicContact CG-CD1 3.94Å; F111-I131 HydrophobicContact CG-CG1 3.75Å; F111-I131 HydrophobicContact CZ-CG1 4.43Å; F111-L139 HydrophobicContact CB-CG 4.38Å
112	M	90.9	Very high	91.4	Very high	54 Å²	54	38.7 Å²	38.7	27%	0.266	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	146.1	171.7	-60.4	-175.4	-57.7	0	0	109	A44 V117 F140	A44-M112 HydrophobicContact CB-CE 4.26Å; A44-M112 HydrophobicContact CB-SD 3.98Å; M112-V117 WeakPolarHBondContact CA-O 3.18Å; M112-F140 HydrophobicContact CE-CE2 4.12Å; M112-F140 HydrophobicContact CE-CZ 4.21Å; M112-F140 HydrophobicContact CG-CE2 4.3Å; M112-F140 HydrophobicContact SD-CE2 4.49Å
113	D	85.9	Confident	91.6	Very high	13 Å²	13	38.3 Å²	38.3	7%	0.07	20%	0.199	C	C	.	.			trans	-95.2	-175.7	170.5	74.4	-0.7	0	0	0	112.6	D115 Q116 V117 H119 K330	D113-D115 PolarHBondContact O-N 2.77Å; D113-D115 WeakPolarHBondContact OD1-CB 3.49Å; D113-D115 PolarHBondContact OD1-N 3.01Å; D113-Q116 WeakPolarHBondContact O-CA 3.35Å; D113-Q116 PolarHBondContact O-N 2.86Å; D113-Q116 PolarHBondContact O-NE2 3.06Å; D113-V117 PolarHBondContact N-O 2.84Å; D113-V117 VanDerWaalsContact N-O 3.09Å; D113-V117 PolarHBondContact OD1-N 2.9Å; D113-H119 IonicContact OD2-CD2 2.77Å; D113-K330 WeakPolarHBondContact OD2-CE 3.49Å; D113-K330 IonicContact OD2-NZ 3.23Å; D113-K330 PolarHBondContact OD2-NZ 3.01Å
114	T	86.4	Confident	91.6	Very high	89 Å²	89	41.6 Å²	41.6	55%	0.546	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.5	-31	178.8	47.3	0	0	0	0	113	Q116 E133	T114-Q116 PolarHBondContact O-N 2.85Å; T114-E133 WeakPolarHBondContact CA-OE1 3.3Å; T114-E133 VanDerWaalsContact CG2-OE1 3.31Å; T114-E133 WeakPolarHBondContact CG2-OE1 3.15Å
115	D	84.5	Confident	91.6	Very high	103 Å²	103	43.8 Å²	43.8	55%	0.551	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.1	6.2	-173.3	-41.6	-23.6	0	0	0	110.6	D113 V117 K330	D113-D115 PolarHBondContact O-N 2.77Å; D113-D115 WeakPolarHBondContact OD1-CB 3.49Å; D113-D115 PolarHBondContact OD1-N 3.01Å; D115-V117 HydrophobicContact CB-CG2 4.08Å; D115-V117 PolarHBondContact O-N 3.25Å; D115-K330 IonicContact OD2-NZ 3.61Å; D115-K330 PolarHBondContact OD2-NZ 3.42Å
116	Q	86.3	Confident	91.7	Very high	115 Å²	115	45.2 Å²	45.2	54%	0.537	24%	0.239	S	C	.	.			trans	57.6	20.2	-169	-57.9	-58.2	-71.2	0	0	114.3	D113 T114	D113-Q116 WeakPolarHBondContact O-CA 3.35Å; D113-Q116 PolarHBondContact O-N 2.86Å; D113-Q116 PolarHBondContact O-NE2 3.06Å; T114-Q116 PolarHBondContact O-N 2.85Å
117	V	84.4	Confident	91.7	Very high	43 Å²	43	45.2 Å²	45.2	26%	0.261	24%	0.239	S	C	.	.			trans	-82.5	130.2	176.7	-178.1	0	0	0	0	109.4	M112 D113 D115 H119	M112-V117 WeakPolarHBondContact CA-O 3.18Å; D113-V117 PolarHBondContact N-O 2.84Å; D113-V117 VanDerWaalsContact N-O 3.09Å; D113-V117 PolarHBondContact OD1-N 2.9Å; D115-V117 HydrophobicContact CB-CG2 4.08Å; D115-V117 PolarHBondContact O-N 3.25Å; V117-H119 WeakPolarHBondContact CG1-NE2 3.44Å
118	S	88.9	Confident	91.5	Very high	33 Å²	33	51.8 Å²	51.8	23%	0.231	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	136	176.8	-172.3	0	0	0	0	111.9	Q110	Q110-S118 PolarHBondContact OE1-OG 2.91Å
119	H	90.3	Very high	91.3	Very high	31 Å²	31	59.4 Å²	59.4	14%	0.144	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	132.1	179.8	-68.8	-30.5	0	0	0	111.6	Q110 F111 D113 V117 H334	Q110-H119 CarbonylContact C-O 3.59Å; Q110-H119 VanDerWaalsContact CA-O 3.31Å; Q110-H119 WeakPolarHBondContact CA-O 3.32Å; F111-H119 HydrophobicContact CD1-CB 4.35Å; F111-H119 VanDerWaalsContact CD1-O 3.3Å; F111-H119 WeakPolarHBondContact CD1-O 3.22Å; F111-H119 HydrophobicContact CE1-CB 3.86Å; F111-H119 HydrophobicContact CE2-CB 4.16Å; F111-H119 HydrophobicContact CZ-CB 3.76Å; F111-H119 PolarHBondContact N-O 3.24Å; F111-H119 PolarHBondContact O-N 2.83Å; D113-H119 IonicContact OD2-CD2 2.77Å; V117-H119 WeakPolarHBondContact CG1-NE2 3.44Å; H119-H334 AromaticContact CE1-CE1 2.79Å; H119-H334 PolarHBondContact CE1-CE1 2.89Å; H119-H334 AromaticContact CE1-ND1 3.14Å; H119-H334 PolarHBondContact CE1-ND1 2.88Å; H119-H334 AromaticContact CE1-NE2 3.85Å; H119-H334 AromaticContact ND1-CE1 3.36Å; H119-H334 PolarHBondContact ND1-CE1 3.01Å; H119-H334 AromaticContact ND1-ND1 3.33Å; H119-H334 PolarHBondContact ND1-ND1 3.06Å; H119-H334 AromaticContact NE2-ND1 3.75Å
120	W	93.6	Very high	91	Very high	48 Å²	48	60.7 Å²	60.7	18%	0.182	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	132.5	169.2	-66.5	111.1	0	0	0	111.1	Q110 D122 R142 V143 K144	Q110-W120 HydrophobicContact CG-CD2 3.89Å; Q110-W120 HydrophobicContact CG-CE3 3.47Å; Q110-W120 VanDerWaalsContact CG-CE3 3.47Å; Q110-W120 HydrophobicContact CG-CH2 3.79Å; Q110-W120 HydrophobicContact CG-CZ2 4.19Å; Q110-W120 HydrophobicContact CG-CZ3 3.42Å; Q110-W120 VanDerWaalsContact CG-CZ3 3.42Å; Q110-W120 VanDerWaalsContact NE2-CH2 3.29Å; W120-D122 PolarHBondContact O-N 2.86Å; W120-R142 HydrophobicContact CH2-CB 3.81Å; W120-R142 HydrophobicContact CZ3-CB 4.06Å; W120-V143 WeakPolarHBondContact CH2-O 3.36Å; W120-K144 HydrophobicContact CD2-CD 3.92Å; W120-K144 HydrophobicContact CD2-CG 4.06Å; W120-K144 HydrophobicContact CE3-CB 4.32Å; W120-K144 HydrophobicContact CE3-CD 4Å; W120-K144 HydrophobicContact CE3-CG 4.21Å; W120-K144 HydrophobicContact CG-CD 4.39Å; W120-K144 VanDerWaalsContact CH2-CA 3.42Å; W120-K144 HydrophobicContact CH2-CB 3.51Å; W120-K144 HydrophobicContact CH2-CG 3.9Å; W120-K144 HydrophobicContact CZ2-CB 3.81Å; W120-K144 HydrophobicContact CZ2-CD 4.47Å; W120-K144 HydrophobicContact CZ2-CG 3.7Å; W120-K144 HydrophobicContact CZ3-CB 3.78Å; W120-K144 HydrophobicContact CZ3-CD 4.32Å; W120-K144 HydrophobicContact CZ3-CG 4.14Å
121	L	94.8	Very high	90.8	Very high	14 Å²	14	59 Å²	59	7%	0.073	30%	0.297	C	S	.	.			trans	-66.5	122.5	174.8	-173.6	69.5	0	0	0	110.8	L109 F111 M123 L127 Q130 L139	L109-L121 HydrophobicContact CB-CB 4.1Å; L109-L121 HydrophobicContact CB-CD2 4.01Å; L109-L121 HydrophobicContact CD1-CD2 3.91Å; L109-L121 WeakPolarHBondContact O-CB 3.47Å; L109-L121 PolarHBondContact O-N 2.88Å; F111-L121 HydrophobicContact CD1-CD1 4.36Å; F111-L121 HydrophobicContact CE1-CD1 4.41Å; L121-M123 PolarHBondContact O-N 3Å; L121-M123 VanDerWaalsContact O-N 3.17Å; L121-L127 HydrophobicContact CD1-CD2 4.08Å; L121-L127 HydrophobicContact CD2-CD2 4.09Å; L121-Q130 HydrophobicContact CD1-CB 4.48Å; L121-L139 HydrophobicContact CD1-CD2 4.35Å; L121-L139 HydrophobicContact CD2-CD2 3.83Å
122	D	92.6	Very high	90.2	Very high	34 Å²	34	63 Å²	63	18%	0.182	32%	0.324	C	S	.	.			trans	-77.4	102.8	172	-169.1	-41	0	0	0	108.8	W120 S124 K125 Q130	W120-D122 PolarHBondContact O-N 2.86Å; D122-S124 PolarHBondContact O-N 2.89Å; D122-S124 VanDerWaalsContact O-N 3.08Å; D122-S124 WeakPolarHBondContact OD1-CB 3.49Å; D122-S124 PolarHBondContact OD1-N 3.03Å; D122-S124 VanDerWaalsContact OD1-N 3.15Å; D122-S124 PolarHBondContact OD1-OG 3.15Å; D122-K125 HydrophobicContact CB-CB 4.47Å; D122-K125 HydrophobicContact CB-CD 4.05Å; D122-K125 HydrophobicContact CB-CG 4.25Å; D122-K125 PolarHBondContact O-N 2.67Å; D122-K125 WeakPolarHBondContact OD2-CE 3.23Å; D122-K125 IonicContact OD2-NZ 2.71Å; D122-K125 PolarHBondContact OD2-NZ 2.89Å; D122-Q130 PolarHBondContact O-NE2 2.99Å
123	M	92.4	Very high	89.7	Confident	62 Å²	62	65.2 Å²	65.2	31%	0.305	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-25.7	-175.4	-61.4	-174.6	-66.8	0	0	112.9	Q89 F92 L121 K125	Q89-M123 HydrophobicContact CB-CB 4.18Å; Q89-M123 WeakPolarHBondContact CB-O 3.21Å; Q89-M123 PolarHBondContact N-O 2.93Å; F92-M123 HydrophobicContact CB-SD 4.2Å; F92-M123 HydrophobicContact CD1-SD 3.95Å; F92-M123 HydrophobicContact CD2-SD 4.18Å; F92-M123 HydrophobicContact CE1-SD 4.34Å; F92-M123 HydrophobicContact CG-SD 3.85Å; L121-M123 PolarHBondContact O-N 3Å; L121-M123 VanDerWaalsContact O-N 3.17Å; M123-K125 VanDerWaalsContact C-N 3.29Å; M123-K125 PolarHBondContact O-N 2.86Å
124	S	91.1	Very high	89.1	Confident	80 Å²	80	66.5 Å²	66.5	56%	0.559	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.9	-19.3	179.4	77.1	0	0	0	0	114.3	D122	D122-S124 PolarHBondContact O-N 2.89Å; D122-S124 VanDerWaalsContact O-N 3.08Å; D122-S124 WeakPolarHBondContact OD1-CB 3.49Å; D122-S124 PolarHBondContact OD1-N 3.03Å; D122-S124 VanDerWaalsContact OD1-N 3.15Å; D122-S124 PolarHBondContact OD1-OG 3.15Å
125	K	94	Very high	88.5	Confident	99 Å²	99	66.3 Å²	66.3	43%	0.43	35%	0.351	S	S	.	.	S	Bend	trans	-105.2	155.5	-170.2	-66	-178.7	-170.6	125.8	0	113.1	K87 G88 D122 M123 Q130	K87-K125 CarbonylContact C-O 3.47Å; K87-K125 VanDerWaalsContact CA-O 3.23Å; K87-K125 WeakPolarHBondContact CA-O 3.49Å; G88-K125 PolarHBondContact N-O 3.38Å; D122-K125 HydrophobicContact CB-CB 4.47Å; D122-K125 HydrophobicContact CB-CD 4.05Å; D122-K125 HydrophobicContact CB-CG 4.25Å; D122-K125 PolarHBondContact O-N 2.67Å; D122-K125 WeakPolarHBondContact OD2-CE 3.23Å; D122-K125 IonicContact OD2-NZ 2.71Å; D122-K125 PolarHBondContact OD2-NZ 2.89Å; M123-K125 VanDerWaalsContact C-N 3.29Å; M123-K125 PolarHBondContact O-N 2.86Å; K125-Q130 HydrophobicContact CB-CG 4.03Å; K125-Q130 HydrophobicContact CD-CG 4.29Å; K125-Q130 PolarHBondContact O-NE2 3.01Å
126	L	94.6	Very high	88.4	Confident	59 Å²	59	64.3 Å²	64.3	31%	0.309	34%	0.343	S	S	.	.	B	Isolated β-bridge	trans	-60.3	134.6	172.7	-59.1	-178.4	0	0	0	111.7	K85 S86 K87 K128 K129	K85-L126 WeakPolarHBondContact O-CD2 3.33Å; S86-L126 WeakPolarHBondContact O-CA 3.32Å; K87-L126 HydrophobicContact CG-CD2 4.18Å; L126-K128 PolarHBondContact O-N 2.85Å; L126-K129 HydrophobicContact CB-CB 4.22Å; L126-K129 HydrophobicContact CB-CD 4.34Å; L126-K129 HydrophobicContact CB-CG 4.12Å; L126-K129 HydrophobicContact CD1-CD 4.06Å; L126-K129 HydrophobicContact CD1-CG 4.4Å; L126-K129 PolarHBondContact O-N 2.81Å
127	L	94.1	Very high	88.7	Confident	0 Å²	0	59 Å²	59	0%	0	32%	0.318	C	S	.	.	G	3₁₀ helix	trans	-54.2	-52.2	179.2	-72.6	153.2	0	0	0	111.8	I66 L82 S86 L91 L121 K129 Q130 I131	I66-L127 HydrophobicContact CD1-CB 4.03Å; I66-L127 HydrophobicContact CD1-CD1 3.84Å; L82-L127 HydrophobicContact CD1-CD1 3.88Å; S86-L127 PolarHBondContact O-N 2.84Å; S86-L127 VanDerWaalsContact O-N 3.1Å; L91-L127 HydrophobicContact CB-CD1 4.28Å; L91-L127 HydrophobicContact CB-CD2 4.42Å; L91-L127 HydrophobicContact CD2-CD2 3.81Å; L121-L127 HydrophobicContact CD1-CD2 4.08Å; L121-L127 HydrophobicContact CD2-CD2 4.09Å; L127-K129 PolarHBondContact O-N 2.81Å; L127-Q130 PolarHBondContact O-N 3.29Å; L127-I131 PolarHBondContact O-N 2.94Å; L127-I131 VanDerWaalsContact O-N 3.1Å
128	K	92.2	Very high	89.1	Confident	146 Å²	146	65.8 Å²	65.8	64%	0.635	34%	0.339	S	S	*	.	G	3₁₀ helix	trans	-62.2	-6.3	177.1	-174.3	161.4	-177.7	166.6	0	115.1	L126 Y137	L126-K128 PolarHBondContact O-N 2.85Å; K128-Y137 WeakPolarHBondContact CB-OH 3.29Å; K128-Y137 WeakPolarHBondContact CG-OH 3.19Å
129	K	92.4	Very high	89.5	Confident	168 Å²	168	64.3 Å²	64.3	73%	0.73	33%	0.329	S	S	*	.	G	3₁₀ helix	trans	-103.2	-0	173.2	-71.1	-169.4	174.2	-177.1	0	113.6	L126 L127	L126-K129 HydrophobicContact CB-CB 4.22Å; L126-K129 HydrophobicContact CB-CD 4.34Å; L126-K129 HydrophobicContact CB-CG 4.12Å; L126-K129 HydrophobicContact CD1-CD 4.06Å; L126-K129 HydrophobicContact CD1-CG 4.4Å; L126-K129 PolarHBondContact O-N 2.81Å; L127-K129 PolarHBondContact O-N 2.81Å
130	Q	91.9	Very high	89.9	Confident	30 Å²	30	64.7 Å²	64.7	14%	0.14	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-118.4	-45.2	-177.9	-61.9	-170.1	83.2	0	0	111.5	F111 L121 D122 K125 L127 P132	F111-Q130 HydrophobicContact CE1-CB 4.43Å; F111-Q130 WeakPolarHBondContact CE2-O 3.42Å; F111-Q130 HydrophobicContact CZ-CB 4.24Å; L121-Q130 HydrophobicContact CD1-CB 4.48Å; D122-Q130 PolarHBondContact O-NE2 2.99Å; K125-Q130 HydrophobicContact CB-CG 4.03Å; K125-Q130 HydrophobicContact CD-CG 4.29Å; K125-Q130 PolarHBondContact O-NE2 3.01Å; L127-Q130 PolarHBondContact O-N 3.29Å; Q130-P132 WeakPolarHBondContact O-CD 3.47Å
131	I	91.3	Very high	90.1	Very high	5 Å²	5	62.5 Å²	62.5	3%	0.026	32%	0.322	C	S	.	.			trans	-102.7	104.7	179.2	-44.3	-178.5	0	0	0	106.6	F111 L127 E133 Y137 L139	F111-I131 HydrophobicContact CB-CD1 3.86Å; F111-I131 HydrophobicContact CB-CG1 4.19Å; F111-I131 HydrophobicContact CD1-CD1 4.26Å; F111-I131 HydrophobicContact CD1-CG1 4.06Å; F111-I131 HydrophobicContact CD2-CB 4.41Å; F111-I131 HydrophobicContact CD2-CD1 4.42Å; F111-I131 HydrophobicContact CD2-CG1 3.79Å; F111-I131 HydrophobicContact CD2-CG2 4.29Å; F111-I131 HydrophobicContact CE1-CG1 4.4Å; F111-I131 HydrophobicContact CE2-CG1 4.14Å; F111-I131 HydrophobicContact CG-CD1 3.94Å; F111-I131 HydrophobicContact CG-CG1 3.75Å; F111-I131 HydrophobicContact CZ-CG1 4.43Å; L127-I131 PolarHBondContact O-N 2.94Å; L127-I131 VanDerWaalsContact O-N 3.1Å; I131-E133 VanDerWaalsContact C-N 3.33Å; I131-E133 WeakPolarHBondContact CG2-O 3.38Å; I131-Y137 HydrophobicContact CB-CD1 3.76Å; I131-Y137 HydrophobicContact CB-CE1 4.28Å; I131-Y137 HydrophobicContact CB-CG 4.48Å; I131-Y137 HydrophobicContact CG2-CD1 3.73Å; I131-Y137 WeakPolarHBondContact O-CE1 3.36Å; I131-L139 HydrophobicContact CD1-CD1 3.95Å; I131-L139 HydrophobicContact CD1-CD2 3.92Å; I131-L139 HydrophobicContact CD1-CG 3.87Å
132	P	81.9	Confident	90.2	Very high	98 Å²	98	62.5 Å²	62.5	64%	0.636	32%	0.321	S	S	*	.			trans	-74.4	-28.2	176.6	30.1	-33.6	0	0	0	111.7	Q130 G134	Q130-P132 WeakPolarHBondContact O-CD 3.47Å; P132-G134 PolarHBondContact O-N 2.86Å
133	E	80.1	Confident	90.4	Very high	99 Å²	99	61 Å²	61	46%	0.463	31%	0.313	S	S	.	.	S	Bend	trans	-84.2	101.9	-179.7	-67.1	-178.7	-160.4	0	0	111.5	T114 I131 Y137	T114-E133 WeakPolarHBondContact CA-OE1 3.3Å; T114-E133 VanDerWaalsContact CG2-OE1 3.31Å; T114-E133 WeakPolarHBondContact CG2-OE1 3.15Å; I131-E133 VanDerWaalsContact C-N 3.33Å; I131-E133 WeakPolarHBondContact CG2-O 3.38Å; E133-Y137 WeakPolarHBondContact O-CD1 3.13Å
134	G	72.6	Confident	90.6	Very high	40 Å²	40	60.4 Å²	60.4	41%	0.412	31%	0.309	S	S	.	.			trans	155.9	-179.5	171.9	0	0	0	0	0	113.5	P132	P132-G134 PolarHBondContact O-N 2.86Å
135	P	74.2	Confident	90.8	Very high	86 Å²	86	57 Å²	57	56%	0.558	28%	0.284	S	S	*	.	S	Bend	cis	-79.5	165.3	2.1	33.9	-36.5	0	0	0	113.5
136	P	82.9	Confident	90.8	Very high	60 Å²	60	53 Å²	53	39%	0.39	27%	0.266	S	S	.	.	S	Bend	cis	-74.5	129.8	-6	30.7	-33.4	0	0	0	111	T67 R69 R138	T67-P136 HydrophobicContact CG2-CB 4.37Å; T67-P136 WeakPolarHBondContact O-CA 3.4Å; R69-P136 HydrophobicContact CG-CB 4.47Å; P136-R138 PolarHBondContact O-N 3.03Å
137	Y	92.4	Very high	90.7	Very high	4 Å²	4	50.1 Å²	50.1	2%	0.016	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	132.7	174.9	-56.9	-66.7	0	0	0	108.9	I66 T67 C68 R69 K128 I131 E133	I66-Y137 HydrophobicContact CB-CD2 4.42Å; I66-Y137 HydrophobicContact CB-CE2 3.86Å; I66-Y137 HydrophobicContact CD1-CD2 4.5Å; I66-Y137 HydrophobicContact CD1-CE2 3.96Å; I66-Y137 HydrophobicContact CG1-CE2 4.44Å; I66-Y137 HydrophobicContact CG2-CE2 3.93Å; T67-Y137 PolarHBondContact O-N 3.46Å; C68-Y137 CarbonylContact C-O 3.49Å; C68-Y137 WeakPolarHBondContact CA-O 3.42Å; R69-Y137 PolarHBondContact N-O 3.33Å; K128-Y137 WeakPolarHBondContact CB-OH 3.29Å; K128-Y137 WeakPolarHBondContact CG-OH 3.19Å; I131-Y137 HydrophobicContact CB-CD1 3.76Å; I131-Y137 HydrophobicContact CB-CE1 4.28Å; I131-Y137 HydrophobicContact CB-CG 4.48Å; I131-Y137 HydrophobicContact CG2-CD1 3.73Å; I131-Y137 WeakPolarHBondContact O-CE1 3.36Å; E133-Y137 WeakPolarHBondContact O-CD1 3.13Å
138	R	93.9	Very high	90.4	Very high	185 Å²	185	52 Å²	52	70%	0.698	26%	0.264	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.9	126.9	179.5	-63.3	-178.3	-178.6	-173.4	0.2	110.3	P136	P136-R138 PolarHBondContact O-N 3.03Å
139	L	96.7	Very high	90.3	Very high	2 Å²	2	48.6 Å²	48.6	1%	0.01	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	160.9	179.1	-58.7	93.3	0	0	0	111.1	C68 R69 V70 L71 L91 L109 Q110 F111 L121 I131	C68-L139 HydrophobicContact CB-CD1 4.23Å; R69-L139 PolarHBondContact O-N 3.18Å; V70-L139 WeakPolarHBondContact CA-O 3.38Å; V70-L139 HydrophobicContact CG2-CB 4.36Å; L71-L139 PolarHBondContact N-O 2.89Å; L91-L139 HydrophobicContact CD2-CD1 3.94Å; L91-L139 HydrophobicContact CD2-CD2 3.86Å; L109-L139 HydrophobicContact CB-CD2 4.02Å; L109-L139 HydrophobicContact CD1-CD2 4.37Å; Q110-L139 CarbonylContact O-C 3.57Å; Q110-L139 WeakPolarHBondContact O-CA 3.45Å; Q110-L139 WeakPolarHBondContact O-CB 3.49Å; F111-L139 HydrophobicContact CB-CG 4.38Å; L121-L139 HydrophobicContact CD1-CD2 4.35Å; L121-L139 HydrophobicContact CD2-CD2 3.83Å; I131-L139 HydrophobicContact CD1-CD1 3.95Å; I131-L139 HydrophobicContact CD1-CD2 3.92Å; I131-L139 HydrophobicContact CD1-CG 3.87Å
140	F	97.3	Very high	90.1	Very high	40 Å²	40	40.6 Å²	40.6	18%	0.175	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	127.5	179.6	-56	-87.6	0	0	0	109.5	L71 L109 Q110 M112 R142	L71-F140 HydrophobicContact CB-CD1 3.95Å; L71-F140 HydrophobicContact CB-CE1 4.36Å; L71-F140 HydrophobicContact CD2-CD1 3.96Å; L71-F140 HydrophobicContact CD2-CE1 3.96Å; L71-F140 HydrophobicContact CG-CD1 4.48Å; L109-F140 WeakPolarHBondContact CA-O 3.33Å; Q110-F140 HydrophobicContact CB-CB 4.5Å; Q110-F140 PolarHBondContact N-O 3.36Å; Q110-F140 PolarHBondContact O-N 3.09Å; M112-F140 HydrophobicContact CE-CE2 4.12Å; M112-F140 HydrophobicContact CE-CZ 4.21Å; M112-F140 HydrophobicContact CG-CE2 4.3Å; M112-F140 HydrophobicContact SD-CE2 4.49Å; F140-R142 HydrophobicContact CB-CG 4.19Å
141	F	98.1	Very high	89.8	Confident	1 Å²	1	44.1 Å²	44.1	0%	0.004	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	128.7	169.9	-178.1	-115.1	0	0	0	109.6	V70 L71 L72 L73 M96 I99 L101 F107 L109 L161	V70-F141 HydrophobicContact CG1-CB 4.13Å; L71-F141 PolarHBondContact O-N 3.03Å; L72-F141 HydrophobicContact CD2-CB 3.8Å; L72-F141 HydrophobicContact CD2-CD1 4.08Å; L72-F141 HydrophobicContact CD2-CG 4.08Å; L73-F141 HydrophobicContact CD1-CD1 3.94Å; L73-F141 HydrophobicContact CD1-CE1 3.97Å; L73-F141 HydrophobicContact CG-CD1 4.04Å; M96-F141 HydrophobicContact CE-CD2 4.02Å; M96-F141 HydrophobicContact CE-CE2 3.35Å; M96-F141 HydrophobicContact CE-CZ 3.99Å; M96-F141 HydrophobicContact SD-CE2 4.35Å; I99-F141 HydrophobicContact CD1-CE1 3.91Å; I99-F141 HydrophobicContact CD1-CZ 3.92Å; L101-F141 HydrophobicContact CD2-CZ 3.77Å; F107-F141 HydrophobicContact CB-CE2 3.49Å; F107-F141 VanDerWaalsContact CB-CE2 3.49Å; F107-F141 HydrophobicContact CB-CZ 3.63Å; F107-F141 AromaticContact CD1-CE1 3.75Å; F107-F141 HydrophobicContact CD1-CE1 3.75Å; F107-F141 HydrophobicContact CD1-CE2 4.01Å; F107-F141 AromaticContact CD1-CZ 3.34Å; F107-F141 HydrophobicContact CD1-CZ 3.34Å; F107-F141 HydrophobicContact CD2-CZ 4.42Å; F107-F141 HydrophobicContact CE1-CE1 4.16Å; F107-F141 HydrophobicContact CE1-CZ 4.07Å; F107-F141 HydrophobicContact CG-CE1 4.4Å; F107-F141 AromaticContact CG-CE2 3.98Å; F107-F141 HydrophobicContact CG-CE2 3.98Å; F107-F141 AromaticContact CG-CZ 3.55Å; F107-F141 HydrophobicContact CG-CZ 3.55Å; L109-F141 HydrophobicContact CD2-CB 4.25Å; L109-F141 HydrophobicContact CD2-CD2 4.32Å; F141-L161 HydrophobicContact CE1-CD1 4.31Å
142	R	97.8	Very high	89.6	Confident	14 Å²	14	47 Å²	47	5%	0.053	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	152.2	-169.7	-63.7	-65	173.9	-122	17.9	111.4	F107 G108 Q110 W120 F140 K144 Q165 Q168	F107-R142 WeakPolarHBondContact CA-O 3.44Å; G108-R142 PolarHBondContact N-O 2.89Å; G108-R142 PolarHBondContact O-N 2.85Å; Q110-R142 HydrophobicContact CG-CB 4.44Å; Q110-R142 HydrophobicContact CG-CG 4.19Å; W120-R142 HydrophobicContact CH2-CB 3.81Å; W120-R142 HydrophobicContact CZ3-CB 4.06Å; F140-R142 HydrophobicContact CB-CG 4.19Å; R142-K144 PolarHBondContact O-N 2.71Å; R142-Q165 VanDerWaalsContact CD-OE1 3.23Å; R142-Q168 VanDerWaalsContact CZ-OE1 3.25Å
143	V	97.3	Very high	90.1	Very high	4 Å²	4	42.4 Å²	42.4	2%	0.024	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	126.3	163.8	-179.2	0	0	0	0	107.7	F107 W120 F145 Y146 F162 Q165	F107-V143 HydrophobicContact CD1-CG2 4.09Å; F107-V143 HydrophobicContact CE1-CG2 3.7Å; F107-V143 HydrophobicContact CZ-CG2 4.45Å; W120-V143 WeakPolarHBondContact CH2-O 3.36Å; V143-F145 WeakPolarHBondContact CG1-O 3.45Å; V143-Y146 HydrophobicContact CB-CE1 4.29Å; V143-Y146 HydrophobicContact CB-CE2 4.15Å; V143-Y146 HydrophobicContact CG1-CD1 4.1Å; V143-Y146 HydrophobicContact CG1-CD2 3.88Å; V143-Y146 HydrophobicContact CG1-CE1 4.14Å; V143-Y146 HydrophobicContact CG1-CE2 3.9Å; V143-Y146 HydrophobicContact CG1-CG 3.96Å; V143-F162 HydrophobicContact CG1-CD2 4.48Å; V143-F162 HydrophobicContact CG1-CE1 3.95Å; V143-F162 HydrophobicContact CG1-CE2 3.9Å; V143-F162 HydrophobicContact CG1-CZ 3.6Å; V143-F162 HydrophobicContact CG2-CD2 3.88Å; V143-F162 HydrophobicContact CG2-CE2 4.01Å; V143-F162 HydrophobicContact CG2-CG 4.22Å; V143-F162 HydrophobicContact CG2-CZ 4.47Å; V143-Q165 HydrophobicContact CB-CB 4.46Å; V143-Q165 HydrophobicContact CB-CG 3.95Å; V143-Q165 HydrophobicContact CG2-CB 3.73Å; V143-Q165 HydrophobicContact CG2-CG 3.78Å
144	K	95.3	Very high	90.5	Very high	49 Å²	49	43.2 Å²	43.2	21%	0.213	22%	0.22	C	C	.	.	S	Bend	trans	-98.7	-44.5	179.5	-179.7	171.4	-177.8	-178.2	0	111.9	Y106 W120 R142 E341	Y106-K144 WeakPolarHBondContact O-CA 3.32Å; Y106-K144 PolarHBondContact O-N 3.27Å; W120-K144 HydrophobicContact CD2-CD 3.92Å; W120-K144 HydrophobicContact CD2-CG 4.06Å; W120-K144 HydrophobicContact CE3-CB 4.32Å; W120-K144 HydrophobicContact CE3-CD 4Å; W120-K144 HydrophobicContact CE3-CG 4.21Å; W120-K144 HydrophobicContact CG-CD 4.39Å; W120-K144 VanDerWaalsContact CH2-CA 3.42Å; W120-K144 HydrophobicContact CH2-CB 3.51Å; W120-K144 HydrophobicContact CH2-CG 3.9Å; W120-K144 HydrophobicContact CZ2-CB 3.81Å; W120-K144 HydrophobicContact CZ2-CD 4.47Å; W120-K144 HydrophobicContact CZ2-CG 3.7Å; W120-K144 HydrophobicContact CZ3-CB 3.78Å; W120-K144 HydrophobicContact CZ3-CD 4.32Å; W120-K144 HydrophobicContact CZ3-CG 4.14Å; R142-K144 PolarHBondContact O-N 2.71Å; K144-E341 WeakPolarHBondContact CE-OE2 3.38Å; K144-E341 IonicContact NZ-OE2 3.71Å; K144-E341 PolarHBondContact NZ-OE2 3.08Å
145	F	94.9	Very high	91.3	Very high	8 Å²	8	42.1 Å²	42.1	4%	0.035	20%	0.204	C	C	.	.	S	Bend	trans	-118.3	114.6	176.1	-55.9	-63.9	0	0	0	107.5	D105 Y106 V143 E341 F345 F346 F370	D105-F145 WeakPolarHBondContact O-CD2 3.47Å; Y106-F145 WeakPolarHBondContact CD1-O 3.49Å; Y106-F145 PolarHBondContact O-N 3.11Å; V143-F145 WeakPolarHBondContact CG1-O 3.45Å; F145-E341 HydrophobicContact CE1-CB 4.37Å; F145-E341 HydrophobicContact CZ-CB 4.15Å; F145-F345 HydrophobicContact CB-CD1 3.57Å; F145-F345 HydrophobicContact CB-CE1 3.41Å; F145-F345 VanDerWaalsContact CB-CE1 3.41Å; F145-F345 HydrophobicContact CB-CE2 4.45Å; F145-F345 HydrophobicContact CB-CG 4.17Å; F145-F345 HydrophobicContact CB-CZ 3.9Å; F145-F345 HydrophobicContact CD1-CB 4.13Å; F145-F345 HydrophobicContact CD1-CD1 4.06Å; F145-F345 HydrophobicContact CD1-CG 4.06Å; F145-F345 HydrophobicContact CD2-CB 4.32Å; F145-F345 AromaticContact CD2-CD1 3.98Å; F145-F345 HydrophobicContact CD2-CD1 3.98Å; F145-F345 AromaticContact CD2-CD2 3.55Å; F145-F345 HydrophobicContact CD2-CD2 3.55Å; F145-F345 HydrophobicContact CD2-CE1 4.17Å; F145-F345 AromaticContact CD2-CE2 3.76Å; F145-F345 HydrophobicContact CD2-CE2 3.76Å; F145-F345 AromaticContact CD2-CG 3.67Å; F145-F345 HydrophobicContact CD2-CG 3.67Å; F145-F345 HydrophobicContact CD2-CZ 4.07Å; F145-F345 HydrophobicContact CE1-CB 4.05Å; F145-F345 HydrophobicContact CE1-CG 4.36Å; F145-F345 HydrophobicContact CE2-CB 4.23Å; F145-F345 AromaticContact CE2-CD2 3.8Å; F145-F345 HydrophobicContact CE2-CD2 3.8Å; F145-F345 HydrophobicContact CE2-CE2 4.35Å; F145-F345 AromaticContact CE2-CG 3.99Å; F145-F345 HydrophobicContact CE2-CG 3.99Å; F145-F345 HydrophobicContact CG-CB 4.27Å; F145-F345 AromaticContact CG-CD1 3.61Å; F145-F345 HydrophobicContact CG-CD1 3.61Å; F145-F345 HydrophobicContact CG-CD2 4.06Å; F145-F345 AromaticContact CG-CE1 3.9Å; F145-F345 HydrophobicContact CG-CE1 3.9Å; F145-F345 HydrophobicContact CG-CE2 4.32Å; F145-F345 AromaticContact CG-CG 3.7Å; F145-F345 HydrophobicContact CG-CG 3.7Å; F145-F345 HydrophobicContact CG-CZ 4.25Å; F145-F345 HydrophobicContact CZ-CB 4.08Å; F145-F345 HydrophobicContact CZ-CD2 4.49Å; F145-F345 HydrophobicContact CZ-CG 4.32Å; F145-F346 HydrophobicContact CB-CE1 4.47Å; F145-F346 HydrophobicContact CB-CE2 4.32Å; F145-F346 HydrophobicContact CB-CZ 3.76Å; F145-F346 HydrophobicContact CD1-CE2 4.04Å; F145-F346 HydrophobicContact CD1-CZ 4.34Å; F145-F346 HydrophobicContact CG-CZ 4.47Å; F145-F370 HydrophobicContact CE2-CE2 4.16Å; F145-F370 HydrophobicContact CZ-CE2 4.06Å
146	Y	95.4	Very high	92.2	Very high	14 Å²	14	40.8 Å²	40.8	6%	0.055	19%	0.19	C	C	.	.			trans	-79.9	124.8	174.3	-67.9	-107	0	0	0	107.3	V143 S148 F162 Q165 L166 D169 Y253 G254 P274 F346	V143-Y146 HydrophobicContact CB-CE1 4.29Å; V143-Y146 HydrophobicContact CB-CE2 4.15Å; V143-Y146 HydrophobicContact CG1-CD1 4.1Å; V143-Y146 HydrophobicContact CG1-CD2 3.88Å; V143-Y146 HydrophobicContact CG1-CE1 4.14Å; V143-Y146 HydrophobicContact CG1-CE2 3.9Å; V143-Y146 HydrophobicContact CG1-CG 3.96Å; Y146-S148 PolarHBondContact O-N 3.03Å; Y146-F162 HydrophobicContact CD1-CE1 4.4Å; Y146-Q165 HydrophobicContact CE1-CG 4.09Å; Y146-Q165 WeakPolarHBondContact OH-CG 3.25Å; Y146-L166 HydrophobicContact CD1-CD2 4.28Å; Y146-L166 HydrophobicContact CE1-CD2 3.91Å; Y146-L166 HydrophobicContact CE1-CG 4.34Å; Y146-D169 PolarHBondContact OH-OD2 3.43Å; Y146-Y253 HydrophobicContact CD1-CE2 4.23Å; Y146-G254 VanDerWaalsContact CG-CA 3.4Å; Y146-P274 WeakPolarHBondContact O-CB 3.35Å; Y146-P274 WeakPolarHBondContact O-CG 3.3Å; Y146-F346 VanDerWaalsContact O-CE1 3.25Å; Y146-F346 WeakPolarHBondContact O-CE1 2.88Å; Y146-F346 VanDerWaalsContact O-CZ 3.23Å; Y146-F346 WeakPolarHBondContact O-CZ 3.5Å
147	S	92.2	Very high	92.7	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	18%	0.178	C	C	.	.			trans	-62.1	138	173.5	-169.7	0	0	0	0	109.7	E149 Y253 E375	S147-E149 VanDerWaalsContact C-N 3.32Å; S147-E149 PolarHBondContact OG-O 2.8Å; S147-Y253 WeakPolarHBondContact O-CE1 3.42Å; S147-Y253 PolarHBondContact O-OH 3.02Å; S147-E375 WeakPolarHBondContact CA-OE1 3.47Å; S147-E375 VanDerWaalsContact CB-OE1 3.25Å; S147-E375 WeakPolarHBondContact CB-OE1 3.38Å; S147-E375 PolarHBondContact OG-OE1 2.79Å
148	S	88.1	Confident	92.8	Very high	38 Å²	38	39.2 Å²	39.2	27%	0.266	18%	0.177	S	C	.	.	S	Bend	trans	-61.7	-43.8	173.2	48.3	0	0	0	0	110.8	Y146	Y146-S148 PolarHBondContact O-N 3.03Å
149	E	88.8	Confident	92.9	Very high	75 Å²	75	32.2 Å²	32.2	35%	0.35	15%	0.151	S	C	.	.	S	Bend	trans	-115.8	101.3	-179.2	-66.6	-54.4	-42.4	0	0	110.8	S147 N151 N152 K248	S147-E149 VanDerWaalsContact C-N 3.32Å; S147-E149 PolarHBondContact OG-O 2.8Å; E149-N151 PolarHBondContact O-N 3.44Å; E149-N152 VanDerWaalsContact O-CB 3.23Å; E149-N152 WeakPolarHBondContact O-CB 3.49Å; E149-N152 PolarHBondContact O-N 3.26Å; E149-K248 IonicContact OE1-NZ 3.75Å; E149-K248 PolarHBondContact OE1-NZ 3.46Å; E149-K248 IonicContact OE2-NZ 2.79Å
150	P	88.1	Confident	92.9	Very high	0 Å²	0	33 Å²	33	0%	0	15%	0.154	C	C	.	.	G	3₁₀ helix	trans	-54.7	-21.4	-179.4	-30.1	37.3	0	0	0	115.6	N152 L153 I241 L244 K248	P150-N152 PolarHBondContact O-N 2.94Å; P150-L153 WeakPolarHBondContact O-CB 3.42Å; P150-L153 PolarHBondContact O-N 3.15Å; P150-I241 HydrophobicContact CB-CD1 3.71Å; P150-L244 HydrophobicContact CB-CB 3.59Å; P150-L244 HydrophobicContact CB-CD1 4.17Å; P150-L244 HydrophobicContact CG-CB 3.77Å; P150-K248 HydrophobicContact CG-CB 4.4Å; P150-K248 HydrophobicContact CG-CD 4.17Å
151	N	87.4	Confident	92.8	Very high	105 Å²	105	31.4 Å²	31.4	56%	0.561	15%	0.147	S	C	*	.	G	3₁₀ helix	trans	-67	-17.8	174.6	-57.7	-25.1	0	0	0	112.7	E149 L153 I241 N245	E149-N151 PolarHBondContact O-N 3.44Å; N151-L153 VanDerWaalsContact C-N 3.33Å; N151-I241 WeakPolarHBondContact OD1-CD1 3.4Å; N151-N245 PolarHBondContact OD1-ND2 3.48Å; N151-N245 VanDerWaalsContact OD1-ND2 3.07Å
152	N	87	Confident	92.8	Very high	64 Å²	64	31.4 Å²	31.4	34%	0.342	15%	0.147	S	C	.	.	G	3₁₀ helix	trans	-74.6	-21.3	173.4	-70.1	-14.8	0	0	0	113	E149 P150 R154 T379	E149-N152 VanDerWaalsContact O-CB 3.23Å; E149-N152 WeakPolarHBondContact O-CB 3.49Å; E149-N152 PolarHBondContact O-N 3.26Å; P150-N152 PolarHBondContact O-N 2.94Å; N152-R154 PolarHBondContact O-N 3.41Å; N152-T379 HydrophobicContact CB-CG2 3.87Å
153	L	90.9	Very high	92.8	Very high	2 Å²	2	30.9 Å²	30.9	1%	0.01	15%	0.146	C	C	.	.			trans	-75.3	104.2	178.4	-56.3	178.6	0	0	0	108.9	Y106 P150 N151 T158 R159 F162 L244	Y106-L153 HydrophobicContact CD1-CD2 4.45Å; Y106-L153 HydrophobicContact CD2-CD2 3.92Å; Y106-L153 HydrophobicContact CE1-CD2 4.08Å; Y106-L153 HydrophobicContact CE2-CD2 3.5Å; Y106-L153 VanDerWaalsContact CE2-CD2 3.5Å; Y106-L153 HydrophobicContact CG-CD2 4.38Å; P150-L153 WeakPolarHBondContact O-CB 3.42Å; P150-L153 PolarHBondContact O-N 3.15Å; N151-L153 VanDerWaalsContact C-N 3.33Å; L153-T158 HydrophobicContact CB-CG2 4.28Å; L153-T158 HydrophobicContact CD1-CG2 4.39Å; L153-T158 HydrophobicContact CD2-CG2 3.93Å; L153-T158 HydrophobicContact CG-CG2 4.43Å; L153-R159 HydrophobicContact CB-CG 3.78Å; L153-R159 HydrophobicContact CD1-CG 4.29Å; L153-R159 PolarHBondContact O-NH1 2.93Å; L153-F162 HydrophobicContact CD1-CB 4.46Å; L153-F162 HydrophobicContact CD1-CD1 3.83Å; L153-F162 HydrophobicContact CD1-CD2 4.02Å; L153-F162 HydrophobicContact CD1-CE1 3.96Å; L153-F162 HydrophobicContact CD1-CE2 4.15Å; L153-F162 HydrophobicContact CD1-CG 3.86Å; L153-F162 HydrophobicContact CD1-CZ 4.11Å; L153-F162 HydrophobicContact CD2-CE2 4.25Å; L153-F162 HydrophobicContact CD2-CZ 4.12Å; L153-L244 HydrophobicContact CD1-CD1 4.31Å
154	R	88.4	Confident	92.8	Very high	117 Å²	117	31.9 Å²	31.9	44%	0.442	15%	0.151	S	C	.	.			trans	-76.4	-44.5	-169.4	-67.4	-179.7	165	-172.1	-3.9	112.3	E103 N152 R159 T379 G382	E103-R154 WeakPolarHBondContact OE1-CB 3.47Å; E103-R154 PolarHBondContact OE1-N 3.09Å; E103-R154 PolarHBondContact OE2-N 2.92Å; N152-R154 PolarHBondContact O-N 3.41Å; R154-R159 PolarHBondContact O-NH1 3.34Å; R154-T379 PolarHBondContact NE-O 3.32Å; R154-T379 PolarHBondContact NH1-O 2.95Å; R154-T379 VanDerWaalsContact NH1-O 3.09Å; R154-T379 PolarHBondContact NH2-O 3.12Å; R154-G382 PolarHBondContact NH1-O 2.91Å
155	E	90.1	Very high	93	Very high	16 Å²	16	29.9 Å²	29.9	8%	0.075	14%	0.142	C	C	.	.	S	Bend	trans	-80	136.2	-176.4	-65.3	-76	153.1	0	0	111.3	V102 E103 F157 T158 R159 R385	V102-E155 HydrophobicContact CB-CG 4.44Å; E103-E155 HydrophobicContact CG-CG 4.33Å; E103-E155 WeakPolarHBondContact OE2-CB 3.31Å; E103-E155 PolarHBondContact OE2-N 2.81Å; E155-F157 VanDerWaalsContact C-N 3.26Å; E155-F157 PolarHBondContact O-N 2.85Å; E155-T158 WeakPolarHBondContact O-CB 3.39Å; E155-T158 PolarHBondContact O-N 2.81Å; E155-R159 PolarHBondContact O-N 2.92Å; E155-R385 WeakPolarHBondContact OE1-CG 3.43Å; E155-R385 IonicContact OE1-CZ 3.75Å; E155-R385 IonicContact OE1-NE 2.72Å; E155-R385 PolarHBondContact OE1-NE 2.98Å; E155-R385 IonicContact OE1-NH2 3.58Å; E155-R385 IonicContact OE2-CZ 3.18Å; E155-R385 VanDerWaalsContact OE2-CZ 3.26Å; E155-R385 IonicContact OE2-NE 3.66Å; E155-R385 PolarHBondContact OE2-NE 3.21Å; E155-R385 IonicContact OE2-NH2 3.64Å; E155-R385 PolarHBondContact OE2-NH2 2.79Å
156	E	92.4	Very high	93.1	Very high	58 Å²	58	29.5 Å²	29.5	27%	0.271	14%	0.141	S	C	.	.	H	α-helix	trans	-61.7	-37.9	176.1	-168	178.6	116.2	0	0	111.7	T158 R159 Y160 S237 F390 R392	E156-T158 VanDerWaalsContact C-N 3.33Å; E156-T158 PolarHBondContact O-N 2.8Å; E156-R159 PolarHBondContact O-N 3.08Å; E156-Y160 PolarHBondContact O-N 2.8Å; E156-S237 WeakPolarHBondContact OE2-CB 3.32Å; E156-S237 PolarHBondContact OE2-OG 3.35Å; E156-F390 HydrophobicContact CB-CE1 3.95Å; E156-F390 HydrophobicContact CG-CE1 3.83Å; E156-F390 HydrophobicContact CG-CZ 4.31Å; E156-R392 IonicContact OE1-CZ 3.86Å; E156-R392 VanDerWaalsContact OE1-CZ 3.29Å; E156-R392 IonicContact OE1-NH1 3.7Å; E156-R392 PolarHBondContact OE1-NH1 3.33Å; E156-R392 IonicContact OE1-NH2 3.29Å; E156-R392 PolarHBondContact OE1-NH2 2.98Å
157	F	93.8	Very high	93.2	Very high	31 Å²	31	30.6 Å²	30.6	14%	0.136	15%	0.145	C	C	.	.	H	α-helix	trans	-62.5	-37.2	175.7	-173.6	-128.6	0	0	0	112.7	I99 L101 E155 Y160 L161 F390	I99-F157 HydrophobicContact CB-CE1 4.13Å; I99-F157 HydrophobicContact CB-CZ 4.27Å; I99-F157 HydrophobicContact CD1-CE1 4.41Å; I99-F157 HydrophobicContact CG1-CE1 4.25Å; I99-F157 WeakPolarHBondContact O-CE1 3.36Å; L101-F157 HydrophobicContact CB-CE1 4.4Å; L101-F157 HydrophobicContact CD1-CD1 4.22Å; E155-F157 VanDerWaalsContact C-N 3.26Å; E155-F157 PolarHBondContact O-N 2.85Å; F157-Y160 AromaticContact CD2-CD1 4Å; F157-Y160 HydrophobicContact CD2-CD1 4Å; F157-Y160 HydrophobicContact CE2-CD1 4.1Å; F157-Y160 HydrophobicContact CE2-CE1 4.37Å; F157-Y160 PolarHBondContact O-N 3.36Å; F157-L161 HydrophobicContact CD1-CD1 3.98Å; F157-L161 HydrophobicContact CD2-CG 4.36Å; F157-L161 HydrophobicContact CE1-CD1 3.69Å; F157-L161 HydrophobicContact CE1-CG 4.35Å; F157-L161 HydrophobicContact CE2-CD1 4.33Å; F157-L161 HydrophobicContact CE2-CD2 4.17Å; F157-L161 HydrophobicContact CE2-CG 4.1Å; F157-L161 HydrophobicContact CG-CD1 4.42Å; F157-L161 HydrophobicContact CZ-CD1 3.89Å; F157-L161 HydrophobicContact CZ-CD2 4.07Å; F157-L161 HydrophobicContact CZ-CG 4.1Å; F157-L161 VanDerWaalsContact O-CG 3.28Å; F157-L161 WeakPolarHBondContact O-CG 3.5Å; F157-L161 PolarHBondContact O-N 3.3Å; F157-F390 HydrophobicContact CB-CD1 3.78Å; F157-F390 HydrophobicContact CB-CE1 3.97Å; F157-F390 HydrophobicContact CB-CG 4.15Å; F157-F390 HydrophobicContact CB-CZ 4.48Å; F157-F390 HydrophobicContact CD2-CB 4.17Å; F157-F390 HydrophobicContact CD2-CD1 4.12Å; F157-F390 AromaticContact CD2-CD2 3.49Å; F157-F390 HydrophobicContact CD2-CD2 3.49Å; F157-F390 VanDerWaalsContact CD2-CD2 3.49Å; F157-F390 HydrophobicContact CD2-CE1 4.43Å; F157-F390 AromaticContact CD2-CE2 3.83Å; F157-F390 HydrophobicContact CD2-CE2 3.83Å; F157-F390 AromaticContact CD2-CG 3.65Å; F157-F390 HydrophobicContact CD2-CG 3.65Å; F157-F390 HydrophobicContact CD2-CZ 4.29Å; F157-F390 HydrophobicContact CE2-CD2 4.06Å; F157-F390 HydrophobicContact CE2-CG 4.44Å; F157-F390 HydrophobicContact CG-CD1 4.35Å; F157-F390 HydrophobicContact CG-CD2 4.46Å; F157-F390 HydrophobicContact CG-CG 4.22Å
158	T	94.9	Very high	93.4	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-62.5	-45	174.6	-55.1	0	0	0	0	111.1	E103 F107 L153 E155 E156 L161 F162	E103-T158 HydrophobicContact CB-CG2 4.17Å; E103-T158 WeakPolarHBondContact OE2-CB 3.46Å; E103-T158 PolarHBondContact OE2-OG1 3.45Å; F107-T158 HydrophobicContact CE2-CG2 4.01Å; F107-T158 HydrophobicContact CZ-CG2 4.16Å; L153-T158 HydrophobicContact CB-CG2 4.28Å; L153-T158 HydrophobicContact CD1-CG2 4.39Å; L153-T158 HydrophobicContact CD2-CG2 3.93Å; L153-T158 HydrophobicContact CG-CG2 4.43Å; E155-T158 WeakPolarHBondContact O-CB 3.39Å; E155-T158 PolarHBondContact O-N 2.81Å; E156-T158 VanDerWaalsContact C-N 3.33Å; E156-T158 PolarHBondContact O-N 2.8Å; T158-L161 PolarHBondContact O-N 2.88Å; T158-F162 HydrophobicContact CG2-CD2 4.12Å; T158-F162 HydrophobicContact CG2-CE2 4.08Å; T158-F162 WeakPolarHBondContact O-CD2 3.38Å; T158-F162 PolarHBondContact O-N 2.98Å
159	R	95.6	Very high	93.8	Very high	39 Å²	39	30.7 Å²	30.7	15%	0.147	14%	0.141	C	C	.	.	H	α-helix	trans	-62.4	-45.3	177.9	-65.7	-171.2	-63.9	-87.3	1.9	111.5	L153 R154 E155 E156 F162 V163 L244	L153-R159 HydrophobicContact CB-CG 3.78Å; L153-R159 HydrophobicContact CD1-CG 4.29Å; L153-R159 PolarHBondContact O-NH1 2.93Å; R154-R159 PolarHBondContact O-NH1 3.34Å; E155-R159 PolarHBondContact O-N 2.92Å; E156-R159 PolarHBondContact O-N 3.08Å; R159-F162 WeakPolarHBondContact O-CB 3.41Å; R159-F162 PolarHBondContact O-N 3.39Å; R159-V163 WeakPolarHBondContact O-CG2 3.28Å; R159-V163 PolarHBondContact O-N 3.34Å; R159-L244 HydrophobicContact CB-CD1 3.85Å; R159-L244 HydrophobicContact CG-CD1 4.06Å
160	Y	96.1	Very high	94.2	Very high	17 Å²	17	27.7 Å²	27.7	7%	0.067	13%	0.127	C	C	.	.	H	α-helix	trans	-57.8	-47	173.5	168.5	-104.4	0	0	0	112.7	E156 F157 F162 V163 L164 E240 F390 R392 R393	E156-Y160 PolarHBondContact O-N 2.8Å; F157-Y160 AromaticContact CD2-CD1 4Å; F157-Y160 HydrophobicContact CD2-CD1 4Å; F157-Y160 HydrophobicContact CE2-CD1 4.1Å; F157-Y160 HydrophobicContact CE2-CE1 4.37Å; F157-Y160 PolarHBondContact O-N 3.36Å; Y160-F162 VanDerWaalsContact C-N 3.31Å; Y160-F162 PolarHBondContact O-N 2.92Å; Y160-V163 PolarHBondContact O-N 3.21Å; Y160-V163 VanDerWaalsContact O-N 3.13Å; Y160-L164 HydrophobicContact CD1-CD1 4.18Å; Y160-L164 HydrophobicContact CE1-CD1 3.56Å; Y160-L164 HydrophobicContact CE1-CG 4.3Å; Y160-L164 HydrophobicContact CE2-CD1 4.27Å; Y160-L164 HydrophobicContact CE2-CD2 4.24Å; Y160-L164 HydrophobicContact CE2-CG 4.21Å; Y160-L164 WeakPolarHBondContact O-CG 3.35Å; Y160-L164 PolarHBondContact O-N 2.93Å; Y160-E240 WeakPolarHBondContact CD2-OE1 3.36Å; Y160-F390 HydrophobicContact CD1-CD2 4.28Å; Y160-F390 AromaticContact CD1-CE2 3.51Å; Y160-F390 HydrophobicContact CD1-CE2 3.51Å; Y160-F390 HydrophobicContact CD1-CZ 4.19Å; Y160-F390 HydrophobicContact CD2-CE2 4.23Å; Y160-F390 HydrophobicContact CE1-CE2 4.03Å; Y160-F390 AromaticContact CG-CE2 3.61Å; Y160-F390 HydrophobicContact CG-CE2 3.61Å; Y160-F390 AromaticContact CG-CZ 3.93Å; Y160-F390 HydrophobicContact CG-CZ 3.93Å; Y160-R392 HydrophobicContact CD2-CG 3.99Å; Y160-R392 HydrophobicContact CE2-CB 4.1Å; Y160-R392 HydrophobicContact CE2-CG 3.88Å; Y160-R393 PolarHBondContact OH-N 2.78Å
161	L	97.1	Very high	94.6	Very high	8 Å²	8	31.3 Å²	31.3	4%	0.042	15%	0.146	C	C	.	.	H	α-helix	trans	-61.2	-37.7	176	-70.9	172.1	0	0	0	112.5	L73 L101 F107 F141 F157 T158 L164 Q165	L73-L161 HydrophobicContact CB-CD2 4.14Å; L73-L161 HydrophobicContact CD1-CB 4.14Å; L73-L161 HydrophobicContact CD1-CD2 4.19Å; L101-L161 HydrophobicContact CD1-CD1 4.15Å; L101-L161 HydrophobicContact CD2-CD1 4.09Å; F107-L161 HydrophobicContact CE1-CB 3.88Å; F107-L161 HydrophobicContact CE1-CD1 4.13Å; F107-L161 HydrophobicContact CZ-CB 3.9Å; F107-L161 HydrophobicContact CZ-CD1 3.97Å; F141-L161 HydrophobicContact CE1-CD1 4.31Å; F157-L161 HydrophobicContact CD1-CD1 3.98Å; F157-L161 HydrophobicContact CD2-CG 4.36Å; F157-L161 HydrophobicContact CE1-CD1 3.69Å; F157-L161 HydrophobicContact CE1-CG 4.35Å; F157-L161 HydrophobicContact CE2-CD1 4.33Å; F157-L161 HydrophobicContact CE2-CD2 4.17Å; F157-L161 HydrophobicContact CE2-CG 4.1Å; F157-L161 HydrophobicContact CG-CD1 4.42Å; F157-L161 HydrophobicContact CZ-CD1 3.89Å; F157-L161 HydrophobicContact CZ-CD2 4.07Å; F157-L161 HydrophobicContact CZ-CG 4.1Å; F157-L161 VanDerWaalsContact O-CG 3.28Å; F157-L161 WeakPolarHBondContact O-CG 3.5Å; F157-L161 PolarHBondContact O-N 3.3Å; T158-L161 PolarHBondContact O-N 2.88Å; L161-L164 HydrophobicContact CD2-CD1 4.46Å; L161-L164 PolarHBondContact O-N 3.12Å; L161-Q165 PolarHBondContact O-N 3.14Å
162	F	97.9	Very high	94.9	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-63.3	-43.2	172.4	-94.7	-118.2	0	0	0	112.1	Y106 F107 V143 Y146 L153 T158 R159 Y160 L164 Q165 L166 L244	Y106-F162 HydrophobicContact CD1-CZ 4.25Å; Y106-F162 HydrophobicContact CG-CE2 4.34Å; Y106-F162 HydrophobicContact CG-CZ 4.19Å; F107-F162 HydrophobicContact CE1-CD2 4.41Å; F107-F162 HydrophobicContact CE1-CE2 4.45Å; F107-F162 HydrophobicContact CE2-CE2 4.17Å; F107-F162 AromaticContact CZ-CD2 3.87Å; F107-F162 HydrophobicContact CZ-CD2 3.87Å; F107-F162 AromaticContact CZ-CE2 3.84Å; F107-F162 HydrophobicContact CZ-CE2 3.84Å; V143-F162 HydrophobicContact CG1-CD2 4.48Å; V143-F162 HydrophobicContact CG1-CE1 3.95Å; V143-F162 HydrophobicContact CG1-CE2 3.9Å; V143-F162 HydrophobicContact CG1-CZ 3.6Å; V143-F162 HydrophobicContact CG2-CD2 3.88Å; V143-F162 HydrophobicContact CG2-CE2 4.01Å; V143-F162 HydrophobicContact CG2-CG 4.22Å; V143-F162 HydrophobicContact CG2-CZ 4.47Å; Y146-F162 HydrophobicContact CD1-CE1 4.4Å; L153-F162 HydrophobicContact CD1-CB 4.46Å; L153-F162 HydrophobicContact CD1-CD1 3.83Å; L153-F162 HydrophobicContact CD1-CD2 4.02Å; L153-F162 HydrophobicContact CD1-CE1 3.96Å; L153-F162 HydrophobicContact CD1-CE2 4.15Å; L153-F162 HydrophobicContact CD1-CG 3.86Å; L153-F162 HydrophobicContact CD1-CZ 4.11Å; L153-F162 HydrophobicContact CD2-CE2 4.25Å; L153-F162 HydrophobicContact CD2-CZ 4.12Å; T158-F162 HydrophobicContact CG2-CD2 4.12Å; T158-F162 HydrophobicContact CG2-CE2 4.08Å; T158-F162 WeakPolarHBondContact O-CD2 3.38Å; T158-F162 PolarHBondContact O-N 2.98Å; R159-F162 WeakPolarHBondContact O-CB 3.41Å; R159-F162 PolarHBondContact O-N 3.39Å; Y160-F162 VanDerWaalsContact C-N 3.31Å; Y160-F162 PolarHBondContact O-N 2.92Å; F162-L164 PolarHBondContact O-N 3.09Å; F162-Q165 PolarHBondContact O-N 3.08Å; F162-L166 WeakPolarHBondContact O-CB 3.39Å; F162-L166 WeakPolarHBondContact O-CD1 3.43Å; F162-L166 WeakPolarHBondContact O-CG 3.25Å; F162-L166 PolarHBondContact O-N 3.11Å; F162-L244 HydrophobicContact CB-CD1 4.3Å; F162-L244 HydrophobicContact CB-CD2 3.82Å
163	V	97.9	Very high	95.2	Very high	4 Å²	4	27.2 Å²	27.2	2%	0.024	14%	0.137	C	C	.	.	H	α-helix	trans	-60.9	-44.1	175.2	172.6	0	0	0	0	110.9	R159 Y160 Q165 L166 R167 E240 F243 L244	R159-V163 WeakPolarHBondContact O-CG2 3.28Å; R159-V163 PolarHBondContact O-N 3.34Å; Y160-V163 PolarHBondContact O-N 3.21Å; Y160-V163 VanDerWaalsContact O-N 3.13Å; V163-Q165 PolarHBondContact O-N 3.41Å; V163-L166 PolarHBondContact O-N 3.31Å; V163-R167 HydrophobicContact CG1-CG 4.24Å; V163-R167 WeakPolarHBondContact O-CB 3.19Å; V163-R167 VanDerWaalsContact O-CG 3.25Å; V163-R167 WeakPolarHBondContact O-CG 3.2Å; V163-R167 PolarHBondContact O-N 3.23Å; V163-E240 HydrophobicContact CG2-CB 4.09Å; V163-E240 HydrophobicContact CG2-CG 4.11Å; V163-F243 HydrophobicContact CB-CD1 4.3Å; V163-F243 HydrophobicContact CB-CE1 4.41Å; V163-F243 HydrophobicContact CG1-CD1 4.05Å; V163-F243 HydrophobicContact CG1-CD2 4.36Å; V163-F243 HydrophobicContact CG1-CE1 4.05Å; V163-F243 HydrophobicContact CG1-CE2 4.37Å; V163-F243 HydrophobicContact CG1-CG 4.23Å; V163-F243 HydrophobicContact CG1-CZ 4.23Å; V163-F243 HydrophobicContact CG2-CB 4.4Å; V163-F243 HydrophobicContact CG2-CD1 3.74Å; V163-F243 HydrophobicContact CG2-CE1 4.3Å; V163-F243 HydrophobicContact CG2-CG 4.19Å; V163-L244 HydrophobicContact CG2-CD1 4.43Å; V163-L244 HydrophobicContact CG2-CD2 3.79Å; V163-L244 HydrophobicContact CG2-CG 3.89Å
164	L	97.4	Very high	95.4	Very high	25 Å²	25	30.8 Å²	30.8	13%	0.131	15%	0.152	C	C	.	.	H	α-helix	trans	-59	-45.6	175.6	-68.4	179.1	0	0	0	112.7	L73 D74 Y160 L161 F162 Q168	L73-L164 HydrophobicContact CB-CB 4.17Å; L73-L164 HydrophobicContact CB-CD1 4.23Å; D74-L164 HydrophobicContact CB-CD1 4.14Å; Y160-L164 HydrophobicContact CD1-CD1 4.18Å; Y160-L164 HydrophobicContact CE1-CD1 3.56Å; Y160-L164 HydrophobicContact CE1-CG 4.3Å; Y160-L164 HydrophobicContact CE2-CD1 4.27Å; Y160-L164 HydrophobicContact CE2-CD2 4.24Å; Y160-L164 HydrophobicContact CE2-CG 4.21Å; Y160-L164 WeakPolarHBondContact O-CG 3.35Å; Y160-L164 PolarHBondContact O-N 2.93Å; L161-L164 HydrophobicContact CD2-CD1 4.46Å; L161-L164 PolarHBondContact O-N 3.12Å; F162-L164 PolarHBondContact O-N 3.09Å; L164-Q168 PolarHBondContact O-N 3.34Å; L164-Q168 VanDerWaalsContact O-N 3.09Å
165	Q	98.1	Very high	95.8	Very high	7 Å²	7	25.3 Å²	25.3	3%	0.033	13%	0.132	C	C	.	.	H	α-helix	trans	-61	-46.6	175.6	176.4	73	73.3	0	0	111.6	L73 R142 V143 Y146 L161 F162 V163 Q168 D169	L73-Q165 HydrophobicContact CD1-CB 4.5Å; L73-Q165 HydrophobicContact CD2-CB 3.92Å; R142-Q165 VanDerWaalsContact CD-OE1 3.23Å; V143-Q165 HydrophobicContact CB-CB 4.46Å; V143-Q165 HydrophobicContact CB-CG 3.95Å; V143-Q165 HydrophobicContact CG2-CB 3.73Å; V143-Q165 HydrophobicContact CG2-CG 3.78Å; Y146-Q165 HydrophobicContact CE1-CG 4.09Å; Y146-Q165 WeakPolarHBondContact OH-CG 3.25Å; L161-Q165 PolarHBondContact O-N 3.14Å; F162-Q165 PolarHBondContact O-N 3.08Å; V163-Q165 PolarHBondContact O-N 3.41Å; Q165-Q168 WeakPolarHBondContact O-CB 3.49Å; Q165-Q168 PolarHBondContact O-N 3.49Å; Q165-Q168 VanDerWaalsContact O-N 3.14Å; Q165-D169 PolarHBondContact NE2-OD1 3.49Å; Q165-D169 PolarHBondContact O-N 3.11Å
166	L	98.1	Very high	95.9	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-67.5	-37.7	-178.2	-71.9	162.2	0	0	0	112	Y146 F162 V163 Q168 D169 I170 L175 F243 L244 C247 Y253	Y146-L166 HydrophobicContact CD1-CD2 4.28Å; Y146-L166 HydrophobicContact CE1-CD2 3.91Å; Y146-L166 HydrophobicContact CE1-CG 4.34Å; F162-L166 WeakPolarHBondContact O-CB 3.39Å; F162-L166 WeakPolarHBondContact O-CD1 3.43Å; F162-L166 WeakPolarHBondContact O-CG 3.25Å; F162-L166 PolarHBondContact O-N 3.11Å; V163-L166 PolarHBondContact O-N 3.31Å; L166-Q168 VanDerWaalsContact C-N 3.29Å; L166-Q168 PolarHBondContact O-N 2.92Å; L166-D169 PolarHBondContact O-N 3.46Å; L166-I170 VanDerWaalsContact O-CG1 3.27Å; L166-I170 WeakPolarHBondContact O-CG1 3.29Å; L166-I170 PolarHBondContact O-N 3Å; L166-L175 HydrophobicContact CD2-CD2 3.64Å; L166-F243 HydrophobicContact CB-CE1 3.77Å; L166-F243 HydrophobicContact CB-CZ 4.3Å; L166-F243 HydrophobicContact CD1-CE1 4.18Å; L166-L244 HydrophobicContact CD1-CD2 3.38Å; L166-C247 HydrophobicContact CD1-CB 4.14Å; L166-Y253 HydrophobicContact CD1-CE2 4.04Å; L166-Y253 HydrophobicContact CD2-CD2 3.89Å; L166-Y253 HydrophobicContact CD2-CE2 3.86Å
167	R	97.2	Very high	96.1	Very high	37 Å²	37	30.6 Å²	30.6	14%	0.14	16%	0.157	C	C	.	.	H	α-helix	trans	-58.3	-41	169.7	-71.2	173.5	71.2	179.5	-2.3	111.4	V163 L171 C189 E193 F243 S395	V163-R167 HydrophobicContact CG1-CG 4.24Å; V163-R167 WeakPolarHBondContact O-CB 3.19Å; V163-R167 VanDerWaalsContact O-CG 3.25Å; V163-R167 WeakPolarHBondContact O-CG 3.2Å; V163-R167 PolarHBondContact O-N 3.23Å; R167-L171 WeakPolarHBondContact O-CB 3.43Å; R167-L171 WeakPolarHBondContact O-CG 2.98Å; R167-L171 PolarHBondContact O-N 2.76Å; R167-C189 WeakPolarHBondContact CD-SG 2.98Å; R167-E193 IonicContact NH1-OE2 3.68Å; R167-F243 HydrophobicContact CG-CE2 4.16Å; R167-F243 HydrophobicContact CG-CZ 3.86Å; R167-S395 PolarHBondContact NH1-OG 3.05Å; R167-S395 PolarHBondContact NH2-OG 2.84Å
168	Q	96.3	Very high	96.3	Very high	34 Å²	34	32.4 Å²	32.4	16%	0.159	17%	0.172	C	C	.	.	H	α-helix	trans	-66.8	-39.1	174.8	-162.6	-160.3	-98.7	0	0	112.3	P45 R142 L164 Q165 L166 L171 S172	P45-Q168 HydrophobicContact CG-CG 3.84Å; R142-Q168 VanDerWaalsContact CZ-OE1 3.25Å; L164-Q168 PolarHBondContact O-N 3.34Å; L164-Q168 VanDerWaalsContact O-N 3.09Å; Q165-Q168 WeakPolarHBondContact O-CB 3.49Å; Q165-Q168 PolarHBondContact O-N 3.49Å; Q165-Q168 VanDerWaalsContact O-N 3.14Å; L166-Q168 VanDerWaalsContact C-N 3.29Å; L166-Q168 PolarHBondContact O-N 2.92Å; Q168-L171 PolarHBondContact O-N 2.87Å; Q168-S172 WeakPolarHBondContact O-CB 3.48Å; Q168-S172 PolarHBondContact O-N 2.77Å; Q168-S172 PolarHBondContact O-OG 3.14Å
169	D	97	Very high	96.4	Very high	5 Å²	5	36.9 Å²	36.9	3%	0.027	19%	0.19	C	C	.	.	H	α-helix	trans	-68.9	-34.2	178.4	-79.1	28.7	0	0	0	112.1	Y146 Q165 L166 S172 G173 K174 L175	Y146-D169 PolarHBondContact OH-OD2 3.43Å; Q165-D169 PolarHBondContact NE2-OD1 3.49Å; Q165-D169 PolarHBondContact O-N 3.11Å; L166-D169 PolarHBondContact O-N 3.46Å; D169-S172 WeakPolarHBondContact CA-OG 3.43Å; D169-S172 PolarHBondContact O-OG 2.95Å; D169-G173 PolarHBondContact O-N 2.95Å; D169-K174 HydrophobicContact CB-CB 4.32Å; D169-K174 PolarHBondContact O-N 3.01Å; D169-K174 WeakPolarHBondContact OD2-CD 3.35Å; D169-K174 IonicContact OD2-NZ 3.27Å; D169-K174 PolarHBondContact OD2-NZ 2.98Å; D169-L175 HydrophobicContact CB-CB 3.94Å; D169-L175 PolarHBondContact O-N 2.82Å
170	I	97.3	Very high	96.5	Very high	13 Å²	13	40.2 Å²	40.2	7%	0.067	21%	0.21	C	C	.	.	H	α-helix	trans	-69.1	-48.4	172.3	-64.5	164.9	0	0	0	110.5	L166 S172 G173 L175 L185 F212 F243	L166-I170 VanDerWaalsContact O-CG1 3.27Å; L166-I170 WeakPolarHBondContact O-CG1 3.29Å; L166-I170 PolarHBondContact O-N 3Å; I170-S172 PolarHBondContact O-N 3.17Å; I170-G173 PolarHBondContact O-N 2.98Å; I170-L175 HydrophobicContact CD1-CD2 4.34Å; I170-L175 HydrophobicContact CG1-CB 4.01Å; I170-L175 HydrophobicContact CG1-CD2 3.93Å; I170-L175 HydrophobicContact CG1-CG 3.99Å; I170-L185 HydrophobicContact CD1-CD1 3.9Å; I170-F212 WeakPolarHBondContact CG2-O 3.49Å; I170-F243 HydrophobicContact CD1-CZ 4.28Å
171	L	95.6	Very high	96.6	Very high	75 Å²	75	40.4 Å²	40.4	39%	0.393	21%	0.213	S	C	.	.	H	α-helix	trans	-66	-22.2	179.5	-75.1	171.7	0	0	0	114.2	R167 Q168 R211	R167-L171 WeakPolarHBondContact O-CB 3.43Å; R167-L171 WeakPolarHBondContact O-CG 2.98Å; R167-L171 PolarHBondContact O-N 2.76Å; Q168-L171 PolarHBondContact O-N 2.87Å; L171-R211 HydrophobicContact CD2-CB 4.16Å
172	S	93.9	Very high	96.6	Very high	46 Å²	46	40.6 Å²	40.6	32%	0.322	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.1	-2.7	172.2	53.9	0	0	0	0	113.6	Q168 D169 I170 K174	Q168-S172 WeakPolarHBondContact O-CB 3.48Å; Q168-S172 PolarHBondContact O-N 2.77Å; Q168-S172 PolarHBondContact O-OG 3.14Å; D169-S172 WeakPolarHBondContact CA-OG 3.43Å; D169-S172 PolarHBondContact O-OG 2.95Å; I170-S172 PolarHBondContact O-N 3.17Å; S172-K174 PolarHBondContact O-N 3.45Å
173	G	93.9	Very high	96.7	Very high	38 Å²	38	41.2 Å²	41.2	39%	0.392	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	73.5	4.2	-177.6	0	0	0	0	0	115	D169 I170	D169-G173 PolarHBondContact O-N 2.95Å; I170-G173 PolarHBondContact O-N 2.98Å
174	K	94.2	Very high	96.7	Very high	76 Å²	76	42.8 Å²	42.8	33%	0.33	23%	0.226	S	C	.	.	S	Bend	trans	-65.3	-40.2	174.2	175.8	172.1	175.5	-70.9	0	111.2	D169 S172 V255	D169-K174 HydrophobicContact CB-CB 4.32Å; D169-K174 PolarHBondContact O-N 3.01Å; D169-K174 WeakPolarHBondContact OD2-CD 3.35Å; D169-K174 IonicContact OD2-NZ 3.27Å; D169-K174 PolarHBondContact OD2-NZ 2.98Å; S172-K174 PolarHBondContact O-N 3.45Å; K174-V255 VanDerWaalsContact CE-O 3.29Å; K174-V255 WeakPolarHBondContact CE-O 3.41Å; K174-V255 PolarHBondContact NZ-O 3.46Å; K174-V255 VanDerWaalsContact NZ-O 3.17Å
175	L	96.3	Very high	96.7	Very high	3 Å²	3	41.8 Å²	41.8	2%	0.016	22%	0.221	C	C	.	.	S	Bend	trans	-103.7	105.3	171.7	-178.1	54.1	0	0	0	109.4	L166 D169 I170 L250 L252	L166-L175 HydrophobicContact CD2-CD2 3.64Å; D169-L175 HydrophobicContact CB-CB 3.94Å; D169-L175 PolarHBondContact O-N 2.82Å; I170-L175 HydrophobicContact CD1-CD2 4.34Å; I170-L175 HydrophobicContact CG1-CB 4.01Å; I170-L175 HydrophobicContact CG1-CD2 3.93Å; I170-L175 HydrophobicContact CG1-CG 3.99Å; L175-L250 HydrophobicContact CD1-CB 3.75Å; L175-L250 HydrophobicContact CD1-CD1 3.85Å; L175-L250 HydrophobicContact CD1-CG 4.46Å; L175-L250 HydrophobicContact CD2-CD1 4.1Å; L175-L250 HydrophobicContact CG-CD1 3.98Å; L175-L252 HydrophobicContact CD1-CB 4.12Å
176	K	94.1	Very high	96.8	Very high	154 Å²	154	41.5 Å²	41.5	67%	0.67	22%	0.22	S	C	*	.			trans	-80.2	129.4	176.2	-65.4	177.8	-176.5	176	0	110.1	L252	K176-L252 HydrophobicContact CB-CD1 4.18Å; K176-L252 HydrophobicContact CD-CD1 3.93Å; K176-L252 HydrophobicContact CG-CD1 3.9Å
177	C	96.3	Very high	96.8	Very high	31 Å²	31	41.5 Å²	41.5	21%	0.209	22%	0.22	C	C	.	.			trans	-116.4	139.3	176.2	-62.9	0	0	0	0	110.5	S182 L250	C177-S182 VanDerWaalsContact CB-OG 3.24Å; C177-S182 WeakPolarHBondContact CB-OG 3.35Å; C177-L250 WeakPolarHBondContact SG-CD1 3.38Å
178	P	96.9	Very high	96.8	Very high	69 Å²	69	41 Å²	41	45%	0.448	22%	0.218	S	C	.	.			trans	-58.2	165.7	160	-23.3	34.2	0	0	0	112.3	V181 S182	P178-V181 HydrophobicContact CB-CB 4.4Å; P178-V181 HydrophobicContact CB-CG2 4.09Å; P178-V181 HydrophobicContact CG-CG2 4.06Å; P178-S182 WeakPolarHBondContact O-CB 3.45Å; P178-S182 PolarHBondContact O-N 2.65Å; P178-S182 PolarHBondContact O-OG 3.14Å
179	Y	97.4	Very high	96.9	Very high	94 Å²	94	39.6 Å²	39.6	37%	0.369	21%	0.211	S	C	.	.	H	α-helix	trans	-58.7	-58.1	-178.6	-176.6	-91.2	0	0	0	111.9	V181 S182 V183 M220 D223	Y179-V181 VanDerWaalsContact C-N 3.28Å; Y179-V181 PolarHBondContact O-N 3.07Å; Y179-S182 WeakPolarHBondContact O-CA 3.35Å; Y179-S182 VanDerWaalsContact O-CB 3.25Å; Y179-S182 WeakPolarHBondContact O-CB 3.17Å; Y179-S182 PolarHBondContact O-N 2.85Å; Y179-V183 HydrophobicContact CD1-CG2 4.18Å; Y179-V183 HydrophobicContact CE1-CG2 3.85Å; Y179-V183 PolarHBondContact O-N 3.44Å; Y179-M220 HydrophobicContact CD2-CE 3.42Å; Y179-M220 VanDerWaalsContact CD2-CE 3.42Å; Y179-M220 HydrophobicContact CE2-CB 4.04Å; Y179-M220 HydrophobicContact CE2-CE 3.39Å; Y179-M220 HydrophobicContact CE2-CG 4.23Å; Y179-M220 HydrophobicContact CG-CE 4.33Å; Y179-M220 VanDerWaalsContact OH-CA 3.28Å; Y179-M220 WeakPolarHBondContact OH-CA 3.25Å; Y179-M220 PolarHBondContact OH-N 3.07Å; Y179-D223 VanDerWaalsContact CE1-OD2 3.3Å; Y179-D223 WeakPolarHBondContact CE1-OD2 3.41Å; Y179-D223 PolarHBondContact OH-OD2 2.8Å
180	D	97.7	Very high	96.9	Very high	108 Å²	108	39.3 Å²	39.3	58%	0.578	21%	0.21	S	C	*	.	H	α-helix	trans	-61.2	-38.4	-175.7	-28.3	-55	0	0	0	111.6	S182 V183 E184	D180-S182 VanDerWaalsContact C-N 3.34Å; D180-S182 PolarHBondContact O-N 3.26Å; D180-V183 WeakPolarHBondContact O-CB 3.31Å; D180-V183 PolarHBondContact O-N 3.46Å; D180-E184 PolarHBondContact O-N 2.79Å
181	V	98.1	Very high	97	Very high	22 Å²	22	38.8 Å²	38.8	13%	0.133	21%	0.207	C	C	.	.	H	α-helix	trans	-66.4	-37.1	174.5	-175.8	0	0	0	0	111.2	P178 Y179 V183 L185 K246 L250	P178-V181 HydrophobicContact CB-CB 4.4Å; P178-V181 HydrophobicContact CB-CG2 4.09Å; P178-V181 HydrophobicContact CG-CG2 4.06Å; Y179-V181 VanDerWaalsContact C-N 3.28Å; Y179-V181 PolarHBondContact O-N 3.07Å; V181-V183 VanDerWaalsContact C-N 3.34Å; V181-L185 HydrophobicContact CG1-CD1 3.8Å; V181-L185 HydrophobicContact CG1-CG 4.15Å; V181-L185 VanDerWaalsContact O-CB 3.32Å; V181-L185 WeakPolarHBondContact O-CB 3.35Å; V181-L185 WeakPolarHBondContact O-CG 2.96Å; V181-L185 PolarHBondContact O-N 3.36Å; V181-K246 HydrophobicContact CG1-CG 3.93Å; V181-L250 HydrophobicContact CG1-CD1 4.46Å; V181-L250 HydrophobicContact CG1-CD2 4.16Å
182	S	98.1	Very high	97	Very high	11 Å²	11	35.8 Å²	35.8	8%	0.077	19%	0.193	C	C	.	.	H	α-helix	trans	-64.9	-39.4	174.4	-54.4	0	0	0	0	111.6	C177 P178 Y179 D180 A186	C177-S182 VanDerWaalsContact CB-OG 3.24Å; C177-S182 WeakPolarHBondContact CB-OG 3.35Å; P178-S182 WeakPolarHBondContact O-CB 3.45Å; P178-S182 PolarHBondContact O-N 2.65Å; P178-S182 PolarHBondContact O-OG 3.14Å; Y179-S182 WeakPolarHBondContact O-CA 3.35Å; Y179-S182 VanDerWaalsContact O-CB 3.25Å; Y179-S182 WeakPolarHBondContact O-CB 3.17Å; Y179-S182 PolarHBondContact O-N 2.85Å; D180-S182 VanDerWaalsContact C-N 3.34Å; D180-S182 PolarHBondContact O-N 3.26Å; S182-A186 VanDerWaalsContact O-CB 3.28Å; S182-A186 WeakPolarHBondContact O-CB 3.44Å; S182-A186 PolarHBondContact O-N 3.24Å
183	V	98.4	Very high	97.1	Very high	13 Å²	13	35.7 Å²	35.7	8%	0.079	19%	0.187	C	C	.	.	H	α-helix	trans	-62.3	-50.8	175.3	170.7	0	0	0	0	111	Y179 D180 V181 A186 A187 M220 D223 I224 R227	Y179-V183 HydrophobicContact CD1-CG2 4.18Å; Y179-V183 HydrophobicContact CE1-CG2 3.85Å; Y179-V183 PolarHBondContact O-N 3.44Å; D180-V183 WeakPolarHBondContact O-CB 3.31Å; D180-V183 PolarHBondContact O-N 3.46Å; V181-V183 VanDerWaalsContact C-N 3.34Å; V183-A186 PolarHBondContact O-N 3.16Å; V183-A187 PolarHBondContact O-N 3.33Å; V183-M220 HydrophobicContact CG2-CG 3.93Å; V183-D223 HydrophobicContact CG1-CB 3.97Å; V183-D223 HydrophobicContact CG2-CB 3.97Å; V183-I224 HydrophobicContact CB-CG1 4.28Å; V183-I224 HydrophobicContact CG1-CG1 4.13Å; V183-I224 HydrophobicContact CG2-CG1 4.27Å; V183-R227 HydrophobicContact CG1-CB 3.91Å; V183-R227 HydrophobicContact CG1-CG 4.26Å
184	E	98.3	Very high	97.1	Very high	37 Å²	37	36.2 Å²	36.2	17%	0.173	18%	0.181	C	C	.	.	H	α-helix	trans	-60.2	-47	176.9	-75.4	179	-114.7	0	0	112.7	D180 A186 A187 Y188 R227 K246	D180-E184 PolarHBondContact O-N 2.79Å; E184-A186 VanDerWaalsContact C-N 3.3Å; E184-A186 PolarHBondContact O-N 2.89Å; E184-A187 PolarHBondContact O-N 2.94Å; E184-Y188 HydrophobicContact CB-CE2 4.26Å; E184-Y188 WeakPolarHBondContact O-CD2 3.07Å; E184-Y188 PolarHBondContact O-N 2.89Å; E184-R227 HydrophobicContact CG-CG 4.44Å; E184-K246 WeakPolarHBondContact OE1-CE 3.46Å; E184-K246 IonicContact OE1-NZ 2.98Å; E184-K246 PolarHBondContact OE1-NZ 2.94Å; E184-K246 VanDerWaalsContact OE2-CE 3.26Å; E184-K246 WeakPolarHBondContact OE2-CE 3.32Å; E184-K246 IonicContact OE2-NZ 2.65Å; E184-K246 PolarHBondContact OE2-NZ 3.44Å
185	L	98.6	Very high	97.2	Very high	5 Å²	5	33.6 Å²	33.6	3%	0.026	18%	0.176	C	C	.	.	H	α-helix	trans	-63.8	-35.7	-179.9	-70.4	175.3	0	0	0	112.2	I170 V181 C189 F243 K246 C247 L250	I170-L185 HydrophobicContact CD1-CD1 3.9Å; V181-L185 HydrophobicContact CG1-CD1 3.8Å; V181-L185 HydrophobicContact CG1-CG 4.15Å; V181-L185 VanDerWaalsContact O-CB 3.32Å; V181-L185 WeakPolarHBondContact O-CB 3.35Å; V181-L185 WeakPolarHBondContact O-CG 2.96Å; V181-L185 PolarHBondContact O-N 3.36Å; L185-C189 PolarHBondContact O-N 2.64Å; L185-C189 VanDerWaalsContact O-N 3.14Å; L185-C189 PolarHBondContact O-SG 3.06Å; L185-F243 HydrophobicContact CB-CD2 3.98Å; L185-F243 HydrophobicContact CB-CE2 3.72Å; L185-F243 HydrophobicContact CB-CZ 4.49Å; L185-F243 HydrophobicContact CD2-CB 4.25Å; L185-F243 HydrophobicContact CD2-CD1 4.07Å; L185-F243 HydrophobicContact CD2-CD2 3.51Å; L185-F243 HydrophobicContact CD2-CE1 4.28Å; L185-F243 HydrophobicContact CD2-CE2 3.76Å; L185-F243 HydrophobicContact CD2-CG 3.67Å; L185-F243 HydrophobicContact CD2-CZ 4.13Å; L185-F243 WeakPolarHBondContact CD2-O 3.38Å; L185-F243 HydrophobicContact CG-CD2 4.34Å; L185-F243 HydrophobicContact CG-CE2 4.24Å; L185-F243 WeakPolarHBondContact O-CD2 3.33Å; L185-F243 WeakPolarHBondContact O-CE2 3.25Å; L185-K246 HydrophobicContact CD2-CB 3.98Å; L185-K246 HydrophobicContact CD2-CG 4.21Å; L185-C247 WeakPolarHBondContact CD2-SG 3.46Å; L185-L250 HydrophobicContact CD1-CD1 4.44Å
186	A	98.3	Very high	97.2	Very high	1 Å²	1	36.6 Å²	36.6	1%	0.008	19%	0.192	C	C	.	.	H	α-helix	trans	-69.9	-41.8	174.1	0	0	0	0	0	112.7	S182 V183 E184 Y188 C189 L190 F212 I224	S182-A186 VanDerWaalsContact O-CB 3.28Å; S182-A186 WeakPolarHBondContact O-CB 3.44Å; S182-A186 PolarHBondContact O-N 3.24Å; V183-A186 PolarHBondContact O-N 3.16Å; E184-A186 VanDerWaalsContact C-N 3.3Å; E184-A186 PolarHBondContact O-N 2.89Å; A186-Y188 PolarHBondContact O-N 3.29Å; A186-C189 WeakPolarHBondContact O-CB 3.34Å; A186-C189 PolarHBondContact O-N 2.66Å; A186-C189 VanDerWaalsContact O-N 3.08Å; A186-L190 PolarHBondContact O-N 2.73Å; A186-F212 HydrophobicContact CB-CB 3.71Å; A186-F212 HydrophobicContact CB-CD1 3.73Å; A186-F212 HydrophobicContact CB-CD2 3.59Å; A186-F212 HydrophobicContact CB-CE1 4.23Å; A186-F212 HydrophobicContact CB-CE2 4.09Å; A186-F212 HydrophobicContact CB-CG 3.38Å; A186-F212 HydrophobicContact CB-CZ 4.38Å; A186-I224 HydrophobicContact CB-CD1 3.47Å; A186-I224 VanDerWaalsContact CB-CD1 3.47Å; A186-I224 HydrophobicContact CB-CG1 3.72Å; A186-I224 HydrophobicContact CB-CG2 3.93Å
187	A	98.4	Very high	97.3	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-61	-43.1	174.7	0	0	0	0	0	111.8	V183 E184 C189 L190 Q191 R227 W228 L231	V183-A187 PolarHBondContact O-N 3.33Å; E184-A187 PolarHBondContact O-N 2.94Å; A187-C189 VanDerWaalsContact C-N 3.28Å; A187-C189 PolarHBondContact O-N 2.72Å; A187-L190 PolarHBondContact O-N 3.37Å; A187-Q191 PolarHBondContact O-N 2.85Å; A187-R227 HydrophobicContact CB-CB 3.93Å; A187-R227 HydrophobicContact CB-CG 3.77Å; A187-W228 HydrophobicContact CB-CB 4.3Å; A187-L231 HydrophobicContact CB-CD1 3.85Å
188	Y	98.6	Very high	97.2	Very high	27 Å²	27	31.5 Å²	31.5	11%	0.106	17%	0.17	C	C	.	.	H	α-helix	trans	-61.7	-34.1	172.3	-69.1	-52.6	0	0	0	112.9	E184 A186 S192 L231 A239 S242 F243	E184-Y188 HydrophobicContact CB-CE2 4.26Å; E184-Y188 WeakPolarHBondContact O-CD2 3.07Å; E184-Y188 PolarHBondContact O-N 2.89Å; A186-Y188 PolarHBondContact O-N 3.29Å; Y188-S192 VanDerWaalsContact O-CB 3.29Å; Y188-S192 WeakPolarHBondContact O-CB 3.21Å; Y188-S192 PolarHBondContact O-N 3.13Å; Y188-S192 PolarHBondContact O-OG 2.95Å; Y188-L231 HydrophobicContact CD1-CD1 3.66Å; Y188-L231 HydrophobicContact CD1-CD2 4.2Å; Y188-L231 HydrophobicContact CE1-CD1 3.98Å; Y188-L231 HydrophobicContact CE1-CD2 3.65Å; Y188-L231 HydrophobicContact CE1-CG 4.49Å; Y188-L231 HydrophobicContact CG-CD1 4.37Å; Y188-A239 HydrophobicContact CD1-CB 4.24Å; Y188-S242 VanDerWaalsContact CE1-CB 3.41Å; Y188-F243 HydrophobicContact CD2-CB 4.37Å; Y188-F243 HydrophobicContact CG-CB 4.42Å
189	C	97.8	Very high	96.8	Very high	3 Å²	3	32.4 Å²	32.4	2%	0.02	18%	0.176	C	C	.	.	H	α-helix	trans	-65	-45.3	174	-68.4	0	0	0	0	111.6	R167 L185 A186 A187 S192 E193 F212 F243	R167-C189 WeakPolarHBondContact CD-SG 2.98Å; L185-C189 PolarHBondContact O-N 2.64Å; L185-C189 VanDerWaalsContact O-N 3.14Å; L185-C189 PolarHBondContact O-SG 3.06Å; A186-C189 WeakPolarHBondContact O-CB 3.34Å; A186-C189 PolarHBondContact O-N 2.66Å; A186-C189 VanDerWaalsContact O-N 3.08Å; A187-C189 VanDerWaalsContact C-N 3.28Å; A187-C189 PolarHBondContact O-N 2.72Å; C189-S192 PolarHBondContact O-N 3.07Å; C189-S192 PolarHBondContact O-OG 3.33Å; C189-E193 WeakPolarHBondContact O-CB 3.44Å; C189-E193 PolarHBondContact O-N 2.93Å; C189-F212 HydrophobicContact CB-CD1 4.1Å; C189-F212 HydrophobicContact CB-CE1 3.61Å; C189-F243 WeakPolarHBondContact SG-CE2 3.37Å
190	L	97.4	Very high	96.5	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-61.5	-49.8	176.8	-68.1	169.3	0	0	0	111.2	A186 A187 S192 E193 L194 V207 F210 F212 I224 W228	A186-L190 PolarHBondContact O-N 2.73Å; A187-L190 PolarHBondContact O-N 3.37Å; L190-S192 PolarHBondContact O-N 3.12Å; L190-E193 PolarHBondContact O-N 2.75Å; L190-L194 HydrophobicContact CD2-CD1 3.96Å; L190-L194 PolarHBondContact O-N 3.28Å; L190-V207 HydrophobicContact CD1-CG1 4.27Å; L190-V207 HydrophobicContact CD1-CG2 3.97Å; L190-F210 HydrophobicContact CD2-CD1 4.48Å; L190-F210 HydrophobicContact CD2-CD2 3.85Å; L190-F210 HydrophobicContact CD2-CE1 4.38Å; L190-F210 HydrophobicContact CD2-CE2 3.76Å; L190-F210 HydrophobicContact CD2-CG 4.24Å; L190-F210 HydrophobicContact CD2-CZ 4.04Å; L190-F212 HydrophobicContact CD1-CZ 4.36Å; L190-F212 HydrophobicContact CD2-CZ 3.87Å; L190-F212 HydrophobicContact CG-CZ 3.85Å; L190-I224 HydrophobicContact CD1-CG2 3.53Å; L190-W228 HydrophobicContact CB-CD2 3.68Å; L190-W228 HydrophobicContact CB-CE3 4.09Å; L190-W228 HydrophobicContact CB-CG 3.98Å; L190-W228 HydrophobicContact CB-CZ2 4.3Å; L190-W228 HydrophobicContact CD1-CB 4.46Å; L190-W228 HydrophobicContact CD1-CD2 4Å; L190-W228 HydrophobicContact CD1-CE3 3.69Å; L190-W228 HydrophobicContact CD1-CG 4.35Å; L190-W228 HydrophobicContact CD1-CZ3 4.28Å; L190-W228 HydrophobicContact CG-CD2 4.43Å; L190-W228 HydrophobicContact CG-CE3 4.38Å
191	Q	97.8	Very high	96.1	Very high	1 Å²	1	38.1 Å²	38.1	1%	0.005	21%	0.207	C	C	.	.	H	α-helix	trans	-58.3	-34.3	176	-170.2	67.3	25.7	0	0	112.4	A187 G195 D196 W228 L231 Q234 A239	A187-Q191 PolarHBondContact O-N 2.85Å; Q191-G195 WeakPolarHBondContact O-CA 3.4Å; Q191-G195 PolarHBondContact O-N 3.43Å; Q191-G195 PolarHBondContact OE1-O 3.06Å; Q191-G195 VanDerWaalsContact OE1-O 3.05Å; Q191-D196 PolarHBondContact NE2-OD1 2.93Å; Q191-W228 VanDerWaalsContact OE1-CD1 3.27Å; Q191-W228 VanDerWaalsContact OE1-NE1 3.14Å; Q191-L231 HydrophobicContact CB-CB 4.23Å; Q191-L231 HydrophobicContact CB-CD1 3.92Å; Q191-L231 HydrophobicContact CG-CB 3.92Å; Q191-L231 HydrophobicContact CG-CD1 4.43Å; Q191-L231 PolarHBondContact NE2-O 2.74Å; Q191-Q234 HydrophobicContact CG-CB 4.2Å; Q191-Q234 PolarHBondContact NE2-O 2.95Å; Q191-A239 HydrophobicContact CB-CB 4.1Å; Q191-A239 HydrophobicContact CG-CB 4.08Å
192	S	96.5	Very high	95.9	Very high	13 Å²	13	38.8 Å²	38.8	9%	0.091	21%	0.209	C	C	.	.	H	α-helix	trans	-74.9	-19.4	177.6	74.9	0	0	0	0	115.4	Y188 C189 L190	Y188-S192 VanDerWaalsContact O-CB 3.29Å; Y188-S192 WeakPolarHBondContact O-CB 3.21Å; Y188-S192 PolarHBondContact O-N 3.13Å; Y188-S192 PolarHBondContact O-OG 2.95Å; C189-S192 PolarHBondContact O-N 3.07Å; C189-S192 PolarHBondContact O-OG 3.33Å; L190-S192 PolarHBondContact O-N 3.12Å
193	E	95	Very high	95.5	Very high	43 Å²	43	40.3 Å²	40.3	20%	0.201	22%	0.22	C	C	.	.	H	α-helix	trans	-113.6	-38.6	-172.5	-172.5	177	143.4	0	0	113.3	R167 C189 L190 F210 P394 S395	R167-E193 IonicContact NH1-OE2 3.68Å; C189-E193 WeakPolarHBondContact O-CB 3.44Å; C189-E193 PolarHBondContact O-N 2.93Å; L190-E193 PolarHBondContact O-N 2.75Å; E193-F210 WeakPolarHBondContact OE1-CE1 3.44Å; E193-P394 WeakPolarHBondContact OE1-CA 3.39Å; E193-S395 WeakPolarHBondContact OE1-CB 3.45Å; E193-S395 PolarHBondContact OE1-N 3.49Å; E193-S395 WeakPolarHBondContact OE2-CB 3.32Å; E193-S395 PolarHBondContact OE2-N 2.77Å; E193-S395 PolarHBondContact OE2-OG 3.04Å
194	L	95.1	Very high	95.1	Very high	49 Å²	49	41.9 Å²	41.9	26%	0.257	23%	0.23	S	C	.	.	H	α-helix	trans	-105.5	-17.4	-177.7	-55.5	-177.8	0	0	0	112.6	L190 L206 F210 W228	L190-L194 HydrophobicContact CD2-CD1 3.96Å; L190-L194 PolarHBondContact O-N 3.28Å; L194-L206 HydrophobicContact CD1-CD2 4.14Å; L194-F210 HydrophobicContact CD1-CE2 4.16Å; L194-F210 HydrophobicContact CD1-CZ 3.96Å; L194-F210 HydrophobicContact CD2-CZ 4.36Å; L194-F210 HydrophobicContact CG-CZ 4.37Å; L194-W228 HydrophobicContact CB-CH2 4.04Å; L194-W228 HydrophobicContact CB-CZ2 3.71Å; L194-W228 HydrophobicContact CD1-CH2 3.52Å; L194-W228 HydrophobicContact CD1-CZ2 4.02Å; L194-W228 HydrophobicContact CD1-CZ3 4.3Å; L194-W228 HydrophobicContact CG-CH2 4.42Å; L194-W228 HydrophobicContact CG-CZ2 4.47Å
195	G	95.7	Very high	94.7	Very high	22 Å²	22	44.3 Å²	44.3	23%	0.227	24%	0.241	C	C	.	.			trans	79.9	-151.6	-172.8	0	0	0	0	0	112.3	Q191 W228	Q191-G195 WeakPolarHBondContact O-CA 3.4Å; Q191-G195 PolarHBondContact O-N 3.43Å; Q191-G195 PolarHBondContact OE1-O 3.06Å; Q191-G195 VanDerWaalsContact OE1-O 3.05Å; G195-W228 PolarHBondContact O-NE1 2.99Å
196	D	96.9	Very high	94.5	Very high	65 Å²	65	45.2 Å²	45.2	35%	0.348	25%	0.246	S	C	.	.	S	Bend	trans	-58.7	140	-179.9	-78.9	3.7	0	0	0	112.3	Q191 D198 R232 G233	Q191-D196 PolarHBondContact NE2-OD1 2.93Å; D196-D198 PolarHBondContact O-N 2.93Å; D196-R232 HydrophobicContact CB-CG 4.16Å; D196-R232 WeakPolarHBondContact OD1-CA 3.41Å; D196-R232 WeakPolarHBondContact OD2-CG 3.4Å; D196-R232 IonicContact OD2-NE 3.26Å; D196-G233 PolarHBondContact OD1-N 3.38Å; D196-G233 PolarHBondContact OD2-N 2.96Å
197	C	96.1	Very high	94.4	Very high	9 Å²	9	45.2 Å²	45.2	6%	0.061	25%	0.246	C	C	.	.			trans	-76.8	115.9	174.1	-170.1	0	0	0	0	111.5	F225 W228 L229	C197-F225 VanDerWaalsContact SG-CE2 3.58Å; C197-W228 HydrophobicContact CB-CD2 3.58Å; C197-W228 HydrophobicContact CB-CE3 3.99Å; C197-W228 HydrophobicContact CB-CG 3.85Å; C197-W228 HydrophobicContact CB-CH2 4.44Å; C197-W228 HydrophobicContact CB-CZ2 4.03Å; C197-W228 HydrophobicContact CB-CZ3 4.42Å; C197-L229 HydrophobicContact CB-CD2 3.89Å; C197-L229 HydrophobicContact CB-CG 4.47Å
198	D	93.8	Very high	94.2	Very high	69 Å²	69	45.3 Å²	45.3	37%	0.369	25%	0.246	S	C	.	.			trans	-89.9	117.5	165.5	-165.3	-39.5	0	0	0	110.4	D196 L200 E201 H202	D196-D198 PolarHBondContact O-N 2.93Å; D198-L200 PolarHBondContact O-N 3.09Å; D198-L200 VanDerWaalsContact O-N 3.13Å; D198-L200 VanDerWaalsContact OD1-CB 3.3Å; D198-L200 WeakPolarHBondContact OD1-CB 3.31Å; D198-L200 PolarHBondContact OD1-N 3.07Å; D198-E201 HydrophobicContact CB-CB 4.47Å; D198-E201 PolarHBondContact O-N 3.21Å; D198-H202 PolarHBondContact N-ND1 3.17Å; D198-H202 WeakPolarHBondContact O-CB 3.44Å; D198-H202 PolarHBondContact O-N 3.22Å
199	P	89.7	Confident	94	Very high	88 Å²	88	46 Å²	46	57%	0.571	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-10	177	-19.3	31.4	0	0	0	115.6	L229	P199-L229 HydrophobicContact CG-CD2 3.82Å
200	L	90.4	Very high	93.9	Very high	161 Å²	161	45.9 Å²	45.9	84%	0.843	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.8	-27.4	178.5	-57.1	177.2	0	0	0	112.7	D198	D198-L200 PolarHBondContact O-N 3.09Å; D198-L200 VanDerWaalsContact O-N 3.13Å; D198-L200 VanDerWaalsContact OD1-CB 3.3Å; D198-L200 WeakPolarHBondContact OD1-CB 3.31Å; D198-L200 PolarHBondContact OD1-N 3.07Å
201	E	89.3	Confident	93.7	Very high	162 Å²	162	50.6 Å²	50.6	76%	0.757	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.4	-25.1	179.5	-60.4	-160.7	154.1	0	0	113.3	D198	D198-E201 HydrophobicContact CB-CB 4.47Å; D198-E201 PolarHBondContact O-N 3.21Å
202	H	93.3	Very high	93.6	Very high	35 Å²	35	51.4 Å²	51.4	16%	0.162	27%	0.271	C	S	.	.			trans	-111.3	146.9	-176.3	-56	153.5	0	0	0	112.5	D198 L206 F225 W228	D198-H202 PolarHBondContact N-ND1 3.17Å; D198-H202 WeakPolarHBondContact O-CB 3.44Å; D198-H202 PolarHBondContact O-N 3.22Å; H202-L206 HydrophobicContact CB-CD2 4.02Å; H202-L206 VanDerWaalsContact CD2-CD2 3.42Å; H202-L206 WeakPolarHBondContact CD2-CD2 3.43Å; H202-F225 HydrophobicContact CB-CE2 3.98Å; H202-F225 WeakPolarHBondContact O-CE2 3.2Å; H202-F225 WeakPolarHBondContact O-CZ 3.38Å; H202-W228 HydrophobicContact CB-CH2 4.15Å; H202-W228 HydrophobicContact CB-CZ3 3.98Å; H202-W228 AromaticContact CE1-CH2 3.47Å; H202-W228 VanDerWaalsContact CE1-CH2 3.47Å; H202-W228 WeakPolarHBondContact CE1-CH2 3.47Å; H202-W228 AromaticContact CE1-CZ2 3.79Å; H202-W228 AromaticContact CG-CH2 3.61Å; H202-W228 AromaticContact CG-CZ3 3.98Å; H202-W228 AromaticContact ND1-CH2 3.11Å; H202-W228 WeakPolarHBondContact ND1-CH2 3.35Å; H202-W228 AromaticContact ND1-CZ2 3.63Å; H202-W228 AromaticContact ND1-CZ3 3.8Å
203	S	90.9	Very high	93.5	Very high	44 Å²	44	51.9 Å²	51.9	31%	0.308	27%	0.273	S	S	.	.			trans	-146.4	169	178.6	76.1	0	0	0	0	111.7	E205 L206	S203-E205 WeakPolarHBondContact CB-OE2 3.3Å; S203-E205 PolarHBondContact O-N 2.94Å; S203-E205 PolarHBondContact OG-N 2.93Å; S203-E205 PolarHBondContact OG-OE2 2.99Å; S203-L206 VanDerWaalsContact O-CB 3.31Å; S203-L206 WeakPolarHBondContact O-CB 3.29Å; S203-L206 PolarHBondContact O-N 2.67Å
204	P	89.9	Confident	93.4	Very high	46 Å²	46	54 Å²	54	30%	0.299	29%	0.291	S	S	.	.	H	α-helix	trans	-56.7	-29.3	174.6	-26.2	36.2	0	0	0	114.1	L206 V207 S208 F225	P204-L206 VanDerWaalsContact C-N 3.26Å; P204-L206 PolarHBondContact O-N 2.8Å; P204-V207 WeakPolarHBondContact O-CB 3.39Å; P204-V207 PolarHBondContact O-N 2.78Å; P204-V207 VanDerWaalsContact O-N 3.08Å; P204-S208 PolarHBondContact O-N 2.93Å; P204-F225 HydrophobicContact CB-CB 4.44Å; P204-F225 HydrophobicContact CG-CB 4.09Å; P204-F225 HydrophobicContact CG-CD1 3.96Å; P204-F225 HydrophobicContact CG-CG 3.97Å
205	E	90.1	Very high	93.2	Very high	88 Å²	88	59.3 Å²	59.3	41%	0.411	31%	0.312	S	S	.	.	H	α-helix	trans	-61.6	-33.8	175.4	-65.2	80.2	-178.4	0	0	112.6	S203 V207 S208 S400 T402	S203-E205 WeakPolarHBondContact CB-OE2 3.3Å; S203-E205 PolarHBondContact O-N 2.94Å; S203-E205 PolarHBondContact OG-N 2.93Å; S203-E205 PolarHBondContact OG-OE2 2.99Å; E205-V207 VanDerWaalsContact C-N 3.35Å; E205-S208 PolarHBondContact O-N 3.03Å; E205-S208 PolarHBondContact O-OG 3.4Å; E205-S400 PolarHBondContact O-OG 3.2Å; E205-T402 HydrophobicContact CG-CG2 4.06Å
206	L	93.4	Very high	93.1	Very high	24 Å²	24	59.3 Å²	59.3	13%	0.126	31%	0.306	C	S	.	.	H	α-helix	trans	-64.7	-39.3	173.6	176.1	61.1	0	0	0	110.9	L194 H202 S203 P204 S208 E209 F210 W228 R397	L194-L206 HydrophobicContact CD1-CD2 4.14Å; H202-L206 HydrophobicContact CB-CD2 4.02Å; H202-L206 VanDerWaalsContact CD2-CD2 3.42Å; H202-L206 WeakPolarHBondContact CD2-CD2 3.43Å; S203-L206 VanDerWaalsContact O-CB 3.31Å; S203-L206 WeakPolarHBondContact O-CB 3.29Å; S203-L206 PolarHBondContact O-N 2.67Å; P204-L206 VanDerWaalsContact C-N 3.26Å; P204-L206 PolarHBondContact O-N 2.8Å; L206-S208 PolarHBondContact O-N 3.46Å; L206-E209 WeakPolarHBondContact O-CB 3.46Å; L206-E209 PolarHBondContact O-N 2.86Å; L206-E209 VanDerWaalsContact O-N 3.1Å; L206-F210 HydrophobicContact CD1-CE2 4.26Å; L206-F210 HydrophobicContact CG-CE2 4.46Å; L206-F210 VanDerWaalsContact O-CD2 3.3Å; L206-F210 WeakPolarHBondContact O-CD2 3.31Å; L206-W228 HydrophobicContact CD2-CH2 4.36Å; L206-W228 HydrophobicContact CD2-CZ3 4.36Å; L206-R397 VanDerWaalsContact CD1-NH1 3.3Å
207	V	95.4	Very high	93	Very high	0 Å²	0	58.5 Å²	58.5	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-60.2	-36.7	175.9	-174.3	0	0	0	0	110.9	L190 P204 E205 E209 F210 F212 E221 I224 F225	L190-V207 HydrophobicContact CD1-CG1 4.27Å; L190-V207 HydrophobicContact CD1-CG2 3.97Å; P204-V207 WeakPolarHBondContact O-CB 3.39Å; P204-V207 PolarHBondContact O-N 2.78Å; P204-V207 VanDerWaalsContact O-N 3.08Å; E205-V207 VanDerWaalsContact C-N 3.35Å; V207-E209 PolarHBondContact O-N 3.33Å; V207-F210 WeakPolarHBondContact O-CB 3.15Å; V207-F210 PolarHBondContact O-N 3.09Å; V207-F212 HydrophobicContact CG1-CE2 3.91Å; V207-E221 HydrophobicContact CB-CB 4.3Å; V207-E221 HydrophobicContact CB-CG 4.41Å; V207-E221 HydrophobicContact CG1-CB 4.21Å; V207-E221 HydrophobicContact CG1-CG 4.06Å; V207-I224 HydrophobicContact CG1-CB 3.92Å; V207-I224 HydrophobicContact CG1-CD1 4.27Å; V207-I224 HydrophobicContact CG1-CG2 3.56Å; V207-I224 HydrophobicContact CG2-CG2 4.43Å; V207-F225 HydrophobicContact CG2-CB 4.04Å; V207-F225 HydrophobicContact CG2-CD2 4.35Å
208	S	94.3	Very high	93	Very high	2 Å²	2	64.6 Å²	64.6	1%	0.014	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-14.3	177.9	82	0	0	0	0	115	P204 E205 L206 F210 R211 E221 S400 R401	P204-S208 PolarHBondContact O-N 2.93Å; E205-S208 PolarHBondContact O-N 3.03Å; E205-S208 PolarHBondContact O-OG 3.4Å; L206-S208 PolarHBondContact O-N 3.46Å; S208-F210 PolarHBondContact O-N 3.09Å; S208-R211 PolarHBondContact O-NH2 3.27Å; S208-E221 VanDerWaalsContact CB-CD 3.42Å; S208-E221 WeakPolarHBondContact CB-OE1 3.24Å; S208-E221 WeakPolarHBondContact CB-OE2 3.38Å; S208-S400 WeakPolarHBondContact OG-CA 3.43Å; S208-S400 PolarHBondContact OG-OG 3.17Å; S208-R401 PolarHBondContact OG-N 2.75Å
209	E	95	Very high	93.1	Very high	41 Å²	41	64.2 Å²	64.2	19%	0.192	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69	-24.4	169	-59.3	-164.2	157.4	0	0	112	L206 V207 R397 Y398	L206-E209 WeakPolarHBondContact O-CB 3.46Å; L206-E209 PolarHBondContact O-N 2.86Å; L206-E209 VanDerWaalsContact O-N 3.1Å; V207-E209 PolarHBondContact O-N 3.33Å; E209-R397 HydrophobicContact CB-CB 4.31Å; E209-R397 HydrophobicContact CB-CG 4.35Å; E209-R397 CarbonylContact O-C 3.59Å; E209-R397 WeakPolarHBondContact O-CA 3.11Å; E209-R397 VanDerWaalsContact OE2-CD 3.3Å; E209-R397 WeakPolarHBondContact OE2-CD 3.18Å; E209-R397 IonicContact OE2-CZ 2.85Å; E209-R397 IonicContact OE2-NE 2.77Å; E209-R397 IonicContact OE2-NH1 3.78Å; E209-R397 PolarHBondContact OE2-NH1 3.25Å; E209-Y398 WeakPolarHBondContact CA-O 3.33Å; E209-Y398 WeakPolarHBondContact CB-O 3.27Å; E209-Y398 PolarHBondContact O-N 2.87Å
210	F	95.4	Very high	93.5	Very high	2 Å²	2	60.5 Å²	60.5	1%	0.009	32%	0.315	C	S	.	.	S	Bend	trans	-91.4	167.4	178.2	-63	-98.2	0	0	0	111.3	L190 E193 L194 L206 V207 S208 F212 Q216	L190-F210 HydrophobicContact CD2-CD1 4.48Å; L190-F210 HydrophobicContact CD2-CD2 3.85Å; L190-F210 HydrophobicContact CD2-CE1 4.38Å; L190-F210 HydrophobicContact CD2-CE2 3.76Å; L190-F210 HydrophobicContact CD2-CG 4.24Å; L190-F210 HydrophobicContact CD2-CZ 4.04Å; E193-F210 WeakPolarHBondContact OE1-CE1 3.44Å; L194-F210 HydrophobicContact CD1-CE2 4.16Å; L194-F210 HydrophobicContact CD1-CZ 3.96Å; L194-F210 HydrophobicContact CD2-CZ 4.36Å; L194-F210 HydrophobicContact CG-CZ 4.37Å; L206-F210 HydrophobicContact CD1-CE2 4.26Å; L206-F210 HydrophobicContact CG-CE2 4.46Å; L206-F210 VanDerWaalsContact O-CD2 3.3Å; L206-F210 WeakPolarHBondContact O-CD2 3.31Å; V207-F210 WeakPolarHBondContact O-CB 3.15Å; V207-F210 PolarHBondContact O-N 3.09Å; S208-F210 PolarHBondContact O-N 3.09Å; F210-F212 HydrophobicContact CB-CD2 4.2Å; F210-F212 HydrophobicContact CB-CE1 4.02Å; F210-F212 HydrophobicContact CB-CE2 3.4Å; F210-F212 VanDerWaalsContact CB-CE2 3.4Å; F210-F212 HydrophobicContact CB-CZ 3.29Å; F210-F212 HydrophobicContact CD1-CE1 4.48Å; F210-F212 HydrophobicContact CD1-CZ 4.11Å; F210-F212 HydrophobicContact CD2-CZ 4.42Å; F210-F212 HydrophobicContact CG-CE1 4.46Å; F210-F212 HydrophobicContact CG-CE2 4.22Å; F210-F212 AromaticContact CG-CZ 3.72Å; F210-F212 HydrophobicContact CG-CZ 3.72Å; F210-Q216 PolarHBondContact O-NE2 2.95Å
211	R	94.6	Very high	93.8	Very high	99 Å²	99	53.1 Å²	53.1	37%	0.374	28%	0.276	S	S	.	.			trans	-132.5	114.9	171.7	-60.1	-65.9	140.9	134	-1.4	108.4	L171 S208 Y398	L171-R211 HydrophobicContact CD2-CB 4.16Å; S208-R211 PolarHBondContact O-NH2 3.27Å; R211-Y398 HydrophobicContact CG-CD2 3.76Å; R211-Y398 HydrophobicContact CG-CE2 3.84Å; R211-Y398 HydrophobicContact CG-CG 4.41Å
212	F	95.4	Very high	94.1	Very high	18 Å²	18	47.4 Å²	47.4	8%	0.079	26%	0.257	C	S	.	.			trans	-110.4	-32.6	-179.2	-55.5	-71.1	0	0	0	112.6	I170 A186 C189 L190 V207 F210 I224	I170-F212 WeakPolarHBondContact CG2-O 3.49Å; A186-F212 HydrophobicContact CB-CB 3.71Å; A186-F212 HydrophobicContact CB-CD1 3.73Å; A186-F212 HydrophobicContact CB-CD2 3.59Å; A186-F212 HydrophobicContact CB-CE1 4.23Å; A186-F212 HydrophobicContact CB-CE2 4.09Å; A186-F212 HydrophobicContact CB-CG 3.38Å; A186-F212 HydrophobicContact CB-CZ 4.38Å; C189-F212 HydrophobicContact CB-CD1 4.1Å; C189-F212 HydrophobicContact CB-CE1 3.61Å; L190-F212 HydrophobicContact CD1-CZ 4.36Å; L190-F212 HydrophobicContact CD2-CZ 3.87Å; L190-F212 HydrophobicContact CG-CZ 3.85Å; V207-F212 HydrophobicContact CG1-CE2 3.91Å; F210-F212 HydrophobicContact CB-CD2 4.2Å; F210-F212 HydrophobicContact CB-CE1 4.02Å; F210-F212 HydrophobicContact CB-CE2 3.4Å; F210-F212 VanDerWaalsContact CB-CE2 3.4Å; F210-F212 HydrophobicContact CB-CZ 3.29Å; F210-F212 HydrophobicContact CD1-CE1 4.48Å; F210-F212 HydrophobicContact CD1-CZ 4.11Å; F210-F212 HydrophobicContact CD2-CZ 4.42Å; F210-F212 HydrophobicContact CG-CE1 4.46Å; F210-F212 HydrophobicContact CG-CE2 4.22Å; F210-F212 AromaticContact CG-CZ 3.72Å; F210-F212 HydrophobicContact CG-CZ 3.72Å; F212-I224 HydrophobicContact CD2-CD1 4.1Å
213	T	94.7	Very high	94.4	Very high	22 Å²	22	49 Å²	49	14%	0.135	27%	0.266	C	S	.	.	S	Bend	trans	-141.7	150.5	-179.6	177.2	0	0	0	0	111.1	K215 Q216 M220	T213-K215 PolarHBondContact O-N 2.86Å; T213-Q216 HydrophobicContact CG2-CB 3.96Å; T213-Q216 HydrophobicContact CG2-CG 4.45Å; T213-Q216 PolarHBondContact O-N 3.43Å; T213-M220 HydrophobicContact CG2-CE 4.06Å; T213-M220 HydrophobicContact CG2-SD 3.42Å; T213-M220 WeakPolarHBondContact CG2-SD 3.35Å
214	P	92.1	Very high	94.7	Very high	87 Å²	87	47 Å²	47	57%	0.565	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-23.7	177.5	-26.6	36.4	0	0	0	115.1
215	K	90.8	Very high	95.1	Very high	162 Å²	162	46.2 Å²	46.2	70%	0.704	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-114.6	43.8	-177.3	-64.9	-171.2	176.8	-174.5	0	112.7	T213 S217	T213-K215 PolarHBondContact O-N 2.86Å; K215-S217 PolarHBondContact O-N 3.05Å
216	Q	94.1	Very high	95.5	Very high	21 Å²	21	45.3 Å²	45.3	10%	0.098	25%	0.247	C	C	.	.			trans	-70.5	115.1	-177.8	-163.9	175.9	-62.5	0	0	111.6	F210 T213 M220 E221 R401	F210-Q216 PolarHBondContact O-NE2 2.95Å; T213-Q216 HydrophobicContact CG2-CB 3.96Å; T213-Q216 HydrophobicContact CG2-CG 4.45Å; T213-Q216 PolarHBondContact O-N 3.43Å; Q216-M220 HydrophobicContact CG-SD 4.45Å; Q216-E221 HydrophobicContact CG-CG 4.06Å; Q216-E221 WeakPolarHBondContact CG-OE1 3.45Å; Q216-E221 PolarHBondContact NE2-OE1 2.56Å; Q216-R401 PolarHBondContact O-NH2 2.81Å
217	S	95.1	Very high	95.7	Very high	48 Å²	48	47.4 Å²	47.4	34%	0.336	25%	0.254	S	S	.	.			trans	-101	166	178.5	65.4	0	0	0	0	112	K215 M220 E221	K215-S217 PolarHBondContact O-N 3.05Å; S217-M220 PolarHBondContact O-N 3.15Å; S217-M220 WeakPolarHBondContact OG-CB 3.44Å; S217-M220 PolarHBondContact OG-N 3.37Å; S217-E221 WeakPolarHBondContact O-CG 3.23Å; S217-E221 PolarHBondContact O-N 2.65Å
218	E	95.2	Very high	95.9	Very high	138 Å²	138	47.4 Å²	47.4	65%	0.645	25%	0.254	S	S	*	.	H	α-helix	trans	-65.6	-39.5	176	-172.3	172.4	166.2	0	0	112.3	M220 E221 A222	E218-M220 VanDerWaalsContact C-N 3.33Å; E218-M220 PolarHBondContact O-N 3.08Å; E218-E221 WeakPolarHBondContact O-CB 3.25Å; E218-E221 PolarHBondContact O-N 3.05Å; E218-E221 VanDerWaalsContact O-N 3.17Å; E218-A222 PolarHBondContact O-N 2.69Å
219	A	96.4	Very high	96	Very high	61 Å²	61	50.4 Å²	50.4	50%	0.504	27%	0.269	S	S	.	.	H	α-helix	trans	-59.7	-43	171.1	0	0	0	0	0	111.8	E221 A222 D223	A219-E221 VanDerWaalsContact C-N 3.33Å; A219-E221 PolarHBondContact O-N 3.29Å; A219-A222 PolarHBondContact O-N 3.08Å; A219-D223 VanDerWaalsContact O-CG 3.32Å; A219-D223 PolarHBondContact O-N 2.57Å
220	M	97.1	Very high	96.1	Very high	10 Å²	10	53.5 Å²	53.5	5%	0.049	29%	0.287	C	S	.	.	H	α-helix	trans	-65.8	-35.5	175.3	-173.2	-173.6	-78.9	0	0	111.9	Y179 V183 T213 Q216 S217 E218 A222 D223 I224	Y179-M220 HydrophobicContact CD2-CE 3.42Å; Y179-M220 VanDerWaalsContact CD2-CE 3.42Å; Y179-M220 HydrophobicContact CE2-CB 4.04Å; Y179-M220 HydrophobicContact CE2-CE 3.39Å; Y179-M220 HydrophobicContact CE2-CG 4.23Å; Y179-M220 HydrophobicContact CG-CE 4.33Å; Y179-M220 VanDerWaalsContact OH-CA 3.28Å; Y179-M220 WeakPolarHBondContact OH-CA 3.25Å; Y179-M220 PolarHBondContact OH-N 3.07Å; V183-M220 HydrophobicContact CG2-CG 3.93Å; T213-M220 HydrophobicContact CG2-CE 4.06Å; T213-M220 HydrophobicContact CG2-SD 3.42Å; T213-M220 WeakPolarHBondContact CG2-SD 3.35Å; Q216-M220 HydrophobicContact CG-SD 4.45Å; S217-M220 PolarHBondContact O-N 3.15Å; S217-M220 WeakPolarHBondContact OG-CB 3.44Å; S217-M220 PolarHBondContact OG-N 3.37Å; E218-M220 VanDerWaalsContact C-N 3.33Å; E218-M220 PolarHBondContact O-N 3.08Å; M220-A222 VanDerWaalsContact C-N 3.32Å; M220-A222 PolarHBondContact O-N 3.3Å; M220-D223 PolarHBondContact O-N 2.87Å; M220-I224 HydrophobicContact CG-CD1 3.73Å; M220-I224 HydrophobicContact CG-CG1 4.23Å; M220-I224 VanDerWaalsContact O-CB 3.31Å; M220-I224 WeakPolarHBondContact O-CB 3.33Å; M220-I224 WeakPolarHBondContact O-CD1 3.36Å; M220-I224 WeakPolarHBondContact O-CG1 3.49Å; M220-I224 PolarHBondContact O-N 3.2Å; M220-I224 HydrophobicContact SD-CD1 4.3Å
221	E	97.1	Very high	96.2	Very high	5 Å²	5	54 Å²	54	2%	0.023	29%	0.29	C	S	.	.	H	α-helix	trans	-65.1	-35.6	175.3	-75.2	156.4	-178.5	0	0	111.9	V207 S208 Q216 S217 E218 A219 F225 R401	V207-E221 HydrophobicContact CB-CB 4.3Å; V207-E221 HydrophobicContact CB-CG 4.41Å; V207-E221 HydrophobicContact CG1-CB 4.21Å; V207-E221 HydrophobicContact CG1-CG 4.06Å; S208-E221 VanDerWaalsContact CB-CD 3.42Å; S208-E221 WeakPolarHBondContact CB-OE1 3.24Å; S208-E221 WeakPolarHBondContact CB-OE2 3.38Å; Q216-E221 HydrophobicContact CG-CG 4.06Å; Q216-E221 WeakPolarHBondContact CG-OE1 3.45Å; Q216-E221 PolarHBondContact NE2-OE1 2.56Å; S217-E221 WeakPolarHBondContact O-CG 3.23Å; S217-E221 PolarHBondContact O-N 2.65Å; E218-E221 WeakPolarHBondContact O-CB 3.25Å; E218-E221 PolarHBondContact O-N 3.05Å; E218-E221 VanDerWaalsContact O-N 3.17Å; A219-E221 VanDerWaalsContact C-N 3.33Å; A219-E221 PolarHBondContact O-N 3.29Å; E221-F225 WeakPolarHBondContact O-CB 3.32Å; E221-F225 PolarHBondContact O-N 2.87Å; E221-F225 VanDerWaalsContact O-N 3.08Å; E221-R401 IonicContact OE1-CZ 2.64Å; E221-R401 IonicContact OE1-NE 2.67Å; E221-R401 IonicContact OE1-NH2 2.73Å; E221-R401 PolarHBondContact OE1-NH2 3.02Å; E221-R401 IonicContact OE2-CZ 3.76Å; E221-R401 VanDerWaalsContact OE2-CZ 3.29Å; E221-R401 IonicContact OE2-NE 3.6Å; E221-R401 PolarHBondContact OE2-NE 2.78Å; E221-R401 IonicContact OE2-NH2 2.66Å; E221-R401 PolarHBondContact OE2-NH2 2.62Å
222	A	96.9	Very high	96.3	Very high	43 Å²	43	58.8 Å²	58.8	36%	0.355	31%	0.308	S	S	.	.	H	α-helix	trans	-69.8	-44	170.8	0	0	0	0	0	112.9	E218 A219 M220 I224 F225 S226	E218-A222 PolarHBondContact O-N 2.69Å; A219-A222 PolarHBondContact O-N 3.08Å; M220-A222 VanDerWaalsContact C-N 3.32Å; M220-A222 PolarHBondContact O-N 3.3Å; A222-I224 VanDerWaalsContact C-N 3.34Å; A222-I224 PolarHBondContact O-N 2.92Å; A222-F225 PolarHBondContact O-N 3.3Å; A222-S226 PolarHBondContact O-N 3.37Å
223	D	98.3	Very high	96.3	Very high	69 Å²	69	60.7 Å²	60.7	37%	0.369	33%	0.333	S	S	.	.	H	α-helix	trans	-62.7	-40.2	176.9	-67.8	-26.1	0	0	0	111.6	Y179 V183 A219 M220 S226 R227	Y179-D223 VanDerWaalsContact CE1-OD2 3.3Å; Y179-D223 WeakPolarHBondContact CE1-OD2 3.41Å; Y179-D223 PolarHBondContact OH-OD2 2.8Å; V183-D223 HydrophobicContact CG1-CB 3.97Å; V183-D223 HydrophobicContact CG2-CB 3.97Å; A219-D223 VanDerWaalsContact O-CG 3.32Å; A219-D223 PolarHBondContact O-N 2.57Å; M220-D223 PolarHBondContact O-N 2.87Å; D223-S226 PolarHBondContact O-N 2.98Å; D223-R227 VanDerWaalsContact O-CB 3.26Å; D223-R227 WeakPolarHBondContact O-CB 3.24Å; D223-R227 PolarHBondContact O-N 3.28Å
224	I	98.3	Very high	96.5	Very high	0 Å²	0	61.5 Å²	61.5	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-63.9	-43.4	174.6	-70.5	164.6	0	0	0	110.9	V183 A186 L190 V207 F212 M220 A222 R227 W228	V183-I224 HydrophobicContact CB-CG1 4.28Å; V183-I224 HydrophobicContact CG1-CG1 4.13Å; V183-I224 HydrophobicContact CG2-CG1 4.27Å; A186-I224 HydrophobicContact CB-CD1 3.47Å; A186-I224 VanDerWaalsContact CB-CD1 3.47Å; A186-I224 HydrophobicContact CB-CG1 3.72Å; A186-I224 HydrophobicContact CB-CG2 3.93Å; L190-I224 HydrophobicContact CD1-CG2 3.53Å; V207-I224 HydrophobicContact CG1-CB 3.92Å; V207-I224 HydrophobicContact CG1-CD1 4.27Å; V207-I224 HydrophobicContact CG1-CG2 3.56Å; V207-I224 HydrophobicContact CG2-CG2 4.43Å; F212-I224 HydrophobicContact CD2-CD1 4.1Å; M220-I224 HydrophobicContact CG-CD1 3.73Å; M220-I224 HydrophobicContact CG-CG1 4.23Å; M220-I224 VanDerWaalsContact O-CB 3.31Å; M220-I224 WeakPolarHBondContact O-CB 3.33Å; M220-I224 WeakPolarHBondContact O-CD1 3.36Å; M220-I224 WeakPolarHBondContact O-CG1 3.49Å; M220-I224 PolarHBondContact O-N 3.2Å; M220-I224 HydrophobicContact SD-CD1 4.3Å; A222-I224 VanDerWaalsContact C-N 3.34Å; A222-I224 PolarHBondContact O-N 2.92Å; I224-R227 PolarHBondContact O-N 2.98Å; I224-W228 WeakPolarHBondContact O-CB 3.24Å; I224-W228 PolarHBondContact O-N 2.73Å
225	F	98	Very high	96.6	Very high	30 Å²	30	59.3 Å²	59.3	13%	0.132	32%	0.321	C	S	.	.	H	α-helix	trans	-61.6	-47.9	176.1	-178.7	-101.9	0	0	0	111.3	C197 H202 P204 V207 E221 A222 R227 W228 L229	C197-F225 VanDerWaalsContact SG-CE2 3.58Å; H202-F225 HydrophobicContact CB-CE2 3.98Å; H202-F225 WeakPolarHBondContact O-CE2 3.2Å; H202-F225 WeakPolarHBondContact O-CZ 3.38Å; P204-F225 HydrophobicContact CB-CB 4.44Å; P204-F225 HydrophobicContact CG-CB 4.09Å; P204-F225 HydrophobicContact CG-CD1 3.96Å; P204-F225 HydrophobicContact CG-CG 3.97Å; V207-F225 HydrophobicContact CG2-CB 4.04Å; V207-F225 HydrophobicContact CG2-CD2 4.35Å; E221-F225 WeakPolarHBondContact O-CB 3.32Å; E221-F225 PolarHBondContact O-N 2.87Å; E221-F225 VanDerWaalsContact O-N 3.08Å; A222-F225 PolarHBondContact O-N 3.3Å; F225-R227 VanDerWaalsContact C-N 3.31Å; F225-R227 PolarHBondContact O-N 2.92Å; F225-W228 HydrophobicContact CD2-CE3 4.33Å; F225-W228 PolarHBondContact O-N 2.95Å; F225-L229 HydrophobicContact CD1-CD1 4.37Å; F225-L229 HydrophobicContact CE1-CD1 4.03Å; F225-L229 PolarHBondContact O-N 3.26Å
226	S	97.8	Very high	96.9	Very high	69 Å²	69	53.7 Å²	53.7	48%	0.483	30%	0.302	S	S	.	.	H	α-helix	trans	-57.5	-45	174.9	-168.2	0	0	0	0	111.5	A222 D223 W228 L229	A222-S226 PolarHBondContact O-N 3.37Å; D223-S226 PolarHBondContact O-N 2.98Å; S226-W228 VanDerWaalsContact C-N 3.32Å; S226-W228 PolarHBondContact O-N 3.31Å; S226-L229 WeakPolarHBondContact O-CB 3.25Å; S226-L229 PolarHBondContact O-N 2.98Å
227	R	98.2	Very high	96.8	Very high	69 Å²	69	54 Å²	54	26%	0.26	31%	0.306	S	S	.	.	H	α-helix	trans	-70.2	-26	-179.3	-170.4	65.3	-173.4	113.1	9.7	113.2	V183 E184 A187 D223 I224 F225 D230 L231	V183-R227 HydrophobicContact CG1-CB 3.91Å; V183-R227 HydrophobicContact CG1-CG 4.26Å; E184-R227 HydrophobicContact CG-CG 4.44Å; A187-R227 HydrophobicContact CB-CB 3.93Å; A187-R227 HydrophobicContact CB-CG 3.77Å; D223-R227 VanDerWaalsContact O-CB 3.26Å; D223-R227 WeakPolarHBondContact O-CB 3.24Å; D223-R227 PolarHBondContact O-N 3.28Å; I224-R227 PolarHBondContact O-N 2.98Å; F225-R227 VanDerWaalsContact C-N 3.31Å; F225-R227 PolarHBondContact O-N 2.92Å; R227-D230 IonicContact CZ-OD2 3.26Å; R227-D230 IonicContact NH1-OD2 3.02Å; R227-D230 PolarHBondContact NH1-OD2 2.98Å; R227-L231 WeakPolarHBondContact O-CG 3.35Å
228	W	98.3	Very high	96.9	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-72.8	-34.8	175.2	180	22.9	0	0	0	112	A187 L190 Q191 L194 G195 C197 H202 L206 I224 F225 S226 D230 L231	A187-W228 HydrophobicContact CB-CB 4.3Å; L190-W228 HydrophobicContact CB-CD2 3.68Å; L190-W228 HydrophobicContact CB-CE3 4.09Å; L190-W228 HydrophobicContact CB-CG 3.98Å; L190-W228 HydrophobicContact CB-CZ2 4.3Å; L190-W228 HydrophobicContact CD1-CB 4.46Å; L190-W228 HydrophobicContact CD1-CD2 4Å; L190-W228 HydrophobicContact CD1-CE3 3.69Å; L190-W228 HydrophobicContact CD1-CG 4.35Å; L190-W228 HydrophobicContact CD1-CZ3 4.28Å; L190-W228 HydrophobicContact CG-CD2 4.43Å; L190-W228 HydrophobicContact CG-CE3 4.38Å; Q191-W228 VanDerWaalsContact OE1-CD1 3.27Å; Q191-W228 VanDerWaalsContact OE1-NE1 3.14Å; L194-W228 HydrophobicContact CB-CH2 4.04Å; L194-W228 HydrophobicContact CB-CZ2 3.71Å; L194-W228 HydrophobicContact CD1-CH2 3.52Å; L194-W228 HydrophobicContact CD1-CZ2 4.02Å; L194-W228 HydrophobicContact CD1-CZ3 4.3Å; L194-W228 HydrophobicContact CG-CH2 4.42Å; L194-W228 HydrophobicContact CG-CZ2 4.47Å; G195-W228 PolarHBondContact O-NE1 2.99Å; C197-W228 HydrophobicContact CB-CD2 3.58Å; C197-W228 HydrophobicContact CB-CE3 3.99Å; C197-W228 HydrophobicContact CB-CG 3.85Å; C197-W228 HydrophobicContact CB-CH2 4.44Å; C197-W228 HydrophobicContact CB-CZ2 4.03Å; C197-W228 HydrophobicContact CB-CZ3 4.42Å; H202-W228 HydrophobicContact CB-CH2 4.15Å; H202-W228 HydrophobicContact CB-CZ3 3.98Å; H202-W228 AromaticContact CE1-CH2 3.47Å; H202-W228 VanDerWaalsContact CE1-CH2 3.47Å; H202-W228 WeakPolarHBondContact CE1-CH2 3.47Å; H202-W228 AromaticContact CE1-CZ2 3.79Å; H202-W228 AromaticContact CG-CH2 3.61Å; H202-W228 AromaticContact CG-CZ3 3.98Å; H202-W228 AromaticContact ND1-CH2 3.11Å; H202-W228 WeakPolarHBondContact ND1-CH2 3.35Å; H202-W228 AromaticContact ND1-CZ2 3.63Å; H202-W228 AromaticContact ND1-CZ3 3.8Å; L206-W228 HydrophobicContact CD2-CH2 4.36Å; L206-W228 HydrophobicContact CD2-CZ3 4.36Å; I224-W228 WeakPolarHBondContact O-CB 3.24Å; I224-W228 PolarHBondContact O-N 2.73Å; F225-W228 HydrophobicContact CD2-CE3 4.33Å; F225-W228 PolarHBondContact O-N 2.95Å; S226-W228 VanDerWaalsContact C-N 3.32Å; S226-W228 PolarHBondContact O-N 3.31Å; W228-D230 PolarHBondContact O-N 3.27Å; W228-L231 PolarHBondContact O-N 3.23Å
229	L	97.2	Very high	97	Very high	64 Å²	64	49.9 Å²	49.9	34%	0.335	28%	0.282	S	S	.	.	H	α-helix	trans	-57.3	-36.9	172.8	-66.5	166.4	0	0	0	112.4	C197 P199 F225 S226 L231	C197-L229 HydrophobicContact CB-CD2 3.89Å; C197-L229 HydrophobicContact CB-CG 4.47Å; P199-L229 HydrophobicContact CG-CD2 3.82Å; F225-L229 HydrophobicContact CD1-CD1 4.37Å; F225-L229 HydrophobicContact CE1-CD1 4.03Å; F225-L229 PolarHBondContact O-N 3.26Å; S226-L229 WeakPolarHBondContact O-CB 3.25Å; S226-L229 PolarHBondContact O-N 2.98Å; L229-L231 PolarHBondContact O-N 3.28Å
230	D	97.1	Very high	97	Very high	107 Å²	107	47.1 Å²	47.1	57%	0.572	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-18	176.9	-62.2	-28.5	0	0	0	114.3	R227 W228 R232	R227-D230 IonicContact CZ-OD2 3.26Å; R227-D230 IonicContact NH1-OD2 3.02Å; R227-D230 PolarHBondContact NH1-OD2 2.98Å; W228-D230 PolarHBondContact O-N 3.27Å; D230-R232 VanDerWaalsContact C-N 3.32Å
231	L	97.6	Very high	96.9	Very high	12 Å²	12	48.4 Å²	48.4	6%	0.063	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.2	4.2	-174	-58.4	-177.5	0	0	0	113.4	A187 Y188 Q191 R227 W228 L229 G233 Q234	A187-L231 HydrophobicContact CB-CD1 3.85Å; Y188-L231 HydrophobicContact CD1-CD1 3.66Å; Y188-L231 HydrophobicContact CD1-CD2 4.2Å; Y188-L231 HydrophobicContact CE1-CD1 3.98Å; Y188-L231 HydrophobicContact CE1-CD2 3.65Å; Y188-L231 HydrophobicContact CE1-CG 4.49Å; Y188-L231 HydrophobicContact CG-CD1 4.37Å; Q191-L231 HydrophobicContact CB-CB 4.23Å; Q191-L231 HydrophobicContact CB-CD1 3.92Å; Q191-L231 HydrophobicContact CG-CB 3.92Å; Q191-L231 HydrophobicContact CG-CD1 4.43Å; Q191-L231 PolarHBondContact NE2-O 2.74Å; R227-L231 WeakPolarHBondContact O-CG 3.35Å; W228-L231 PolarHBondContact O-N 3.23Å; L229-L231 PolarHBondContact O-N 3.28Å; L231-G233 PolarHBondContact O-N 3.28Å; L231-Q234 WeakPolarHBondContact O-CB 3.45Å; L231-Q234 PolarHBondContact O-N 3.5Å
232	R	96.4	Very high	97	Very high	199 Å²	199	49.6 Å²	49.6	75%	0.751	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.5	131.1	-176.5	-165.8	-175.1	-178.5	-178.4	4.8	112.7	D196 D230 Q234	D196-R232 HydrophobicContact CB-CG 4.16Å; D196-R232 WeakPolarHBondContact OD1-CA 3.41Å; D196-R232 WeakPolarHBondContact OD2-CG 3.4Å; D196-R232 IonicContact OD2-NE 3.26Å; D230-R232 VanDerWaalsContact C-N 3.32Å; R232-Q234 VanDerWaalsContact C-N 3.33Å
233	G	96.6	Very high	97	Very high	59 Å²	59	47.7 Å²	47.7	61%	0.608	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.9	-5.4	-176.3	0	0	0	0	0	114.5	D196 L231	D196-G233 PolarHBondContact OD1-N 3.38Å; D196-G233 PolarHBondContact OD2-N 2.96Å; L231-G233 PolarHBondContact O-N 3.28Å
234	Q	97.4	Very high	97	Very high	39 Å²	39	44.4 Å²	44.4	18%	0.182	24%	0.24	C	C	.	.			trans	-79	123.5	175.1	-170.1	173.8	48.7	0	0	110.7	Q191 L231 R232 Q238 A239 S242	Q191-Q234 HydrophobicContact CG-CB 4.2Å; Q191-Q234 PolarHBondContact NE2-O 2.95Å; L231-Q234 WeakPolarHBondContact O-CB 3.45Å; L231-Q234 PolarHBondContact O-N 3.5Å; R232-Q234 VanDerWaalsContact C-N 3.33Å; Q234-Q238 HydrophobicContact CG-CB 3.44Å; Q234-Q238 VanDerWaalsContact CG-CB 3.44Å; Q234-Q238 PolarHBondContact NE2-O 2.83Å; Q234-A239 HydrophobicContact CG-CB 4.38Å; Q234-S242 PolarHBondContact NE2-OG 2.85Å
235	S	95.8	Very high	96.9	Very high	40 Å²	40	46.3 Å²	46.3	28%	0.28	25%	0.25	S	S	.	.			trans	-67.1	157.5	177.2	85	0	0	0	0	111.9	S237 Q238 A239	S235-S237 PolarHBondContact O-N 2.91Å; S235-S237 PolarHBondContact OG-N 2.89Å; S235-S237 PolarHBondContact OG-OG 3.42Å; S235-Q238 WeakPolarHBondContact O-CA 3.47Å; S235-Q238 WeakPolarHBondContact O-CB 3.14Å; S235-Q238 PolarHBondContact O-N 3.18Å; S235-Q238 WeakPolarHBondContact OG-CG 3.27Å; S235-Q238 PolarHBondContact OG-N 2.78Å; S235-A239 PolarHBondContact O-N 3.1Å
236	P	95.3	Very high	96.9	Very high	45 Å²	45	47.9 Å²	47.9	29%	0.292	26%	0.257	S	S	.	.	H	α-helix	trans	-52.8	-39.1	175.5	-32.6	38.5	0	0	0	114.4	A239 E240	P236-A239 PolarHBondContact O-N 2.98Å; P236-E240 WeakPolarHBondContact O-CB 3.39Å; P236-E240 VanDerWaalsContact O-CG 3.24Å; P236-E240 WeakPolarHBondContact O-CG 3.16Å; P236-E240 PolarHBondContact O-N 3.02Å
237	S	93.4	Very high	96.9	Very high	28 Å²	28	44.6 Å²	44.6	20%	0.196	23%	0.234	C	C	.	.	H	α-helix	trans	-77.8	-20.7	178.2	51.9	0	0	0	0	114.6	E156 S235 I241	E156-S237 WeakPolarHBondContact OE2-CB 3.32Å; E156-S237 PolarHBondContact OE2-OG 3.35Å; S235-S237 PolarHBondContact O-N 2.91Å; S235-S237 PolarHBondContact OG-N 2.89Å; S235-S237 PolarHBondContact OG-OG 3.42Å; S237-I241 WeakPolarHBondContact O-CG2 3.39Å; S237-I241 PolarHBondContact O-N 3.24Å
238	Q	95.9	Very high	96.7	Very high	99 Å²	99	42.9 Å²	42.9	46%	0.463	23%	0.229	S	C	.	.	H	α-helix	trans	-75.8	-38.5	166.9	-72	172.1	-31.5	0	0	111.6	Q234 S235 I241 S242	Q234-Q238 HydrophobicContact CG-CB 3.44Å; Q234-Q238 VanDerWaalsContact CG-CB 3.44Å; Q234-Q238 PolarHBondContact NE2-O 2.83Å; S235-Q238 WeakPolarHBondContact O-CA 3.47Å; S235-Q238 WeakPolarHBondContact O-CB 3.14Å; S235-Q238 PolarHBondContact O-N 3.18Å; S235-Q238 WeakPolarHBondContact OG-CG 3.27Å; S235-Q238 PolarHBondContact OG-N 2.78Å; Q238-I241 WeakPolarHBondContact O-CG2 3.49Å; Q238-S242 WeakPolarHBondContact O-CB 3.41Å; Q238-S242 PolarHBondContact O-N 3.19Å; Q238-S242 PolarHBondContact O-OG 3.03Å
239	A	97.4	Very high	96.5	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-64.9	-43	174.3	0	0	0	0	0	111.1	Y188 Q191 Q234 S235 P236 S242 F243	Y188-A239 HydrophobicContact CD1-CB 4.24Å; Q191-A239 HydrophobicContact CB-CB 4.1Å; Q191-A239 HydrophobicContact CG-CB 4.08Å; Q234-A239 HydrophobicContact CG-CB 4.38Å; S235-A239 PolarHBondContact O-N 3.1Å; P236-A239 PolarHBondContact O-N 2.98Å; A239-S242 WeakPolarHBondContact O-CB 3.36Å; A239-S242 PolarHBondContact O-N 3.35Å; A239-F243 WeakPolarHBondContact O-CB 3.26Å; A239-F243 PolarHBondContact O-N 3.1Å
240	E	96.6	Very high	96.4	Very high	2 Å²	2	50.3 Å²	50.3	1%	0.009	25%	0.254	C	S	.	.	H	α-helix	trans	-60	-48.6	174.2	-74.1	163.6	177.1	0	0	112.8	Y160 V163 P236 S242 F243 L244 R392	Y160-E240 WeakPolarHBondContact CD2-OE1 3.36Å; V163-E240 HydrophobicContact CG2-CB 4.09Å; V163-E240 HydrophobicContact CG2-CG 4.11Å; P236-E240 WeakPolarHBondContact O-CB 3.39Å; P236-E240 VanDerWaalsContact O-CG 3.24Å; P236-E240 WeakPolarHBondContact O-CG 3.16Å; P236-E240 PolarHBondContact O-N 3.02Å; E240-S242 VanDerWaalsContact C-N 3.25Å; E240-S242 PolarHBondContact O-N 3.42Å; E240-F243 WeakPolarHBondContact O-CB 3.49Å; E240-F243 PolarHBondContact O-N 2.91Å; E240-L244 VanDerWaalsContact O-CG 3.3Å; E240-L244 WeakPolarHBondContact O-CG 3.5Å; E240-L244 PolarHBondContact O-N 3.02Å; E240-R392 IonicContact OE1-CZ 2.76Å; E240-R392 VanDerWaalsContact OE1-CZ 3.26Å; E240-R392 IonicContact OE1-NE 2.72Å; E240-R392 PolarHBondContact OE1-NE 3.43Å; E240-R392 IonicContact OE1-NH2 2.85Å; E240-R392 PolarHBondContact OE1-NH2 2.61Å; E240-R392 IonicContact OE2-CZ 2.73Å; E240-R392 IonicContact OE2-NE 3.29Å; E240-R392 IonicContact OE2-NH2 3.33Å; E240-R392 PolarHBondContact OE2-NH2 2.71Å
241	I	96.1	Very high	96.2	Very high	38 Å²	38	50 Å²	50	20%	0.195	25%	0.249	C	C	.	.	H	α-helix	trans	-69.2	-25.8	179.1	-167.2	54.8	0	0	0	112.3	P150 N151 S237 Q238 N245	P150-I241 HydrophobicContact CB-CD1 3.71Å; N151-I241 WeakPolarHBondContact OD1-CD1 3.4Å; S237-I241 WeakPolarHBondContact O-CG2 3.39Å; S237-I241 PolarHBondContact O-N 3.24Å; Q238-I241 WeakPolarHBondContact O-CG2 3.49Å; I241-N245 WeakPolarHBondContact O-CB 3.45Å; I241-N245 PolarHBondContact O-N 3.29Å; I241-N245 PolarHBondContact O-ND2 2.91Å
242	S	97.7	Very high	96.1	Very high	30 Å²	30	50.7 Å²	50.7	21%	0.21	25%	0.253	C	S	.	.	H	α-helix	trans	-69.8	-47.2	170.5	-57.8	0	0	0	0	111.6	Y188 Q234 Q238 A239 E240 L244 N245 K246	Y188-S242 VanDerWaalsContact CE1-CB 3.41Å; Q234-S242 PolarHBondContact NE2-OG 2.85Å; Q238-S242 WeakPolarHBondContact O-CB 3.41Å; Q238-S242 PolarHBondContact O-N 3.19Å; Q238-S242 PolarHBondContact O-OG 3.03Å; A239-S242 WeakPolarHBondContact O-CB 3.36Å; A239-S242 PolarHBondContact O-N 3.35Å; E240-S242 VanDerWaalsContact C-N 3.25Å; E240-S242 PolarHBondContact O-N 3.42Å; S242-L244 VanDerWaalsContact C-N 3.32Å; S242-L244 PolarHBondContact O-N 2.93Å; S242-N245 PolarHBondContact O-N 2.79Å; S242-K246 WeakPolarHBondContact O-CB 3.43Å; S242-K246 PolarHBondContact O-N 3.02Å
243	F	98.4	Very high	96.1	Very high	2 Å²	2	41.9 Å²	41.9	1%	0.009	22%	0.219	C	C	.	.	H	α-helix	trans	-53.7	-47.7	173.2	-179.8	-73.2	0	0	0	111.2	V163 L166 R167 I170 L185 Y188 C189 A239 E240 K246 C247	V163-F243 HydrophobicContact CB-CD1 4.3Å; V163-F243 HydrophobicContact CB-CE1 4.41Å; V163-F243 HydrophobicContact CG1-CD1 4.05Å; V163-F243 HydrophobicContact CG1-CD2 4.36Å; V163-F243 HydrophobicContact CG1-CE1 4.05Å; V163-F243 HydrophobicContact CG1-CE2 4.37Å; V163-F243 HydrophobicContact CG1-CG 4.23Å; V163-F243 HydrophobicContact CG1-CZ 4.23Å; V163-F243 HydrophobicContact CG2-CB 4.4Å; V163-F243 HydrophobicContact CG2-CD1 3.74Å; V163-F243 HydrophobicContact CG2-CE1 4.3Å; V163-F243 HydrophobicContact CG2-CG 4.19Å; L166-F243 HydrophobicContact CB-CE1 3.77Å; L166-F243 HydrophobicContact CB-CZ 4.3Å; L166-F243 HydrophobicContact CD1-CE1 4.18Å; R167-F243 HydrophobicContact CG-CE2 4.16Å; R167-F243 HydrophobicContact CG-CZ 3.86Å; I170-F243 HydrophobicContact CD1-CZ 4.28Å; L185-F243 HydrophobicContact CB-CD2 3.98Å; L185-F243 HydrophobicContact CB-CE2 3.72Å; L185-F243 HydrophobicContact CB-CZ 4.49Å; L185-F243 HydrophobicContact CD2-CB 4.25Å; L185-F243 HydrophobicContact CD2-CD1 4.07Å; L185-F243 HydrophobicContact CD2-CD2 3.51Å; L185-F243 HydrophobicContact CD2-CE1 4.28Å; L185-F243 HydrophobicContact CD2-CE2 3.76Å; L185-F243 HydrophobicContact CD2-CG 3.67Å; L185-F243 HydrophobicContact CD2-CZ 4.13Å; L185-F243 WeakPolarHBondContact CD2-O 3.38Å; L185-F243 HydrophobicContact CG-CD2 4.34Å; L185-F243 HydrophobicContact CG-CE2 4.24Å; L185-F243 WeakPolarHBondContact O-CD2 3.33Å; L185-F243 WeakPolarHBondContact O-CE2 3.25Å; Y188-F243 HydrophobicContact CD2-CB 4.37Å; Y188-F243 HydrophobicContact CG-CB 4.42Å; C189-F243 WeakPolarHBondContact SG-CE2 3.37Å; A239-F243 WeakPolarHBondContact O-CB 3.26Å; A239-F243 PolarHBondContact O-N 3.1Å; E240-F243 WeakPolarHBondContact O-CB 3.49Å; E240-F243 PolarHBondContact O-N 2.91Å; F243-K246 PolarHBondContact O-N 3.38Å; F243-C247 WeakPolarHBondContact CE1-SG 3.43Å; F243-C247 WeakPolarHBondContact O-CB 3.46Å; F243-C247 PolarHBondContact O-N 3.07Å; F243-C247 PolarHBondContact O-SG 3.18Å
244	L	97.8	Very high	96	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-67.1	-43.4	-180	-63.6	176.8	0	0	0	112.4	P150 L153 R159 F162 V163 L166 E240 S242 K246 C247 K248	P150-L244 HydrophobicContact CB-CB 3.59Å; P150-L244 HydrophobicContact CB-CD1 4.17Å; P150-L244 HydrophobicContact CG-CB 3.77Å; L153-L244 HydrophobicContact CD1-CD1 4.31Å; R159-L244 HydrophobicContact CB-CD1 3.85Å; R159-L244 HydrophobicContact CG-CD1 4.06Å; F162-L244 HydrophobicContact CB-CD1 4.3Å; F162-L244 HydrophobicContact CB-CD2 3.82Å; V163-L244 HydrophobicContact CG2-CD1 4.43Å; V163-L244 HydrophobicContact CG2-CD2 3.79Å; V163-L244 HydrophobicContact CG2-CG 3.89Å; L166-L244 HydrophobicContact CD1-CD2 3.38Å; E240-L244 VanDerWaalsContact O-CG 3.3Å; E240-L244 WeakPolarHBondContact O-CG 3.5Å; E240-L244 PolarHBondContact O-N 3.02Å; S242-L244 VanDerWaalsContact C-N 3.32Å; S242-L244 PolarHBondContact O-N 2.93Å; L244-K246 VanDerWaalsContact C-N 3.26Å; L244-K246 PolarHBondContact O-N 2.89Å; L244-C247 PolarHBondContact O-N 2.94Å; L244-K248 PolarHBondContact O-N 3.32Å
245	N	97.1	Very high	95.8	Very high	40 Å²	40	38 Å²	38	21%	0.214	19%	0.189	C	C	.	.	H	α-helix	trans	-68.3	-23	176.6	-84.6	-66.4	0	0	0	113.4	N151 I241 S242 K248 W249	N151-N245 PolarHBondContact OD1-ND2 3.48Å; N151-N245 VanDerWaalsContact OD1-ND2 3.07Å; I241-N245 WeakPolarHBondContact O-CB 3.45Å; I241-N245 PolarHBondContact O-N 3.29Å; I241-N245 PolarHBondContact O-ND2 2.91Å; S242-N245 PolarHBondContact O-N 2.79Å; N245-K248 PolarHBondContact OD1-NZ 3.21Å; N245-W249 PolarHBondContact O-NE1 2.77Å
246	K	97.3	Very high	95.8	Very high	64 Å²	64	38.6 Å²	38.6	28%	0.278	19%	0.188	S	C	.	.	H	α-helix	trans	-76	-43.6	167.8	-166.4	78.3	176.5	-158.9	0	111.3	V181 E184 L185 S242 F243 L244 K248	V181-K246 HydrophobicContact CG1-CG 3.93Å; E184-K246 WeakPolarHBondContact OE1-CE 3.46Å; E184-K246 IonicContact OE1-NZ 2.98Å; E184-K246 PolarHBondContact OE1-NZ 2.94Å; E184-K246 VanDerWaalsContact OE2-CE 3.26Å; E184-K246 WeakPolarHBondContact OE2-CE 3.32Å; E184-K246 IonicContact OE2-NZ 2.65Å; E184-K246 PolarHBondContact OE2-NZ 3.44Å; L185-K246 HydrophobicContact CD2-CB 3.98Å; L185-K246 HydrophobicContact CD2-CG 4.21Å; S242-K246 WeakPolarHBondContact O-CB 3.43Å; S242-K246 PolarHBondContact O-N 3.02Å; F243-K246 PolarHBondContact O-N 3.38Å; L244-K246 VanDerWaalsContact C-N 3.26Å; L244-K246 PolarHBondContact O-N 2.89Å; K246-K248 PolarHBondContact O-N 2.85Å
247	C	97.3	Very high	95.7	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-63.1	-37.6	-179.2	-75.5	0	0	0	0	114.1	L166 L185 F243 L244 W249 L250 Y253	L166-C247 HydrophobicContact CD1-CB 4.14Å; L185-C247 WeakPolarHBondContact CD2-SG 3.46Å; F243-C247 WeakPolarHBondContact CE1-SG 3.43Å; F243-C247 WeakPolarHBondContact O-CB 3.46Å; F243-C247 PolarHBondContact O-N 3.07Å; F243-C247 PolarHBondContact O-SG 3.18Å; L244-C247 PolarHBondContact O-N 2.94Å; C247-W249 PolarHBondContact O-N 3.12Å; C247-W249 VanDerWaalsContact O-N 3.09Å; C247-L250 WeakPolarHBondContact O-CB 3.32Å; C247-L250 PolarHBondContact O-N 3.22Å; C247-Y253 HydrophobicContact CB-CD2 4.07Å; C247-Y253 HydrophobicContact CB-CE2 4.22Å; C247-Y253 WeakPolarHBondContact O-CD2 3.08Å
248	K	94.7	Very high	95.7	Very high	33 Å²	33	38 Å²	38	14%	0.143	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-21.8	-173.6	80.9	-174.5	-169.8	-173.7	0	114.6	E149 P150 L244 N245 K246 Y253	E149-K248 IonicContact OE1-NZ 3.75Å; E149-K248 PolarHBondContact OE1-NZ 3.46Å; E149-K248 IonicContact OE2-NZ 2.79Å; P150-K248 HydrophobicContact CG-CB 4.4Å; P150-K248 HydrophobicContact CG-CD 4.17Å; L244-K248 PolarHBondContact O-N 3.32Å; N245-K248 PolarHBondContact OD1-NZ 3.21Å; K246-K248 PolarHBondContact O-N 2.85Å; K248-Y253 HydrophobicContact CB-CD1 4.37Å; K248-Y253 HydrophobicContact CB-CE1 4.2Å
249	W	94.3	Very high	95.6	Very high	199 Å²	199	39.1 Å²	39.1	75%	0.754	18%	0.183	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.7	-7.2	178.1	-58	116.2	0	0	0	113.8	N245 C247	N245-W249 PolarHBondContact O-NE1 2.77Å; C247-W249 PolarHBondContact O-N 3.12Å; C247-W249 VanDerWaalsContact O-N 3.09Å
250	L	95	Very high	95.6	Very high	21 Å²	21	39.5 Å²	39.5	11%	0.11	19%	0.185	C	C	.	.	S	Bend	trans	-73.8	134.8	175.9	-67.1	171.8	0	0	0	110.3	L175 C177 V181 L185 C247 L252 Y253	L175-L250 HydrophobicContact CD1-CB 3.75Å; L175-L250 HydrophobicContact CD1-CD1 3.85Å; L175-L250 HydrophobicContact CD1-CG 4.46Å; L175-L250 HydrophobicContact CD2-CD1 4.1Å; L175-L250 HydrophobicContact CG-CD1 3.98Å; C177-L250 WeakPolarHBondContact SG-CD1 3.38Å; V181-L250 HydrophobicContact CG1-CD1 4.46Å; V181-L250 HydrophobicContact CG1-CD2 4.16Å; L185-L250 HydrophobicContact CD1-CD1 4.44Å; C247-L250 WeakPolarHBondContact O-CB 3.32Å; C247-L250 PolarHBondContact O-N 3.22Å; L250-L252 PolarHBondContact O-N 2.96Å; L250-L252 VanDerWaalsContact O-N 3.07Å; L250-Y253 WeakPolarHBondContact O-CB 3.42Å; L250-Y253 PolarHBondContact O-N 2.64Å
251	E	92.1	Very high	95.5	Very high	100 Å²	100	43.5 Å²	43.5	47%	0.467	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-29.2	-174	175.5	163.8	-96.1	0	0	115.1	F280 K285	E251-F280 HydrophobicContact CG-CZ 4.09Å; E251-K285 HydrophobicContact CG-CD 4.34Å; E251-K285 WeakPolarHBondContact OE1-CD 3.28Å; E251-K285 WeakPolarHBondContact OE1-CE 3.35Å; E251-K285 IonicContact OE1-NZ 2.86Å; E251-K285 PolarHBondContact OE1-NZ 2.73Å
252	L	94.8	Very high	95.4	Very high	27 Å²	27	42 Å²	42	14%	0.141	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.6	12.8	179.6	-59.2	179.6	0	0	0	113.2	L175 K176 L250 G254 V255 M257 F280	L175-L252 HydrophobicContact CD1-CB 4.12Å; K176-L252 HydrophobicContact CB-CD1 4.18Å; K176-L252 HydrophobicContact CD-CD1 3.93Å; K176-L252 HydrophobicContact CG-CD1 3.9Å; L250-L252 PolarHBondContact O-N 2.96Å; L250-L252 VanDerWaalsContact O-N 3.07Å; L252-G254 PolarHBondContact O-N 3.09Å; L252-V255 PolarHBondContact O-N 3.37Å; L252-M257 HydrophobicContact CD2-CE 4.19Å; L252-F280 HydrophobicContact CD2-CE2 4.37Å; L252-F280 HydrophobicContact CD2-CZ 4.05Å
253	Y	96.3	Very high	94.8	Very high	13 Å²	13	46.5 Å²	46.5	5%	0.051	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.6	119.8	178.2	175.6	-102.3	0	0	0	111.7	Y146 S147 L166 C247 K248 L250 V255 P274	Y146-Y253 HydrophobicContact CD1-CE2 4.23Å; S147-Y253 WeakPolarHBondContact O-CE1 3.42Å; S147-Y253 PolarHBondContact O-OH 3.02Å; L166-Y253 HydrophobicContact CD1-CE2 4.04Å; L166-Y253 HydrophobicContact CD2-CD2 3.89Å; L166-Y253 HydrophobicContact CD2-CE2 3.86Å; C247-Y253 HydrophobicContact CB-CD2 4.07Å; C247-Y253 HydrophobicContact CB-CE2 4.22Å; C247-Y253 WeakPolarHBondContact O-CD2 3.08Å; K248-Y253 HydrophobicContact CB-CD1 4.37Å; K248-Y253 HydrophobicContact CB-CE1 4.2Å; L250-Y253 WeakPolarHBondContact O-CB 3.42Å; L250-Y253 PolarHBondContact O-N 2.64Å; Y253-V255 PolarHBondContact O-N 2.87Å; Y253-V255 VanDerWaalsContact O-N 3.09Å; Y253-P274 HydrophobicContact CE1-CG 4.29Å
254	G	94.5	Very high	94.2	Very high	10 Å²	10	50 Å²	50	10%	0.103	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	64.5	8.4	179.1	0	0	0	0	0	115.8	Y146 L252 D256	Y146-G254 VanDerWaalsContact CG-CA 3.4Å; L252-G254 PolarHBondContact O-N 3.09Å; G254-D256 PolarHBondContact O-N 3.42Å
255	V	95.1	Very high	93.8	Very high	8 Å²	8	51.9 Å²	51.9	5%	0.048	25%	0.247	C	C	.	.			trans	-71	127.7	-171.8	178.4	0	0	0	0	111.9	K174 L252 Y253 M257 L272 T273 L278	K174-V255 VanDerWaalsContact CE-O 3.29Å; K174-V255 WeakPolarHBondContact CE-O 3.41Å; K174-V255 PolarHBondContact NZ-O 3.46Å; K174-V255 VanDerWaalsContact NZ-O 3.17Å; L252-V255 PolarHBondContact O-N 3.37Å; Y253-V255 PolarHBondContact O-N 2.87Å; Y253-V255 VanDerWaalsContact O-N 3.09Å; V255-M257 HydrophobicContact CG1-CB 4.32Å; V255-M257 HydrophobicContact CG1-CE 3.81Å; V255-M257 HydrophobicContact CG1-SD 4.43Å; V255-L272 WeakPolarHBondContact CA-O 3.29Å; V255-T273 HydrophobicContact CG2-CG2 3.99Å; V255-L278 HydrophobicContact CG2-CD2 4.22Å
256	D	93.9	Very high	93.5	Very high	51 Å²	51	51 Å²	51	27%	0.273	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	107.4	165.8	178.1	33	0	0	0	108.9	G254 H258 G271 L272	G254-D256 PolarHBondContact O-N 3.42Å; D256-H258 PolarHBondContact O-CD2 3.49Å; D256-H258 IonicContact OD1-NE2 2.89Å; D256-H258 PolarHBondContact OD1-NE2 3.18Å; D256-H258 IonicContact OD2-CD2 2.83Å; D256-H258 IonicContact OD2-CE1 2.89Å; D256-H258 IonicContact OD2-NE2 3.21Å; D256-H258 PolarHBondContact OD2-NE2 3.41Å; D256-G271 CarbonylContact O-C 3.6Å; D256-G271 WeakPolarHBondContact O-CA 3.48Å; D256-L272 HydrophobicContact CB-CB 4.31Å; D256-L272 PolarHBondContact N-O 3.17Å; D256-L272 VanDerWaalsContact N-O 3.07Å; D256-L272 PolarHBondContact O-N 3.36Å
257	M	94.1	Very high	93.5	Very high	45 Å²	45	54.2 Å²	54.2	22%	0.222	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	120.7	-163.6	-170.6	67.1	81.2	0	0	112.9	Q40 L252 V255 A269 F280	Q40-M257 PolarHBondContact NE2-O 2.57Å; L252-M257 HydrophobicContact CD2-CE 4.19Å; V255-M257 HydrophobicContact CG1-CB 4.32Å; V255-M257 HydrophobicContact CG1-CE 3.81Å; V255-M257 HydrophobicContact CG1-SD 4.43Å; M257-A269 HydrophobicContact CG-CB 4.08Å; M257-A269 HydrophobicContact SD-CB 3.53Å; M257-A269 VanDerWaalsContact SD-CB 3.53Å; M257-F280 HydrophobicContact CE-CD2 3.7Å; M257-F280 HydrophobicContact CE-CE2 3.56Å; M257-F280 HydrophobicContact CE-CZ 4.49Å; M257-F280 HydrophobicContact SD-CD2 4.32Å
258	H	93.8	Very high	93.4	Very high	15 Å²	15	54.4 Å²	54.4	7%	0.069	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	119	-178.5	-64.3	-97.9	0	0	0	111.9	D256 L270 H334 L335	D256-H258 PolarHBondContact O-CD2 3.49Å; D256-H258 IonicContact OD1-NE2 2.89Å; D256-H258 PolarHBondContact OD1-NE2 3.18Å; D256-H258 IonicContact OD2-CD2 2.83Å; D256-H258 IonicContact OD2-CE1 2.89Å; D256-H258 IonicContact OD2-NE2 3.21Å; D256-H258 PolarHBondContact OD2-NE2 3.41Å; H258-L270 PolarHBondContact N-O 3.14Å; H258-L270 PolarHBondContact O-N 3.3Å; H258-H334 AromaticContact CE1-CD2 3.69Å; H258-H334 AromaticContact CE1-NE2 3.85Å; H258-L335 HydrophobicContact CB-CD1 4.02Å; H258-L335 HydrophobicContact CB-CD2 3.94Å; H258-L335 HydrophobicContact CB-CG 4.43Å
259	F	94.4	Very high	93.5	Very high	124 Å²	124	53.1 Å²	53.1	54%	0.544	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	132.9	176.4	-62	-79	0	0	0	111.9	A269	F259-A269 HydrophobicContact CD1-CB 3.79Å; F259-A269 HydrophobicContact CE1-CB 3.84Å
260	V	95.6	Very high	93.6	Very high	7 Å²	7	43.8 Å²	43.8	4%	0.042	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	167.5	-175.5	-50.4	0	0	0	0	110.7	Y268 L270 F324 L326 L335	V260-Y268 PolarHBondContact N-O 3.4Å; V260-Y268 PolarHBondContact O-N 3.01Å; V260-L270 HydrophobicContact CG1-CD1 3.92Å; V260-L270 HydrophobicContact CG1-CG 4.2Å; V260-L270 HydrophobicContact CG2-CD1 4Å; V260-L270 HydrophobicContact CG2-CG 3.89Å; V260-F324 HydrophobicContact CB-CB 4.01Å; V260-F324 HydrophobicContact CG1-CB 4.43Å; V260-F324 HydrophobicContact CG2-CB 3.84Å; V260-F324 HydrophobicContact CG2-CD1 3.57Å; V260-F324 HydrophobicContact CG2-CE1 4.37Å; V260-F324 HydrophobicContact CG2-CG 3.92Å; V260-L326 HydrophobicContact CB-CG 4.44Å; V260-L326 HydrophobicContact CG1-CD1 3.94Å; V260-L326 HydrophobicContact CG1-CD2 4.15Å; V260-L326 HydrophobicContact CG1-CG 3.84Å; V260-L335 HydrophobicContact CG1-CD2 4.09Å
261	K	95.8	Very high	93.7	Very high	86 Å²	86	42.8 Å²	42.8	37%	0.374	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	141.2	169.5	-71.3	179.3	172	-82.7	0	111	G266 E267 F324 Q325	K261-G266 CarbonylContact C-O 3.56Å; K261-G266 VanDerWaalsContact CA-O 3.24Å; K261-G266 WeakPolarHBondContact CA-O 3.39Å; K261-E267 WeakPolarHBondContact CE-OE1 3.48Å; K261-E267 HydrophobicContact CG-CG 4.3Å; K261-E267 IonicContact NZ-OE1 2.84Å; K261-E267 PolarHBondContact NZ-OE1 2.71Å; K261-F324 CarbonylContact O-C 3.48Å; K261-F324 VanDerWaalsContact O-CA 3.31Å; K261-F324 WeakPolarHBondContact O-CA 3.23Å; K261-Q325 PolarHBondContact N-O 3.2Å; K261-Q325 PolarHBondContact O-N 3.35Å
262	G	92.9	Very high	93.9	Very high	8 Å²	8	38.3 Å²	38.3	8%	0.082	20%	0.199	C	C	.	.			trans	-75.4	-177.2	174.6	0	0	0	0	0	112.9	D264 G265 G266	G262-D264 VanDerWaalsContact C-OD1 3.29Å; G262-D264 VanDerWaalsContact CA-OD1 3.22Å; G262-D264 WeakPolarHBondContact CA-OD1 3.08Å; G262-G265 PolarHBondContact O-N 3.47Å; G262-G266 PolarHBondContact N-O 3.35Å
263	R	86.5	Confident	93.9	Very high	123 Å²	123	37.6 Å²	37.6	46%	0.464	20%	0.196	S	C	.	.	S	Bend	trans	-72.3	-36.9	174.5	-175.4	-163.1	-72.7	175.6	-2.6	111.4	G265 M769 T770	R263-G265 PolarHBondContact O-N 3.47Å; R263-M769 PolarHBondContact NH1-O 3Å; R263-M769 VanDerWaalsContact NH1-O 3.08Å; R263-T770 PolarHBondContact NH1-OG1 3.49Å
264	D	85.2	Confident	93.7	Very high	75 Å²	75	37.5 Å²	37.5	40%	0.401	20%	0.197	S	C	.	.	S	Bend	trans	-59	-23.8	169.6	57	-64.9	0	0	0	113.7	G262 G266 Y268	G262-D264 VanDerWaalsContact C-OD1 3.29Å; G262-D264 VanDerWaalsContact CA-OD1 3.22Å; G262-D264 WeakPolarHBondContact CA-OD1 3.08Å; D264-G266 VanDerWaalsContact OD2-CA 3.3Å; D264-G266 WeakPolarHBondContact OD2-CA 3.5Å; D264-G266 PolarHBondContact OD2-N 3.03Å; D264-Y268 PolarHBondContact OD2-OH 3.02Å; D264-Y268 VanDerWaalsContact OD2-OH 3.04Å
265	G	88.7	Confident	93.6	Very high	40 Å²	40	40 Å²	40	41%	0.412	21%	0.21	S	C	.	.	S	Bend	trans	98.2	-9.2	-179.4	0	0	0	0	0	115.1	G262 R263	G262-G265 PolarHBondContact O-N 3.47Å; R263-G265 PolarHBondContact O-N 3.47Å
266	G	92.4	Very high	93.5	Very high	22 Å²	22	39.6 Å²	39.6	23%	0.227	21%	0.208	C	C	.	.			trans	-59	155.7	173.7	0	0	0	0	0	113.1	K261 G262 D264 Y268	K261-G266 CarbonylContact C-O 3.56Å; K261-G266 VanDerWaalsContact CA-O 3.24Å; K261-G266 WeakPolarHBondContact CA-O 3.39Å; G262-G266 PolarHBondContact N-O 3.35Å; D264-G266 VanDerWaalsContact OD2-CA 3.3Å; D264-G266 WeakPolarHBondContact OD2-CA 3.5Å; D264-G266 PolarHBondContact OD2-N 3.03Å; G266-Y268 WeakPolarHBondContact O-CD2 3.23Å
267	E	95.3	Very high	93.6	Very high	131 Å²	131	37.4 Å²	37.4	61%	0.612	20%	0.196	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-100.4	117.4	-178.6	-59.9	-159.6	153.3	0	0	110.9	K261	K261-E267 WeakPolarHBondContact CE-OE1 3.48Å; K261-E267 HydrophobicContact CG-CG 4.3Å; K261-E267 IonicContact NZ-OE1 2.84Å; K261-E267 PolarHBondContact NZ-OE1 2.71Å
268	Y	96.4	Very high	93.7	Very high	5 Å²	5	35.5 Å²	35.5	2%	0.02	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	156	-176.3	-59	-81.8	0	0	0	110.5	V260 D264 G266 F280 E281 I286 L767	V260-Y268 PolarHBondContact N-O 3.4Å; V260-Y268 PolarHBondContact O-N 3.01Å; D264-Y268 PolarHBondContact OD2-OH 3.02Å; D264-Y268 VanDerWaalsContact OD2-OH 3.04Å; G266-Y268 WeakPolarHBondContact O-CD2 3.23Å; Y268-F280 CarbonylContact C-O 3.51Å; Y268-F280 VanDerWaalsContact CA-O 3.23Å; Y268-F280 WeakPolarHBondContact CA-O 3.33Å; Y268-F280 WeakPolarHBondContact CB-O 3.4Å; Y268-E281 HydrophobicContact CD1-CB 3.91Å; Y268-E281 HydrophobicContact CD1-CG 4.22Å; Y268-E281 HydrophobicContact CE1-CB 3.9Å; Y268-E281 HydrophobicContact CE1-CG 3.88Å; Y268-E281 WeakPolarHBondContact CE1-OE1 3.36Å; Y268-E281 PolarHBondContact OH-OE1 2.96Å; Y268-I286 HydrophobicContact CD1-CD1 3.8Å; Y268-I286 HydrophobicContact CE1-CD1 3.83Å; Y268-L767 HydrophobicContact CE2-CD2 4.02Å
269	A	96.3	Very high	93.8	Very high	6 Å²	6	35.2 Å²	35.2	5%	0.05	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	126.4	170.8	0	0	0	0	0	110.2	M257 F259 F280	M257-A269 HydrophobicContact CG-CB 4.08Å; M257-A269 HydrophobicContact SD-CB 3.53Å; M257-A269 VanDerWaalsContact SD-CB 3.53Å; F259-A269 HydrophobicContact CD1-CB 3.79Å; F259-A269 HydrophobicContact CE1-CB 3.84Å; A269-F280 HydrophobicContact CB-CB 4.29Å; A269-F280 PolarHBondContact N-O 3.5Å; A269-F280 PolarHBondContact O-N 2.93Å
270	L	96.9	Very high	93.8	Very high	3 Å²	3	30 Å²	30	2%	0.016	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	106.6	178.5	-59.8	-178.7	0	0	0	109	H258 V260 I277 L278 V279 L304 F324 L335	H258-L270 PolarHBondContact N-O 3.14Å; H258-L270 PolarHBondContact O-N 3.3Å; V260-L270 HydrophobicContact CG1-CD1 3.92Å; V260-L270 HydrophobicContact CG1-CG 4.2Å; V260-L270 HydrophobicContact CG2-CD1 4Å; V260-L270 HydrophobicContact CG2-CG 3.89Å; L270-I277 HydrophobicContact CB-CG2 4.24Å; L270-I277 HydrophobicContact CD2-CG2 4.23Å; L270-L278 CarbonylContact C-O 3.5Å; L270-L278 WeakPolarHBondContact CA-O 3.42Å; L270-V279 HydrophobicContact CD2-CB 4.41Å; L270-V279 HydrophobicContact CD2-CG1 4.04Å; L270-V279 HydrophobicContact CD2-CG2 3.87Å; L270-L304 HydrophobicContact CD1-CD2 4.14Å; L270-F324 HydrophobicContact CD1-CB 4.42Å; L270-F324 HydrophobicContact CD1-CD2 3.78Å; L270-F324 HydrophobicContact CD1-CE2 4.11Å; L270-F324 HydrophobicContact CD1-CG 4.01Å; L270-F324 HydrophobicContact CD2-CE1 4.36Å; L270-F324 HydrophobicContact CD2-CE2 4.2Å; L270-F324 HydrophobicContact CD2-CZ 4.06Å; L270-L335 HydrophobicContact CD1-CD2 4.29Å
271	G	96.5	Very high	93.8	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	114.8	173.7	0	0	0	0	0	111	D256 T273 L278	D256-G271 CarbonylContact O-C 3.6Å; D256-G271 WeakPolarHBondContact O-CA 3.48Å; G271-T273 WeakPolarHBondContact O-CG2 3.3Å; G271-L278 PolarHBondContact N-O 2.96Å; G271-L278 PolarHBondContact O-N 2.81Å
272	L	95.9	Very high	93.5	Very high	5 Å²	5	31.9 Å²	31.9	3%	0.026	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	127.4	168.6	-50.6	-179.2	0	0	0	108.6	V255 D256 I277 W291 L335 C338 A339	V255-L272 WeakPolarHBondContact CA-O 3.29Å; D256-L272 HydrophobicContact CB-CB 4.31Å; D256-L272 PolarHBondContact N-O 3.17Å; D256-L272 VanDerWaalsContact N-O 3.07Å; D256-L272 PolarHBondContact O-N 3.36Å; L272-I277 HydrophobicContact CD2-CD1 4.44Å; L272-I277 HydrophobicContact CD2-CG1 4.09Å; L272-W291 HydrophobicContact CD2-CH2 4.36Å; L272-L335 HydrophobicContact CD1-CD1 4.1Å; L272-L335 HydrophobicContact CD2-CD1 3.99Å; L272-L335 HydrophobicContact CG-CD1 4.22Å; L272-C338 HydrophobicContact CD1-CB 3.53Å; L272-A339 HydrophobicContact CD1-CB 4.07Å; L272-A339 HydrophobicContact CD2-CB 3.72Å
273	T	94.9	Very high	93.2	Very high	13 Å²	13	36.2 Å²	36.2	8%	0.08	22%	0.22	C	C	.	.			trans	-128.2	168.8	-176.8	93.3	0	0	0	0	111.1	V255 G271 T275 G276 L278 W291	V255-T273 HydrophobicContact CG2-CG2 3.99Å; G271-T273 WeakPolarHBondContact O-CG2 3.3Å; T273-T275 PolarHBondContact O-N 2.97Å; T273-T275 PolarHBondContact OG1-N 3.14Å; T273-G276 PolarHBondContact N-O 3.12Å; T273-G276 PolarHBondContact OG1-N 2.88Å; T273-G276 VanDerWaalsContact OG1-N 3.12Å; T273-G276 PolarHBondContact OG1-O 2.92Å; T273-L278 HydrophobicContact CG2-CB 3.59Å; T273-L278 HydrophobicContact CG2-CD2 4.26Å; T273-W291 WeakPolarHBondContact O-CZ2 3.07Å; T273-W291 PolarHBondContact O-NE1 2.89Å; T273-W291 VanDerWaalsContact O-NE1 3.11Å
274	P	91.8	Very high	93.5	Very high	10 Å²	10	35.2 Å²	35.2	7%	0.065	22%	0.224	C	C	.	.	S	Bend	trans	-57.9	-30.1	172.1	-25.1	37.2	0	0	0	113.2	Y146 Y253 W291 F346	Y146-P274 WeakPolarHBondContact O-CB 3.35Å; Y146-P274 WeakPolarHBondContact O-CG 3.3Å; Y253-P274 HydrophobicContact CE1-CG 4.29Å; P274-W291 VanDerWaalsContact O-CD1 3.24Å; P274-W291 PolarHBondContact O-NE1 2.89Å; P274-W291 VanDerWaalsContact O-NE1 3.14Å; P274-F346 HydrophobicContact CB-CD1 4.34Å; P274-F346 HydrophobicContact CB-CE1 3.84Å; P274-F346 HydrophobicContact CB-CE2 4.33Å; P274-F346 HydrophobicContact CB-CZ 3.84Å; P274-F346 HydrophobicContact CG-CZ 4.28Å; P274-F346 VanDerWaalsContact O-CG 3.31Å; P274-F346 WeakPolarHBondContact O-CG 3.28Å
275	T	92.3	Very high	93.9	Very high	63 Å²	63	36.6 Å²	36.6	39%	0.387	23%	0.227	S	C	.	.	S	Bend	trans	-93.9	-29	-172.7	-43.5	0	0	0	0	113.4	T273 L288 F290 W291	T273-T275 PolarHBondContact O-N 2.97Å; T273-T275 PolarHBondContact OG1-N 3.14Å; T275-L288 HydrophobicContact CG2-CD2 3.95Å; T275-F290 HydrophobicContact CG2-CD1 3.51Å; T275-F290 HydrophobicContact CG2-CE1 3.52Å; T275-F290 WeakPolarHBondContact O-CA 3.39Å; T275-W291 PolarHBondContact O-N 3.09Å; T275-W291 VanDerWaalsContact O-N 3.09Å
276	G	94.4	Very high	94	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	173.3	-157.1	-174	0	0	0	0	0	114.7	T273 F289 W291	T273-G276 PolarHBondContact N-O 3.12Å; T273-G276 PolarHBondContact OG1-N 2.88Å; T273-G276 VanDerWaalsContact OG1-N 3.12Å; T273-G276 PolarHBondContact OG1-O 2.92Å; G276-F289 CarbonylContact C-O 3.53Å; G276-F289 WeakPolarHBondContact CA-O 3.25Å; G276-W291 WeakPolarHBondContact O-CZ2 3.44Å
277	I	96.3	Very high	94	Very high	4 Å²	4	36.7 Å²	36.7	2%	0.021	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	109.1	169.6	-55.2	179.3	0	0	0	108.7	L270 L272 F289 W291 I294 L306	L270-I277 HydrophobicContact CB-CG2 4.24Å; L270-I277 HydrophobicContact CD2-CG2 4.23Å; L272-I277 HydrophobicContact CD2-CD1 4.44Å; L272-I277 HydrophobicContact CD2-CG1 4.09Å; I277-F289 PolarHBondContact N-O 3.07Å; I277-F289 PolarHBondContact O-N 2.84Å; I277-W291 HydrophobicContact CD1-CH2 4.34Å; I277-W291 HydrophobicContact CD1-CZ3 4.02Å; I277-W291 HydrophobicContact CG1-CH2 3.64Å; I277-W291 HydrophobicContact CG1-CZ3 3.62Å; I277-I294 HydrophobicContact CB-CD1 4.48Å; I277-I294 HydrophobicContact CD1-CD1 3.9Å; I277-I294 HydrophobicContact CG1-CD1 3.9Å; I277-L306 HydrophobicContact CD1-CD1 4.07Å; I277-L306 HydrophobicContact CD1-CD2 4.31Å
278	L	95.9	Very high	93.9	Very high	6 Å²	6	32.9 Å²	32.9	3%	0.031	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	137.8	173.4	-177.8	62.8	0	0	0	109.4	V255 L270 G271 T273 F280 K285 L288	V255-L278 HydrophobicContact CG2-CD2 4.22Å; L270-L278 CarbonylContact C-O 3.5Å; L270-L278 WeakPolarHBondContact CA-O 3.42Å; G271-L278 PolarHBondContact N-O 2.96Å; G271-L278 PolarHBondContact O-N 2.81Å; T273-L278 HydrophobicContact CG2-CB 3.59Å; T273-L278 HydrophobicContact CG2-CD2 4.26Å; L278-F280 HydrophobicContact CD1-CE2 4.42Å; L278-F280 HydrophobicContact CD2-CE2 3.48Å; L278-F280 VanDerWaalsContact CD2-CE2 3.48Å; L278-F280 HydrophobicContact CD2-CZ 3.84Å; L278-F280 HydrophobicContact CG-CD2 4.26Å; L278-F280 HydrophobicContact CG-CE2 3.56Å; L278-F280 HydrophobicContact CG-CZ 4.17Å; L278-K285 HydrophobicContact CD1-CD 3.87Å; L278-K285 HydrophobicContact CD1-CG 4.02Å; L278-L288 HydrophobicContact CB-CD1 4.15Å; L278-L288 HydrophobicContact CD1-CB 4.35Å
279	V	95.6	Very high	93.8	Very high	8 Å²	8	33.8 Å²	33.8	5%	0.048	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	129.5	-175.6	-170.8	0	0	0	0	110.7	L270 I286 G287 F289	L270-V279 HydrophobicContact CD2-CB 4.41Å; L270-V279 HydrophobicContact CD2-CG1 4.04Å; L270-V279 HydrophobicContact CD2-CG2 3.87Å; V279-I286 HydrophobicContact CB-CB 4.46Å; V279-I286 HydrophobicContact CG1-CB 4.49Å; V279-I286 HydrophobicContact CG1-CD1 3.75Å; V279-I286 HydrophobicContact CG1-CG1 4.35Å; V279-I286 PolarHBondContact O-N 3.33Å; V279-G287 PolarHBondContact N-O 3.28Å; V279-F289 HydrophobicContact CG2-CD2 3.88Å; V279-F289 HydrophobicContact CG2-CE2 3.74Å
280	F	95.4	Very high	93.7	Very high	15 Å²	15	38.8 Å²	38.8	7%	0.066	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	148.9	172.3	-64.7	-97.9	0	0	0	111.7	E251 L252 M257 Y268 A269 L278 N284 K285	E251-F280 HydrophobicContact CG-CZ 4.09Å; L252-F280 HydrophobicContact CD2-CE2 4.37Å; L252-F280 HydrophobicContact CD2-CZ 4.05Å; M257-F280 HydrophobicContact CE-CD2 3.7Å; M257-F280 HydrophobicContact CE-CE2 3.56Å; M257-F280 HydrophobicContact CE-CZ 4.49Å; M257-F280 HydrophobicContact SD-CD2 4.32Å; Y268-F280 CarbonylContact C-O 3.51Å; Y268-F280 VanDerWaalsContact CA-O 3.23Å; Y268-F280 WeakPolarHBondContact CA-O 3.33Å; Y268-F280 WeakPolarHBondContact CB-O 3.4Å; A269-F280 HydrophobicContact CB-CB 4.29Å; A269-F280 PolarHBondContact N-O 3.5Å; A269-F280 PolarHBondContact O-N 2.93Å; L278-F280 HydrophobicContact CD1-CE2 4.42Å; L278-F280 HydrophobicContact CD2-CE2 3.48Å; L278-F280 VanDerWaalsContact CD2-CE2 3.48Å; L278-F280 HydrophobicContact CD2-CZ 3.84Å; L278-F280 HydrophobicContact CG-CD2 4.26Å; L278-F280 HydrophobicContact CG-CE2 3.56Å; L278-F280 HydrophobicContact CG-CZ 4.17Å; F280-N284 CarbonylContact C-O 3.58Å; F280-N284 WeakPolarHBondContact CA-O 3.33Å; F280-K285 HydrophobicContact CD1-CB 3.97Å; F280-K285 HydrophobicContact CE1-CB 3.76Å; F280-K285 HydrophobicContact CZ-CB 4.45Å
281	E	94.3	Very high	93.5	Very high	63 Å²	63	39 Å²	39	29%	0.294	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	112.1	164	-177.5	170.1	-124.9	0	0	107.8	Y268 S283 N284 I286 I763	Y268-E281 HydrophobicContact CD1-CB 3.91Å; Y268-E281 HydrophobicContact CD1-CG 4.22Å; Y268-E281 HydrophobicContact CE1-CB 3.9Å; Y268-E281 HydrophobicContact CE1-CG 3.88Å; Y268-E281 WeakPolarHBondContact CE1-OE1 3.36Å; Y268-E281 PolarHBondContact OH-OE1 2.96Å; E281-S283 PolarHBondContact O-N 3.43Å; E281-S283 VanDerWaalsContact O-N 3.09Å; E281-N284 PolarHBondContact N-O 3.13Å; E281-N284 WeakPolarHBondContact O-CB 3.45Å; E281-N284 PolarHBondContact O-N 3.45Å; E281-I286 HydrophobicContact CB-CD1 3.85Å; E281-I286 HydrophobicContact CB-CG1 4.12Å; E281-I763 VanDerWaalsContact OE2-CD1 3.3Å; E281-I763 WeakPolarHBondContact OE2-CD1 3.42Å
282	G	89.8	Confident	93.3	Very high	69 Å²	69	42.7 Å²	42.7	71%	0.711	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.3	-114.8	-167.3	0	0	0	0	0	112.2
283	S	87.1	Confident	93	Very high	100 Å²	100	45.3 Å²	45.3	70%	0.699	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.5	-13.9	173.6	49.1	0	0	0	0	114.7	E281	E281-S283 PolarHBondContact O-N 3.43Å; E281-S283 VanDerWaalsContact O-N 3.09Å
284	N	91.8	Very high	92.9	Very high	102 Å²	102	44.8 Å²	44.8	55%	0.545	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	124.3	-161.5	-61.3	-4.5	0	0	0	110.5	F280 E281 I286	F280-N284 CarbonylContact C-O 3.58Å; F280-N284 WeakPolarHBondContact CA-O 3.33Å; E281-N284 PolarHBondContact N-O 3.13Å; E281-N284 WeakPolarHBondContact O-CB 3.45Å; E281-N284 PolarHBondContact O-N 3.45Å; N284-I286 PolarHBondContact O-N 2.96Å
285	K	93.4	Very high	92.8	Very high	104 Å²	104	45 Å²	45	45%	0.452	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	119.1	176	173.3	169.7	167	176.7	0	110.8	E251 L278 F280	E251-K285 HydrophobicContact CG-CD 4.34Å; E251-K285 WeakPolarHBondContact OE1-CD 3.28Å; E251-K285 WeakPolarHBondContact OE1-CE 3.35Å; E251-K285 IonicContact OE1-NZ 2.86Å; E251-K285 PolarHBondContact OE1-NZ 2.73Å; L278-K285 HydrophobicContact CD1-CD 3.87Å; L278-K285 HydrophobicContact CD1-CG 4.02Å; F280-K285 HydrophobicContact CD1-CB 3.97Å; F280-K285 HydrophobicContact CE1-CB 3.76Å; F280-K285 HydrophobicContact CZ-CB 4.45Å
286	I	91.1	Very high	92.7	Very high	39 Å²	39	45.4 Å²	45.4	20%	0.2	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	-43.1	178.5	-44.4	179.4	0	0	0	110.7	Y268 V279 E281 N284 I763	Y268-I286 HydrophobicContact CD1-CD1 3.8Å; Y268-I286 HydrophobicContact CE1-CD1 3.83Å; V279-I286 HydrophobicContact CB-CB 4.46Å; V279-I286 HydrophobicContact CG1-CB 4.49Å; V279-I286 HydrophobicContact CG1-CD1 3.75Å; V279-I286 HydrophobicContact CG1-CG1 4.35Å; V279-I286 PolarHBondContact O-N 3.33Å; E281-I286 HydrophobicContact CB-CD1 3.85Å; E281-I286 HydrophobicContact CB-CG1 4.12Å; N284-I286 PolarHBondContact O-N 2.96Å; I286-I763 HydrophobicContact CD1-CG2 4.41Å
287	G	92.3	Very high	92.6	Very high	25 Å²	25	45.6 Å²	45.6	26%	0.258	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	168.9	-177.5	-174.2	0	0	0	0	0	114.4	V279	V279-G287 PolarHBondContact N-O 3.28Å
288	L	94	Very high	92.4	Very high	50 Å²	50	46.1 Å²	46.1	26%	0.262	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	114.4	-177.9	171.9	62	0	0	0	109.6	T275 L278 F290	T275-L288 HydrophobicContact CG2-CD2 3.95Å; L278-L288 HydrophobicContact CB-CD1 4.15Å; L278-L288 HydrophobicContact CD1-CB 4.35Å; L288-F290 HydrophobicContact CD2-CE1 4.19Å; L288-F290 HydrophobicContact CD2-CE2 4.48Å; L288-F290 HydrophobicContact CD2-CZ 4.1Å; L288-F290 HydrophobicContact CG-CE2 4.44Å; L288-F290 WeakPolarHBondContact O-CD2 3.5Å; L288-F290 PolarHBondContact O-N 3.47Å
289	F	94.5	Very high	92.2	Very high	25 Å²	25	46.1 Å²	46.1	11%	0.11	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	102	173.7	-60.9	-54.5	0	0	0	109.8	G276 I277 V279 I294 L306 V308 E310 F322	G276-F289 CarbonylContact C-O 3.53Å; G276-F289 WeakPolarHBondContact CA-O 3.25Å; I277-F289 PolarHBondContact N-O 3.07Å; I277-F289 PolarHBondContact O-N 2.84Å; V279-F289 HydrophobicContact CG2-CD2 3.88Å; V279-F289 HydrophobicContact CG2-CE2 3.74Å; F289-I294 HydrophobicContact CB-CD1 4.05Å; F289-I294 HydrophobicContact CB-CG1 4.17Å; F289-I294 WeakPolarHBondContact O-CD1 3.44Å; F289-L306 HydrophobicContact CD2-CD2 3.69Å; F289-L306 HydrophobicContact CE2-CD2 4.02Å; F289-L306 HydrophobicContact CG-CD2 4.5Å; F289-V308 HydrophobicContact CB-CG1 4.47Å; F289-V308 HydrophobicContact CB-CG2 4.21Å; F289-V308 HydrophobicContact CD1-CB 4.34Å; F289-V308 HydrophobicContact CD1-CG1 3.92Å; F289-V308 HydrophobicContact CD1-CG2 3.88Å; F289-V308 HydrophobicContact CD2-CG2 4.33Å; F289-V308 HydrophobicContact CE1-CG2 4.29Å; F289-V308 HydrophobicContact CG-CG1 4.46Å; F289-V308 HydrophobicContact CG-CG2 3.9Å; F289-E310 WeakPolarHBondContact CE1-OE1 3.35Å; F289-F322 AromaticContact CE1-CE2 3.85Å; F289-F322 HydrophobicContact CE1-CE2 3.85Å; F289-F322 HydrophobicContact CE1-CZ 4.06Å; F289-F322 HydrophobicContact CE2-CD2 4.2Å; F289-F322 HydrophobicContact CE2-CE2 4.1Å; F289-F322 HydrophobicContact CE2-CZ 4.48Å; F289-F322 AromaticContact CZ-CD2 3.99Å; F289-F322 HydrophobicContact CZ-CD2 3.99Å; F289-F322 HydrophobicContact CZ-CE1 4.19Å; F289-F322 AromaticContact CZ-CE2 3.44Å; F289-F322 HydrophobicContact CZ-CE2 3.44Å; F289-F322 VanDerWaalsContact CZ-CE2 3.44Å; F289-F322 AromaticContact CZ-CZ 3.56Å; F289-F322 HydrophobicContact CZ-CZ 3.56Å
290	F	93.6	Very high	92.1	Very high	110 Å²	110	52.3 Å²	52.3	48%	0.482	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.8	139.4	-177.8	-66.9	-98.3	0	0	0	112.5	T275 L288 P292 K293 I294	T275-F290 HydrophobicContact CG2-CD1 3.51Å; T275-F290 HydrophobicContact CG2-CE1 3.52Å; T275-F290 WeakPolarHBondContact O-CA 3.39Å; L288-F290 HydrophobicContact CD2-CE1 4.19Å; L288-F290 HydrophobicContact CD2-CE2 4.48Å; L288-F290 HydrophobicContact CD2-CZ 4.1Å; L288-F290 HydrophobicContact CG-CE2 4.44Å; L288-F290 WeakPolarHBondContact O-CD2 3.5Å; L288-F290 PolarHBondContact O-N 3.47Å; F290-P292 VanDerWaalsContact C-CD 3.41Å; F290-P292 VanDerWaalsContact C-N 3.32Å; F290-P292 VanDerWaalsContact O-N 3.14Å; F290-K293 PolarHBondContact O-N 3.23Å; F290-I294 PolarHBondContact O-N 3.28Å
291	W	93.7	Very high	91.9	Very high	7 Å²	7	59 Å²	59	3%	0.027	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.6	-34.6	-177.8	-63.7	127.2	0	0	0	115.8	L272 T273 P274 T275 G276 I277 I294 H343 F346 R347	L272-W291 HydrophobicContact CD2-CH2 4.36Å; T273-W291 WeakPolarHBondContact O-CZ2 3.07Å; T273-W291 PolarHBondContact O-NE1 2.89Å; T273-W291 VanDerWaalsContact O-NE1 3.11Å; P274-W291 VanDerWaalsContact O-CD1 3.24Å; P274-W291 PolarHBondContact O-NE1 2.89Å; P274-W291 VanDerWaalsContact O-NE1 3.14Å; T275-W291 PolarHBondContact O-N 3.09Å; T275-W291 VanDerWaalsContact O-N 3.09Å; G276-W291 WeakPolarHBondContact O-CZ2 3.44Å; I277-W291 HydrophobicContact CD1-CH2 4.34Å; I277-W291 HydrophobicContact CD1-CZ3 4.02Å; I277-W291 HydrophobicContact CG1-CH2 3.64Å; I277-W291 HydrophobicContact CG1-CZ3 3.62Å; W291-I294 HydrophobicContact CE3-CD1 3.74Å; W291-I294 HydrophobicContact CZ3-CD1 3.97Å; W291-H343 HydrophobicContact CD2-CB 4.25Å; W291-H343 HydrophobicContact CE3-CB 3.74Å; W291-H343 AromaticContact CE3-CD2 3.85Å; W291-H343 HydrophobicContact CZ3-CB 3.98Å; W291-F346 AromaticContact NE1-CD2 3.88Å; W291-R347 HydrophobicContact CB-CB 4.43Å; W291-R347 PolarHBondContact O-NH1 2.82Å
292	P	90.4	Very high	91.9	Very high	78 Å²	78	57.4 Å²	57.4	51%	0.506	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-37.9	174.9	-25.2	37.1	0	0	0	114.2	F290 R347	F290-P292 VanDerWaalsContact C-CD 3.41Å; F290-P292 VanDerWaalsContact C-N 3.32Å; F290-P292 VanDerWaalsContact O-N 3.14Å; P292-R347 PolarHBondContact O-NH1 2.85Å
293	K	90.8	Very high	92.2	Very high	60 Å²	60	55.4 Å²	55.4	26%	0.261	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79	-16.1	-179	-73.8	-53.9	-146.6	172.2	0	113.4	F290 T295 V308 V309 D311	F290-K293 PolarHBondContact O-N 3.23Å; K293-T295 PolarHBondContact O-N 2.85Å; K293-V308 HydrophobicContact CB-CG1 4.03Å; K293-V308 WeakPolarHBondContact O-CA 3.47Å; K293-V309 WeakPolarHBondContact CB-O 3.41Å; K293-V309 WeakPolarHBondContact CD-O 3.4Å; K293-V309 WeakPolarHBondContact CG-O 3.3Å; K293-V309 PolarHBondContact O-N 3.42Å; K293-D311 WeakPolarHBondContact CE-OD2 3.35Å; K293-D311 IonicContact NZ-OD1 3.79Å; K293-D311 PolarHBondContact NZ-OD1 2.85Å; K293-D311 IonicContact NZ-OD2 3.91Å; K293-D311 PolarHBondContact NZ-OD2 2.99Å
294	I	92	Very high	92.6	Very high	2 Å²	2	50.8 Å²	50.8	1%	0.01	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	114	173	-63.9	172.4	0	0	0	109.8	I277 F289 F290 W291 L306 V308 R347 F667	I277-I294 HydrophobicContact CB-CD1 4.48Å; I277-I294 HydrophobicContact CD1-CD1 3.9Å; I277-I294 HydrophobicContact CG1-CD1 3.9Å; F289-I294 HydrophobicContact CB-CD1 4.05Å; F289-I294 HydrophobicContact CB-CG1 4.17Å; F289-I294 WeakPolarHBondContact O-CD1 3.44Å; F290-I294 PolarHBondContact O-N 3.28Å; W291-I294 HydrophobicContact CE3-CD1 3.74Å; W291-I294 HydrophobicContact CZ3-CD1 3.97Å; I294-L306 HydrophobicContact CB-CD1 4.48Å; I294-L306 HydrophobicContact CD1-CD1 4.09Å; I294-L306 HydrophobicContact CG1-CD1 4.04Å; I294-L306 HydrophobicContact CG2-CD1 3.68Å; I294-V308 HydrophobicContact CG1-CG2 4.3Å; I294-R347 PolarHBondContact O-NH1 3.37Å; I294-F667 HydrophobicContact CG2-CE2 4.33Å
295	T	90	Very high	92.8	Very high	14 Å²	14	47.1 Å²	47.1	9%	0.086	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	-30.8	-176.6	59.1	0	0	0	0	113.8	K293 M307 V309 F667	K293-T295 PolarHBondContact O-N 2.85Å; T295-M307 PolarHBondContact N-O 3.46Å; T295-V309 HydrophobicContact CG2-CB 4.19Å; T295-V309 HydrophobicContact CG2-CG2 3.53Å; T295-F667 VanDerWaalsContact O-CD2 3.22Å; T295-F667 WeakPolarHBondContact O-CD2 3.45Å; T295-F667 PolarHBondContact O-N 2.78Å; T295-F667 VanDerWaalsContact O-N 3.09Å
296	R	90.2	Very high	92.8	Very high	72 Å²	72	42.2 Å²	42.2	27%	0.272	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143	145.3	173.6	-52.3	-162.8	179.4	94.1	7.1	112.3	M307 E319 S666	R296-M307 HydrophobicContact CB-CB 4.05Å; R296-M307 HydrophobicContact CB-CE 4.19Å; R296-M307 HydrophobicContact CB-CG 4.15Å; R296-M307 HydrophobicContact CB-SD 3.85Å; R296-M307 HydrophobicContact CG-SD 3.89Å; R296-M307 PolarHBondContact N-O 2.83Å; R296-M307 PolarHBondContact NH1-SD 3.14Å; R296-M307 PolarHBondContact O-N 3.33Å; R296-E319 IonicContact NH1-OE1 2.99Å; R296-E319 IonicContact NH1-OE2 2.74Å; R296-S666 PolarHBondContact NE-OG 2.97Å
297	L	93.1	Very high	93	Very high	4 Å²	4	41.9 Å²	41.9	2%	0.021	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	115.4	168.3	-170.9	75	0	0	0	109.9	L304 T305 L306 W336 A339 V340 F667	L297-L304 HydrophobicContact CD1-CD1 4.15Å; L297-L304 HydrophobicContact CD1-CD2 4.26Å; L297-L304 HydrophobicContact CD1-CG 4.19Å; L297-L304 HydrophobicContact CG-CD1 4.38Å; L297-T305 WeakPolarHBondContact CA-O 3.48Å; L297-L306 HydrophobicContact CD1-CB 4.05Å; L297-L306 HydrophobicContact CD1-CD1 3.85Å; L297-W336 PolarHBondContact O-NE1 3.37Å; L297-A339 HydrophobicContact CD2-CB 3.34Å; L297-V340 HydrophobicContact CD2-CG2 4.28Å; L297-F667 HydrophobicContact CB-CE2 4.44Å
298	D	91.6	Very high	93	Very high	15 Å²	15	40.7 Å²	40.7	8%	0.08	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	165.4	-173.5	-92.1	-52.4	0	0	0	112.5	L304 T305 R663 Q664 F665	D298-L304 CarbonylContact O-C 3.53Å; D298-T305 PolarHBondContact N-O 2.98Å; D298-T305 PolarHBondContact O-N 3.22Å; D298-R663 VanDerWaalsContact OD1-C 3.29Å; D298-R663 VanDerWaalsContact OD1-O 3.05Å; D298-Q664 WeakPolarHBondContact OD1-CA 3.37Å; D298-Q664 PolarHBondContact OD1-N 3.43Å; D298-Q664 VanDerWaalsContact OD2-CA 3.3Å; D298-Q664 WeakPolarHBondContact OD2-CA 3.45Å; D298-F665 PolarHBondContact OD1-N 3.38Å; D298-F665 PolarHBondContact OD2-N 3.27Å; D298-F665 VanDerWaalsContact OD2-N 3.15Å
299	F	92.3	Very high	92.9	Very high	7 Å²	7	38.9 Å²	38.9	3%	0.031	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	143.8	174.8	87.8	-75.5	0	0	0	114.6	C303 L304 K333 W336 R663	F299-C303 CarbonylContact C-O 3.56Å; F299-C303 WeakPolarHBondContact CA-O 3.38Å; F299-L304 HydrophobicContact CB-CD1 4.31Å; F299-K333 HydrophobicContact CD2-CB 4.36Å; F299-K333 HydrophobicContact CE1-CG 4.29Å; F299-K333 HydrophobicContact CE2-CB 3.66Å; F299-K333 HydrophobicContact CE2-CG 4.04Å; F299-K333 HydrophobicContact CZ-CB 3.82Å; F299-K333 HydrophobicContact CZ-CD 4.08Å; F299-K333 HydrophobicContact CZ-CG 3.64Å; F299-W336 HydrophobicContact CB-CB 4.18Å; F299-W336 HydrophobicContact CB-CG 4.17Å; F299-W336 HydrophobicContact CD1-CB 4.02Å; F299-W336 AromaticContact CD1-CD1 4Å; F299-W336 AromaticContact CD1-CD2 3.47Å; F299-W336 HydrophobicContact CD1-CD2 3.47Å; F299-W336 VanDerWaalsContact CD1-CD2 3.47Å; F299-W336 AromaticContact CD1-CE2 3.98Å; F299-W336 AromaticContact CD1-CE3 3.78Å; F299-W336 HydrophobicContact CD1-CE3 3.78Å; F299-W336 AromaticContact CD1-CG 3.54Å; F299-W336 HydrophobicContact CD1-CG 3.54Å; F299-W336 AromaticContact CE1-CD2 3.81Å; F299-W336 HydrophobicContact CE1-CD2 3.81Å; F299-W336 AromaticContact CE1-CE3 3.6Å; F299-W336 HydrophobicContact CE1-CE3 3.6Å; F299-W336 HydrophobicContact CE1-CG 4.3Å; F299-W336 HydrophobicContact CE1-CZ3 4.02Å; F299-W336 HydrophobicContact CG-CB 4.21Å; F299-W336 HydrophobicContact CG-CD2 4.48Å; F299-W336 HydrophobicContact CG-CG 4.14Å; F299-R663 VanDerWaalsContact CE2-NH1 3.33Å; F299-R663 VanDerWaalsContact CZ-NH1 3.26Å
300	K	92.1	Very high	92.6	Very high	137 Å²	137	40.2 Å²	40.2	60%	0.596	20%	0.195	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-141.8	111.7	-173.6	-173.1	-179.7	178.3	-175.3	0	110	S302 C303	K300-S302 PolarHBondContact O-N 3.36Å; K300-C303 PolarHBondContact N-O 3.25Å; K300-C303 PolarHBondContact O-N 2.94Å
301	K	92.2	Very high	92.1	Very high	155 Å²	155	39.3 Å²	39.3	67%	0.674	20%	0.195	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.4	-112.9	-165.1	-59.1	-179.6	175.7	-175.5	0	110.5	S329	K301-S329 VanDerWaalsContact C-OG 3.31Å; K301-S329 WeakPolarHBondContact O-CB 3.43Å; K301-S329 PolarHBondContact O-OG 3.04Å
302	S	94.4	Very high	91.6	Very high	31 Å²	31	39.9 Å²	39.9	22%	0.217	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.8	1.1	179.3	45.2	0	0	0	0	113.3	K300 L326 C332	K300-S302 PolarHBondContact O-N 3.36Å; S302-L326 VanDerWaalsContact CB-O 3.32Å; S302-L326 WeakPolarHBondContact CB-O 3.28Å; S302-L326 PolarHBondContact O-N 2.87Å; S302-C332 PolarHBondContact O-SG 2.95Å
303	C	95	Very high	91.1	Very high	26 Å²	26	37.9 Å²	37.9	18%	0.176	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	124.1	175.7	-168.7	0	0	0	0	110.3	F299 K300 F324	F299-C303 CarbonylContact C-O 3.56Å; F299-C303 WeakPolarHBondContact CA-O 3.38Å; K300-C303 PolarHBondContact N-O 3.25Å; K300-C303 PolarHBondContact O-N 2.94Å; C303-F324 CarbonylContact C-O 3.53Å; C303-F324 WeakPolarHBondContact CA-O 3.4Å
304	L	96.3	Very high	90.7	Very high	3 Å²	3	39.3 Å²	39.3	2%	0.016	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82	152.3	162.2	-168.8	74	0	0	0	108.9	L270 L297 D298 F299 F324 L326 L335 W336	L270-L304 HydrophobicContact CD1-CD2 4.14Å; L297-L304 HydrophobicContact CD1-CD1 4.15Å; L297-L304 HydrophobicContact CD1-CD2 4.26Å; L297-L304 HydrophobicContact CD1-CG 4.19Å; L297-L304 HydrophobicContact CG-CD1 4.38Å; D298-L304 CarbonylContact O-C 3.53Å; F299-L304 HydrophobicContact CB-CD1 4.31Å; L304-F324 HydrophobicContact CB-CB 4.38Å; L304-F324 PolarHBondContact N-O 3.4Å; L304-F324 PolarHBondContact O-N 2.83Å; L304-F324 VanDerWaalsContact O-N 3.09Å; L304-L326 HydrophobicContact CB-CD1 4.32Å; L304-L335 HydrophobicContact CD2-CD2 3.83Å; L304-L335 HydrophobicContact CD2-CG 4.15Å; L304-W336 HydrophobicContact CD1-CB 3.83Å; L304-W336 HydrophobicContact CD1-CG 4.39Å
305	T	95.3	Very high	90.2	Very high	25 Å²	25	42 Å²	42	15%	0.153	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	124.2	172.7	-55.2	0	0	0	0	108.6	L297 D298 M307 T321 F322 M323	L297-T305 WeakPolarHBondContact CA-O 3.48Å; D298-T305 PolarHBondContact N-O 2.98Å; D298-T305 PolarHBondContact O-N 3.22Å; T305-M307 HydrophobicContact CG2-CE 4.13Å; T305-T321 HydrophobicContact CG2-CG2 3.9Å; T305-F322 WeakPolarHBondContact CA-O 3.06Å; T305-M323 HydrophobicContact CG2-CG 4.34Å
306	L	94.9	Very high	89.9	Confident	1 Å²	1	48 Å²	48	1%	0.005	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	128.6	-177.7	169.6	65.6	0	0	0	108.1	I277 F289 I294 L297 V308 F322 F324	I277-L306 HydrophobicContact CD1-CD1 4.07Å; I277-L306 HydrophobicContact CD1-CD2 4.31Å; F289-L306 HydrophobicContact CD2-CD2 3.69Å; F289-L306 HydrophobicContact CE2-CD2 4.02Å; F289-L306 HydrophobicContact CG-CD2 4.5Å; I294-L306 HydrophobicContact CB-CD1 4.48Å; I294-L306 HydrophobicContact CD1-CD1 4.09Å; I294-L306 HydrophobicContact CG1-CD1 4.04Å; I294-L306 HydrophobicContact CG2-CD1 3.68Å; L297-L306 HydrophobicContact CD1-CB 4.05Å; L297-L306 HydrophobicContact CD1-CD1 3.85Å; L306-V308 HydrophobicContact CD1-CG2 4.13Å; L306-V308 HydrophobicContact CD2-CG2 4.14Å; L306-V308 HydrophobicContact CG-CG2 3.86Å; L306-F322 HydrophobicContact CB-CB 4.4Å; L306-F322 HydrophobicContact CD2-CD2 4.45Å; L306-F322 PolarHBondContact N-O 2.93Å; L306-F322 PolarHBondContact O-N 3.32Å; L306-F324 HydrophobicContact CD2-CE2 4.36Å
307	M	93.7	Very high	89.8	Confident	32 Å²	32	51.2 Å²	51.2	16%	0.158	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	129.5	172.7	-58.1	175.8	-148.5	0	0	109.3	T295 R296 T305 H320 T321	T295-M307 PolarHBondContact N-O 3.46Å; R296-M307 HydrophobicContact CB-CB 4.05Å; R296-M307 HydrophobicContact CB-CE 4.19Å; R296-M307 HydrophobicContact CB-CG 4.15Å; R296-M307 HydrophobicContact CB-SD 3.85Å; R296-M307 HydrophobicContact CG-SD 3.89Å; R296-M307 PolarHBondContact N-O 2.83Å; R296-M307 PolarHBondContact NH1-SD 3.14Å; R296-M307 PolarHBondContact O-N 3.33Å; T305-M307 HydrophobicContact CG2-CE 4.13Å; M307-H320 WeakPolarHBondContact CA-O 3.02Å; M307-T321 HydrophobicContact CG-CG2 4.28Å
308	V	93.2	Very high	89.5	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	131.7	-177.6	-167.1	0	0	0	0	108.2	F289 K293 I294 L306 E310 H320 F322	F289-V308 HydrophobicContact CB-CG1 4.47Å; F289-V308 HydrophobicContact CB-CG2 4.21Å; F289-V308 HydrophobicContact CD1-CB 4.34Å; F289-V308 HydrophobicContact CD1-CG1 3.92Å; F289-V308 HydrophobicContact CD1-CG2 3.88Å; F289-V308 HydrophobicContact CD2-CG2 4.33Å; F289-V308 HydrophobicContact CE1-CG2 4.29Å; F289-V308 HydrophobicContact CG-CG1 4.46Å; F289-V308 HydrophobicContact CG-CG2 3.9Å; K293-V308 HydrophobicContact CB-CG1 4.03Å; K293-V308 WeakPolarHBondContact O-CA 3.47Å; I294-V308 HydrophobicContact CG1-CG2 4.3Å; L306-V308 HydrophobicContact CD1-CG2 4.13Å; L306-V308 HydrophobicContact CD2-CG2 4.14Å; L306-V308 HydrophobicContact CG-CG2 3.86Å; V308-E310 HydrophobicContact CG1-CG 4.19Å; V308-H320 PolarHBondContact N-O 2.91Å; V308-H320 PolarHBondContact O-N 3.26Å; V308-F322 HydrophobicContact CB-CE2 4.44Å; V308-F322 HydrophobicContact CG2-CD2 4.19Å; V308-F322 HydrophobicContact CG2-CE2 4.07Å
309	V	91.9	Very high	89.5	Confident	12 Å²	12	58.9 Å²	58.9	7%	0.073	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	120.2	166	167.1	0	0	0	0	108.5	K293 T295 E317 Q318 E319	K293-V309 WeakPolarHBondContact CB-O 3.41Å; K293-V309 WeakPolarHBondContact CD-O 3.4Å; K293-V309 WeakPolarHBondContact CG-O 3.3Å; K293-V309 PolarHBondContact O-N 3.42Å; T295-V309 HydrophobicContact CG2-CB 4.19Å; T295-V309 HydrophobicContact CG2-CG2 3.53Å; V309-E317 HydrophobicContact CG1-CB 3.59Å; V309-E317 HydrophobicContact CG1-CG 3.7Å; V309-Q318 WeakPolarHBondContact CA-O 3.37Å; V309-E319 HydrophobicContact CG2-CG 3.81Å
310	E	87.1	Confident	89.4	Confident	53 Å²	53	60.5 Å²	60.5	25%	0.248	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	154	164.2	-65.2	-166.1	-173.5	0	0	109.2	F289 V308 Q318 R760	F289-E310 WeakPolarHBondContact CE1-OE1 3.35Å; V308-E310 HydrophobicContact CG1-CG 4.19Å; E310-Q318 PolarHBondContact N-O 3.21Å; E310-Q318 VanDerWaalsContact N-O 3.09Å; E310-Q318 PolarHBondContact O-N 2.77Å; E310-R760 IonicContact OE2-NH2 3.62Å; E310-R760 PolarHBondContact OE2-NH2 3.35Å
311	D	85	Confident	89.5	Confident	92 Å²	92	56.7 Å²	56.7	49%	0.492	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	123.3	179.6	-51.3	-52.9	0	0	0	108.1	K293	K293-D311 WeakPolarHBondContact CE-OD2 3.35Å; K293-D311 IonicContact NZ-OD1 3.79Å; K293-D311 PolarHBondContact NZ-OD1 2.85Å; K293-D311 IonicContact NZ-OD2 3.91Å; K293-D311 PolarHBondContact NZ-OD2 2.99Å
312	D	82.8	Confident	89.5	Confident	18 Å²	18	49.6 Å²	49.6	10%	0.096	26%	0.259	C	S	.	.			trans	-69.6	172.1	178.1	81.5	7.5	0	0	0	112.5	Q314 G315 R316 Q318	D312-Q314 PolarHBondContact O-N 3.38Å; D312-Q314 WeakPolarHBondContact OD1-CA 3.46Å; D312-Q314 WeakPolarHBondContact OD1-CB 3.44Å; D312-Q314 PolarHBondContact OD1-N 3.35Å; D312-G315 WeakPolarHBondContact O-CA 3.36Å; D312-G315 PolarHBondContact O-N 2.98Å; D312-G315 PolarHBondContact OD1-N 3.11Å; D312-G315 VanDerWaalsContact OD1-N 3.08Å; D312-R316 PolarHBondContact N-O 2.88Å; D312-R316 WeakPolarHBondContact OD1-CB 3.5Å; D312-R316 PolarHBondContact OD1-N 3.33Å; D312-R316 IonicContact OD1-NE 3.26Å; D312-R316 IonicContact OD2-CZ 3.19Å; D312-R316 IonicContact OD2-NE 2.72Å; D312-R316 PolarHBondContact OD2-NE 3.17Å; D312-R316 IonicContact OD2-NH2 2.72Å; D312-R316 PolarHBondContact OD2-NH2 2.86Å; D312-Q318 HydrophobicContact CB-CG 4.09Å; D312-Q318 PolarHBondContact OD2-NE2 3.41Å
313	D	79.3	Confident	89.5	Confident	37 Å²	37	51.5 Å²	51.5	20%	0.198	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-5.9	-176.5	-58.3	-80.2	0	0	0	114.6	K589	D313-K589 HydrophobicContact CB-CB 3.52Å; D313-K589 HydrophobicContact CB-CD 3.78Å; D313-K589 HydrophobicContact CB-CG 3.51Å; D313-K589 VanDerWaalsContact CG-CB 3.46Å; D313-K589 WeakPolarHBondContact O-CE 3.33Å; D313-K589 PolarHBondContact O-NZ 2.79Å; D313-K589 WeakPolarHBondContact OD1-CA 3.17Å; D313-K589 WeakPolarHBondContact OD1-CB 3.29Å; D313-K589 PolarHBondContact OD1-N 3.39Å; D313-K589 WeakPolarHBondContact OD2-CA 3.45Å; D313-K589 PolarHBondContact OD2-N 3.24Å
314	Q	82.1	Confident	89.6	Confident	89 Å²	89	50.4 Å²	50.4	42%	0.416	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.2	2.3	168.1	-64.2	110.9	25	0	0	112.7	D312 R316	D312-Q314 PolarHBondContact O-N 3.38Å; D312-Q314 WeakPolarHBondContact OD1-CA 3.46Å; D312-Q314 WeakPolarHBondContact OD1-CB 3.44Å; D312-Q314 PolarHBondContact OD1-N 3.35Å; Q314-R316 HydrophobicContact CB-CG 4.44Å
315	G	81.7	Confident	89.6	Confident	60 Å²	60	55.8 Å²	55.8	62%	0.619	28%	0.283	S	S	*	.	S	Bend	trans	83.2	22.9	179.4	0	0	0	0	0	114.2	D312	D312-G315 WeakPolarHBondContact O-CA 3.36Å; D312-G315 PolarHBondContact O-N 2.98Å; D312-G315 PolarHBondContact OD1-N 3.11Å; D312-G315 VanDerWaalsContact OD1-N 3.08Å
316	R	84.6	Confident	89.5	Confident	139 Å²	139	55.1 Å²	55.1	53%	0.525	28%	0.278	S	S	.	.			trans	-103.8	134.5	-179.5	-49.9	175.2	-62	169.2	4.9	110.5	D312 Q314 Q318	D312-R316 PolarHBondContact N-O 2.88Å; D312-R316 WeakPolarHBondContact OD1-CB 3.5Å; D312-R316 PolarHBondContact OD1-N 3.33Å; D312-R316 IonicContact OD1-NE 3.26Å; D312-R316 IonicContact OD2-CZ 3.19Å; D312-R316 IonicContact OD2-NE 2.72Å; D312-R316 PolarHBondContact OD2-NE 3.17Å; D312-R316 IonicContact OD2-NH2 2.72Å; D312-R316 PolarHBondContact OD2-NH2 2.86Å; Q314-R316 HydrophobicContact CB-CG 4.44Å; R316-Q318 PolarHBondContact O-N 2.71Å
317	E	87.3	Confident	89.4	Confident	140 Å²	140	58.4 Å²	58.4	65%	0.654	31%	0.306	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.6	127.2	177.3	-68.3	-171	140.8	0	0	111.9	V309	V309-E317 HydrophobicContact CG1-CB 3.59Å; V309-E317 HydrophobicContact CG1-CG 3.7Å
318	Q	87.6	Confident	89.3	Confident	75 Å²	75	58.7 Å²	58.7	35%	0.35	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	131	173.4	-63.7	-167	21.5	0	0	111.1	V309 E310 D312 R316 H320	V309-Q318 WeakPolarHBondContact CA-O 3.37Å; E310-Q318 PolarHBondContact N-O 3.21Å; E310-Q318 VanDerWaalsContact N-O 3.09Å; E310-Q318 PolarHBondContact O-N 2.77Å; D312-Q318 HydrophobicContact CB-CG 4.09Å; D312-Q318 PolarHBondContact OD2-NE2 3.41Å; R316-Q318 PolarHBondContact O-N 2.71Å; Q318-H320 PolarHBondContact O-N 2.65Å
319	E	91.1	Very high	89.2	Confident	104 Å²	104	61.5 Å²	61.5	49%	0.486	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	106.5	175.5	-74.7	-162.1	144.7	0	0	111.7	R296 V309	R296-E319 IonicContact NH1-OE1 2.99Å; R296-E319 IonicContact NH1-OE2 2.74Å; V309-E319 HydrophobicContact CG2-CG 3.81Å
320	H	89.9	Confident	89.1	Confident	42 Å²	42	65.9 Å²	65.9	19%	0.194	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	130.6	169.5	-63	-78.4	0	0	0	111	M307 V308 Q318 F322 L768	M307-H320 WeakPolarHBondContact CA-O 3.02Å; V308-H320 PolarHBondContact N-O 2.91Å; V308-H320 PolarHBondContact O-N 3.26Å; Q318-H320 PolarHBondContact O-N 2.65Å; H320-F322 HydrophobicContact CB-CE2 3.71Å; H320-F322 HydrophobicContact CB-CZ 3.88Å; H320-L768 HydrophobicContact CB-CD2 4.38Å
321	T	93.7	Very high	89.2	Confident	56 Å²	56	65 Å²	65	34%	0.344	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	112.4	-179.3	-62.3	0	0	0	0	111.7	T305 M307	T305-T321 HydrophobicContact CG2-CG2 3.9Å; M307-T321 HydrophobicContact CG-CG2 4.28Å
322	F	93.4	Very high	89.6	Confident	6 Å²	6	60.6 Å²	60.6	3%	0.026	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	144	176.6	-54.3	-82.7	0	0	0	111.1	F289 T305 L306 V308 H320 F324 L764 L767 L768	F289-F322 AromaticContact CE1-CE2 3.85Å; F289-F322 HydrophobicContact CE1-CE2 3.85Å; F289-F322 HydrophobicContact CE1-CZ 4.06Å; F289-F322 HydrophobicContact CE2-CD2 4.2Å; F289-F322 HydrophobicContact CE2-CE2 4.1Å; F289-F322 HydrophobicContact CE2-CZ 4.48Å; F289-F322 AromaticContact CZ-CD2 3.99Å; F289-F322 HydrophobicContact CZ-CD2 3.99Å; F289-F322 HydrophobicContact CZ-CE1 4.19Å; F289-F322 AromaticContact CZ-CE2 3.44Å; F289-F322 HydrophobicContact CZ-CE2 3.44Å; F289-F322 VanDerWaalsContact CZ-CE2 3.44Å; F289-F322 AromaticContact CZ-CZ 3.56Å; F289-F322 HydrophobicContact CZ-CZ 3.56Å; T305-F322 WeakPolarHBondContact CA-O 3.06Å; L306-F322 HydrophobicContact CB-CB 4.4Å; L306-F322 HydrophobicContact CD2-CD2 4.45Å; L306-F322 PolarHBondContact N-O 2.93Å; L306-F322 PolarHBondContact O-N 3.32Å; V308-F322 HydrophobicContact CB-CE2 4.44Å; V308-F322 HydrophobicContact CG2-CD2 4.19Å; V308-F322 HydrophobicContact CG2-CE2 4.07Å; H320-F322 HydrophobicContact CB-CE2 3.71Å; H320-F322 HydrophobicContact CB-CZ 3.88Å; F322-F324 HydrophobicContact CB-CD2 4.46Å; F322-F324 HydrophobicContact CB-CE2 3.62Å; F322-F324 HydrophobicContact CB-CZ 3.86Å; F322-L764 HydrophobicContact CE1-CD2 4.34Å; F322-L764 HydrophobicContact CZ-CD2 4.37Å; F322-L767 HydrophobicContact CD1-CB 4.38Å; F322-L767 HydrophobicContact CD1-CD1 4.47Å; F322-L767 HydrophobicContact CE1-CB 4.42Å; F322-L767 HydrophobicContact CE1-CD1 4.44Å; F322-L768 HydrophobicContact CE1-CD2 4.29Å
323	M	94.6	Very high	90.1	Very high	71 Å²	71	63.5 Å²	63.5	35%	0.35	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	126.1	-178.8	-68.6	-176.2	65.6	0	0	110.7	T305	T305-M323 HydrophobicContact CG2-CG 4.34Å
324	F	95.9	Very high	90.5	Very high	3 Å²	3	63.7 Å²	63.7	1%	0.013	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	124.4	-173.6	-59.8	-72	0	0	0	111.4	V260 K261 L270 C303 L304 L306 F322	V260-F324 HydrophobicContact CB-CB 4.01Å; V260-F324 HydrophobicContact CG1-CB 4.43Å; V260-F324 HydrophobicContact CG2-CB 3.84Å; V260-F324 HydrophobicContact CG2-CD1 3.57Å; V260-F324 HydrophobicContact CG2-CE1 4.37Å; V260-F324 HydrophobicContact CG2-CG 3.92Å; K261-F324 CarbonylContact O-C 3.48Å; K261-F324 VanDerWaalsContact O-CA 3.31Å; K261-F324 WeakPolarHBondContact O-CA 3.23Å; L270-F324 HydrophobicContact CD1-CB 4.42Å; L270-F324 HydrophobicContact CD1-CD2 3.78Å; L270-F324 HydrophobicContact CD1-CE2 4.11Å; L270-F324 HydrophobicContact CD1-CG 4.01Å; L270-F324 HydrophobicContact CD2-CE1 4.36Å; L270-F324 HydrophobicContact CD2-CE2 4.2Å; L270-F324 HydrophobicContact CD2-CZ 4.06Å; C303-F324 CarbonylContact C-O 3.53Å; C303-F324 WeakPolarHBondContact CA-O 3.4Å; L304-F324 HydrophobicContact CB-CB 4.38Å; L304-F324 PolarHBondContact N-O 3.4Å; L304-F324 PolarHBondContact O-N 2.83Å; L304-F324 VanDerWaalsContact O-N 3.09Å; L306-F324 HydrophobicContact CD2-CE2 4.36Å; F322-F324 HydrophobicContact CB-CD2 4.46Å; F322-F324 HydrophobicContact CB-CE2 3.62Å; F322-F324 HydrophobicContact CB-CZ 3.86Å
325	Q	96.1	Very high	91.1	Very high	117 Å²	117	59.5 Å²	59.5	55%	0.547	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	132.9	177.5	179.3	167.5	-36.5	0	0	111.3	K261	K261-Q325 PolarHBondContact N-O 3.2Å; K261-Q325 PolarHBondContact O-N 3.35Å
326	L	94.4	Very high	91.7	Very high	10 Å²	10	57.1 Å²	57.1	5%	0.052	29%	0.289	C	S	.	.			trans	-109.6	162.3	172.4	-68.8	90.9	0	0	0	110.8	V260 S302 L304 S328 C332 L335	V260-L326 HydrophobicContact CB-CG 4.44Å; V260-L326 HydrophobicContact CG1-CD1 3.94Å; V260-L326 HydrophobicContact CG1-CD2 4.15Å; V260-L326 HydrophobicContact CG1-CG 3.84Å; S302-L326 VanDerWaalsContact CB-O 3.32Å; S302-L326 WeakPolarHBondContact CB-O 3.28Å; S302-L326 PolarHBondContact O-N 2.87Å; L304-L326 HydrophobicContact CB-CD1 4.32Å; L326-S328 PolarHBondContact O-N 3.05Å; L326-C332 HydrophobicContact CB-CB 4.24Å; L326-C332 HydrophobicContact CD1-CB 4.1Å; L326-L335 HydrophobicContact CD1-CD2 4.19Å; L326-L335 HydrophobicContact CD2-CB 4.38Å; L326-L335 HydrophobicContact CD2-CD2 3.91Å
327	A	91.3	Very high	92	Very high	70 Å²	70	52.2 Å²	52.2	58%	0.579	27%	0.271	S	S	*	.	S	Bend	trans	-59	-32.3	179.4	0	0	0	0	0	113.7
328	S	91.7	Very high	92.2	Very high	39 Å²	39	46 Å²	46	27%	0.273	24%	0.244	S	C	.	.			trans	-142.2	161.1	-177.9	88.4	0	0	0	0	114.3	L326 K330 S331 C332	L326-S328 PolarHBondContact O-N 3.05Å; S328-K330 VanDerWaalsContact C-N 3.3Å; S328-K330 WeakPolarHBondContact OG-CB 3.48Å; S328-K330 PolarHBondContact OG-N 3.24Å; S328-S331 PolarHBondContact OG-N 3.5Å; S328-S331 PolarHBondContact OG-OG 2.95Å; S328-C332 WeakPolarHBondContact O-CB 3.16Å; S328-C332 PolarHBondContact O-N 2.76Å
329	S	92.3	Very high	92.5	Very high	58 Å²	58	42.5 Å²	42.5	41%	0.406	23%	0.228	S	C	.	.	H	α-helix	trans	-73.4	-20.1	171.5	-160.3	0	0	0	0	113	K301 K333	K301-S329 VanDerWaalsContact C-OG 3.31Å; K301-S329 WeakPolarHBondContact O-CB 3.43Å; K301-S329 PolarHBondContact O-OG 3.04Å; S329-K333 WeakPolarHBondContact O-CB 3.34Å; S329-K333 PolarHBondContact O-N 2.73Å; S329-K333 VanDerWaalsContact O-N 3.15Å
330	K	89	Confident	92.6	Very high	104 Å²	104	37.7 Å²	37.7	45%	0.452	21%	0.205	S	C	.	.	H	α-helix	trans	-64.5	-55.7	168.9	174.7	-170.2	170.4	-167.5	0	108.9	D113 D115 S328 K333 H334	D113-K330 WeakPolarHBondContact OD2-CE 3.49Å; D113-K330 IonicContact OD2-NZ 3.23Å; D113-K330 PolarHBondContact OD2-NZ 3.01Å; D115-K330 IonicContact OD2-NZ 3.61Å; D115-K330 PolarHBondContact OD2-NZ 3.42Å; S328-K330 VanDerWaalsContact C-N 3.3Å; S328-K330 WeakPolarHBondContact OG-CB 3.48Å; S328-K330 PolarHBondContact OG-N 3.24Å; K330-K333 PolarHBondContact O-N 3.28Å; K330-H334 WeakPolarHBondContact O-CB 3.38Å; K330-H334 PolarHBondContact O-N 2.9Å
331	S	90	Very high	92.7	Very high	35 Å²	35	36.5 Å²	36.5	25%	0.245	20%	0.2	C	C	.	.	H	α-helix	trans	-62.4	-46.8	-179.8	-39.7	0	0	0	0	112	S328 K333 H334 L335	S328-S331 PolarHBondContact OG-N 3.5Å; S328-S331 PolarHBondContact OG-OG 2.95Å; S331-K333 VanDerWaalsContact C-N 3.35Å; S331-K333 PolarHBondContact O-N 3.45Å; S331-H334 WeakPolarHBondContact O-CB 3.34Å; S331-H334 PolarHBondContact O-N 3.17Å; S331-H334 VanDerWaalsContact O-N 3.08Å; S331-L335 PolarHBondContact O-N 3.46Å
332	C	93.7	Very high	92.6	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-60.4	-41.7	177.8	-175.9	0	0	0	0	112.6	S302 L326 S328 W336	S302-C332 PolarHBondContact O-SG 2.95Å; L326-C332 HydrophobicContact CB-CB 4.24Å; L326-C332 HydrophobicContact CD1-CB 4.1Å; S328-C332 WeakPolarHBondContact O-CB 3.16Å; S328-C332 PolarHBondContact O-N 2.76Å; C332-W336 VanDerWaalsContact O-CB 3.29Å; C332-W336 WeakPolarHBondContact O-CB 3.5Å; C332-W336 PolarHBondContact O-N 3.46Å
333	K	91.6	Very high	92.5	Very high	79 Å²	79	34.5 Å²	34.5	34%	0.343	19%	0.188	S	C	.	.	H	α-helix	trans	-68.4	-32.7	174	-175.5	-179.7	177.7	-169.9	0	112.6	F299 S329 K330 S331 K337	F299-K333 HydrophobicContact CD2-CB 4.36Å; F299-K333 HydrophobicContact CE1-CG 4.29Å; F299-K333 HydrophobicContact CE2-CB 3.66Å; F299-K333 HydrophobicContact CE2-CG 4.04Å; F299-K333 HydrophobicContact CZ-CB 3.82Å; F299-K333 HydrophobicContact CZ-CD 4.08Å; F299-K333 HydrophobicContact CZ-CG 3.64Å; S329-K333 WeakPolarHBondContact O-CB 3.34Å; S329-K333 PolarHBondContact O-N 2.73Å; S329-K333 VanDerWaalsContact O-N 3.15Å; K330-K333 PolarHBondContact O-N 3.28Å; S331-K333 VanDerWaalsContact C-N 3.35Å; S331-K333 PolarHBondContact O-N 3.45Å; K333-K337 WeakPolarHBondContact O-CB 3.42Å; K333-K337 WeakPolarHBondContact O-CG 3.42Å; K333-K337 PolarHBondContact O-N 3.39Å; K333-K337 VanDerWaalsContact O-N 3.08Å
334	H	89.4	Confident	92.2	Very high	41 Å²	41	31.3 Å²	31.3	19%	0.19	17%	0.173	C	C	.	.	H	α-helix	trans	-65.6	-57.4	175.5	176.3	112.3	0	0	0	110.3	H119 H258 K330 S331 W336 K337 C338	H119-H334 AromaticContact CE1-CE1 2.79Å; H119-H334 PolarHBondContact CE1-CE1 2.89Å; H119-H334 AromaticContact CE1-ND1 3.14Å; H119-H334 PolarHBondContact CE1-ND1 2.88Å; H119-H334 AromaticContact CE1-NE2 3.85Å; H119-H334 AromaticContact ND1-CE1 3.36Å; H119-H334 PolarHBondContact ND1-CE1 3.01Å; H119-H334 AromaticContact ND1-ND1 3.33Å; H119-H334 PolarHBondContact ND1-ND1 3.06Å; H119-H334 AromaticContact NE2-ND1 3.75Å; H258-H334 AromaticContact CE1-CD2 3.69Å; H258-H334 AromaticContact CE1-NE2 3.85Å; K330-H334 WeakPolarHBondContact O-CB 3.38Å; K330-H334 PolarHBondContact O-N 2.9Å; S331-H334 WeakPolarHBondContact O-CB 3.34Å; S331-H334 PolarHBondContact O-N 3.17Å; S331-H334 VanDerWaalsContact O-N 3.08Å; H334-W336 VanDerWaalsContact C-N 3.33Å; H334-W336 PolarHBondContact O-N 2.86Å; H334-K337 WeakPolarHBondContact O-CA 3.49Å; H334-K337 WeakPolarHBondContact O-CB 3.47Å; H334-K337 PolarHBondContact O-N 3.34Å; H334-C338 PolarHBondContact NE2-SG 3.23Å; H334-C338 PolarHBondContact O-N 2.79Å; H334-C338 PolarHBondContact O-SG 3.06Å; H334-C338 VanDerWaalsContact O-SG 3.41Å
335	L	93.1	Very high	91.9	Very high	1 Å²	1	31.2 Å²	31.2	1%	0.005	17%	0.173	C	C	.	.	H	α-helix	trans	-53.4	-48.5	176.5	168.4	55.8	0	0	0	111.6	H258 V260 L270 L272 L304 L326 S331 K337 C338 A339	H258-L335 HydrophobicContact CB-CD1 4.02Å; H258-L335 HydrophobicContact CB-CD2 3.94Å; H258-L335 HydrophobicContact CB-CG 4.43Å; V260-L335 HydrophobicContact CG1-CD2 4.09Å; L270-L335 HydrophobicContact CD1-CD2 4.29Å; L272-L335 HydrophobicContact CD1-CD1 4.1Å; L272-L335 HydrophobicContact CD2-CD1 3.99Å; L272-L335 HydrophobicContact CG-CD1 4.22Å; L304-L335 HydrophobicContact CD2-CD2 3.83Å; L304-L335 HydrophobicContact CD2-CG 4.15Å; L326-L335 HydrophobicContact CD1-CD2 4.19Å; L326-L335 HydrophobicContact CD2-CB 4.38Å; L326-L335 HydrophobicContact CD2-CD2 3.91Å; S331-L335 PolarHBondContact O-N 3.46Å; L335-K337 VanDerWaalsContact C-N 3.28Å; L335-K337 PolarHBondContact O-N 2.87Å; L335-C338 PolarHBondContact O-N 3.08Å; L335-A339 WeakPolarHBondContact O-CB 3.33Å; L335-A339 PolarHBondContact O-N 2.9Å
336	W	94.4	Very high	91.6	Very high	9 Å²	9	27.3 Å²	27.3	3%	0.034	15%	0.154	C	C	.	.	H	α-helix	trans	-57.2	-39.1	176.1	176	80.7	0	0	0	112.8	L297 F299 L304 C332 H334 V340 F368 F665	L297-W336 PolarHBondContact O-NE1 3.37Å; F299-W336 HydrophobicContact CB-CB 4.18Å; F299-W336 HydrophobicContact CB-CG 4.17Å; F299-W336 HydrophobicContact CD1-CB 4.02Å; F299-W336 AromaticContact CD1-CD1 4Å; F299-W336 AromaticContact CD1-CD2 3.47Å; F299-W336 HydrophobicContact CD1-CD2 3.47Å; F299-W336 VanDerWaalsContact CD1-CD2 3.47Å; F299-W336 AromaticContact CD1-CE2 3.98Å; F299-W336 AromaticContact CD1-CE3 3.78Å; F299-W336 HydrophobicContact CD1-CE3 3.78Å; F299-W336 AromaticContact CD1-CG 3.54Å; F299-W336 HydrophobicContact CD1-CG 3.54Å; F299-W336 AromaticContact CE1-CD2 3.81Å; F299-W336 HydrophobicContact CE1-CD2 3.81Å; F299-W336 AromaticContact CE1-CE3 3.6Å; F299-W336 HydrophobicContact CE1-CE3 3.6Å; F299-W336 HydrophobicContact CE1-CG 4.3Å; F299-W336 HydrophobicContact CE1-CZ3 4.02Å; F299-W336 HydrophobicContact CG-CB 4.21Å; F299-W336 HydrophobicContact CG-CD2 4.48Å; F299-W336 HydrophobicContact CG-CG 4.14Å; L304-W336 HydrophobicContact CD1-CB 3.83Å; L304-W336 HydrophobicContact CD1-CG 4.39Å; C332-W336 VanDerWaalsContact O-CB 3.29Å; C332-W336 WeakPolarHBondContact O-CB 3.5Å; C332-W336 PolarHBondContact O-N 3.46Å; H334-W336 VanDerWaalsContact C-N 3.33Å; H334-W336 PolarHBondContact O-N 2.86Å; W336-V340 HydrophobicContact CD2-CG2 4.37Å; W336-V340 HydrophobicContact CZ2-CG2 4.1Å; W336-V340 WeakPolarHBondContact O-CB 3.39Å; W336-V340 VanDerWaalsContact O-CG2 3.25Å; W336-V340 WeakPolarHBondContact O-CG2 3.26Å; W336-V340 PolarHBondContact O-N 3.45Å; W336-F368 HydrophobicContact CH2-CB 3.99Å; W336-F368 HydrophobicContact CZ3-CB 3.81Å; W336-F368 HydrophobicContact CZ3-CD1 4.47Å; W336-F665 HydrophobicContact CZ2-CD2 4.49Å
337	K	91.3	Very high	91.1	Very high	36 Å²	36	28.8 Å²	28.8	16%	0.157	16%	0.159	C	C	.	.	H	α-helix	trans	-66.6	-50.8	174.2	-80.3	-179.1	91.8	-66.2	0	111.7	K333 H334 L335 A339 V340 E341 F368	K333-K337 WeakPolarHBondContact O-CB 3.42Å; K333-K337 WeakPolarHBondContact O-CG 3.42Å; K333-K337 PolarHBondContact O-N 3.39Å; K333-K337 VanDerWaalsContact O-N 3.08Å; H334-K337 WeakPolarHBondContact O-CA 3.49Å; H334-K337 WeakPolarHBondContact O-CB 3.47Å; H334-K337 PolarHBondContact O-N 3.34Å; L335-K337 VanDerWaalsContact C-N 3.28Å; L335-K337 PolarHBondContact O-N 2.87Å; K337-A339 VanDerWaalsContact C-N 3.28Å; K337-A339 PolarHBondContact O-N 3.2Å; K337-V340 PolarHBondContact O-N 3.27Å; K337-E341 IonicContact NZ-OE1 3.75Å; K337-E341 PolarHBondContact NZ-OE1 3.02Å; K337-E341 WeakPolarHBondContact O-CB 3.44Å; K337-E341 VanDerWaalsContact O-CG 3.25Å; K337-E341 WeakPolarHBondContact O-CG 3.31Å; K337-E341 PolarHBondContact O-N 3.36Å; K337-F368 HydrophobicContact CD-CG 4.47Å; K337-F368 VanDerWaalsContact CE-CD2 3.43Å; K337-F368 HydrophobicContact CG-CD1 4.08Å; K337-F368 HydrophobicContact CG-CG 4.13Å; K337-F368 VanDerWaalsContact NZ-CE2 3.29Å
338	C	92.2	Very high	90.6	Very high	11 Å²	11	26.7 Å²	26.7	7%	0.074	14%	0.138	C	C	.	.	H	α-helix	trans	-58.5	-43	-178.1	-62.4	0	0	0	0	110.8	L272 H334 L335 E341 S342	L272-C338 HydrophobicContact CD1-CB 3.53Å; H334-C338 PolarHBondContact NE2-SG 3.23Å; H334-C338 PolarHBondContact O-N 2.79Å; H334-C338 PolarHBondContact O-SG 3.06Å; H334-C338 VanDerWaalsContact O-SG 3.41Å; L335-C338 PolarHBondContact O-N 3.08Å; C338-E341 PolarHBondContact O-N 3.43Å; C338-S342 PolarHBondContact O-N 3.48Å; C338-S342 PolarHBondContact O-OG 2.8Å
339	A	94.2	Very high	89.8	Confident	1 Å²	1	29.5 Å²	29.5	1%	0.008	14%	0.142	C	C	.	.	H	α-helix	trans	-67.6	-39.3	177.5	0	0	0	0	0	113.6	L272 L297 L335 K337 E341 H343	L272-A339 HydrophobicContact CD1-CB 4.07Å; L272-A339 HydrophobicContact CD2-CB 3.72Å; L297-A339 HydrophobicContact CD2-CB 3.34Å; L335-A339 WeakPolarHBondContact O-CB 3.33Å; L335-A339 PolarHBondContact O-N 2.9Å; K337-A339 VanDerWaalsContact C-N 3.28Å; K337-A339 PolarHBondContact O-N 3.2Å; A339-E341 VanDerWaalsContact C-N 3.35Å; A339-H343 VanDerWaalsContact O-CB 3.28Å; A339-H343 WeakPolarHBondContact O-CB 3.09Å; A339-H343 PolarHBondContact O-N 3.34Å
340	V	91.8	Very high	88.6	Confident	3 Å²	3	33 Å²	33	2%	0.018	15%	0.152	C	C	.	.	H	α-helix	trans	-67.4	-34.6	172.5	167.8	0	0	0	0	111.8	L297 W336 K337 A344 F368	L297-V340 HydrophobicContact CD2-CG2 4.28Å; W336-V340 HydrophobicContact CD2-CG2 4.37Å; W336-V340 HydrophobicContact CZ2-CG2 4.1Å; W336-V340 WeakPolarHBondContact O-CB 3.39Å; W336-V340 VanDerWaalsContact O-CG2 3.25Å; W336-V340 WeakPolarHBondContact O-CG2 3.26Å; W336-V340 PolarHBondContact O-N 3.45Å; K337-V340 PolarHBondContact O-N 3.27Å; V340-A344 WeakPolarHBondContact O-CB 3.48Å; V340-A344 PolarHBondContact O-N 3.45Å; V340-A344 VanDerWaalsContact O-N 3.11Å; V340-F368 HydrophobicContact CG1-CD1 4.21Å; V340-F368 HydrophobicContact CG1-CE1 4.25Å
341	E	92.1	Very high	87.4	Confident	17 Å²	17	29.5 Å²	29.5	8%	0.079	14%	0.14	C	C	.	.	H	α-helix	trans	-67.2	-46	174.6	-70.7	174.1	-167.9	0	0	111.2	K144 F145 K337 C338 A339 A344 F345 F368 F370	K144-E341 WeakPolarHBondContact CE-OE2 3.38Å; K144-E341 IonicContact NZ-OE2 3.71Å; K144-E341 PolarHBondContact NZ-OE2 3.08Å; F145-E341 HydrophobicContact CE1-CB 4.37Å; F145-E341 HydrophobicContact CZ-CB 4.15Å; K337-E341 IonicContact NZ-OE1 3.75Å; K337-E341 PolarHBondContact NZ-OE1 3.02Å; K337-E341 WeakPolarHBondContact O-CB 3.44Å; K337-E341 VanDerWaalsContact O-CG 3.25Å; K337-E341 WeakPolarHBondContact O-CG 3.31Å; K337-E341 PolarHBondContact O-N 3.36Å; C338-E341 PolarHBondContact O-N 3.43Å; A339-E341 VanDerWaalsContact C-N 3.35Å; E341-A344 PolarHBondContact O-N 2.85Å; E341-F345 WeakPolarHBondContact O-CB 3.47Å; E341-F345 PolarHBondContact O-N 2.91Å; E341-F368 HydrophobicContact CG-CE1 3.5Å; E341-F368 VanDerWaalsContact CG-CE1 3.5Å; E341-F368 HydrophobicContact CG-CZ 3.49Å; E341-F368 VanDerWaalsContact CG-CZ 3.49Å; E341-F368 WeakPolarHBondContact OE1-CZ 3.49Å; E341-F370 HydrophobicContact CB-CD2 4.21Å; E341-F370 HydrophobicContact CG-CD2 4.22Å
342	S	92	Very high	86	Confident	15 Å²	15	29.5 Å²	29.5	11%	0.105	14%	0.139	C	C	.	.	H	α-helix	trans	-65.6	-48.7	176.9	-61.7	0	0	0	0	112.7	C338 A344 F345 F346	C338-S342 PolarHBondContact O-N 3.48Å; C338-S342 PolarHBondContact O-OG 2.8Å; S342-A344 VanDerWaalsContact C-N 3.29Å; S342-A344 PolarHBondContact O-N 2.88Å; S342-F345 PolarHBondContact O-N 2.85Å; S342-F345 VanDerWaalsContact O-N 3.13Å; S342-F346 WeakPolarHBondContact O-CD2 3.26Å; S342-F346 PolarHBondContact O-N 2.84Å
343	H	90.8	Very high	84	Confident	4 Å²	4	33 Å²	33	2%	0.019	17%	0.168	C	C	.	.	H	α-helix	trans	-54.1	-47.5	175.3	176.1	-77.3	0	0	0	111.2	W291 A339 F345 R347 F667	W291-H343 HydrophobicContact CD2-CB 4.25Å; W291-H343 HydrophobicContact CE3-CB 3.74Å; W291-H343 AromaticContact CE3-CD2 3.85Å; W291-H343 HydrophobicContact CZ3-CB 3.98Å; A339-H343 VanDerWaalsContact O-CB 3.28Å; A339-H343 WeakPolarHBondContact O-CB 3.09Å; A339-H343 PolarHBondContact O-N 3.34Å; H343-F345 PolarHBondContact O-N 3.06Å; H343-R347 PolarHBondContact NE2-NH1 3.3Å; H343-R347 WeakPolarHBondContact O-CB 3.33Å; H343-R347 PolarHBondContact O-N 3.35Å; H343-F667 AromaticContact CD2-CE2 3.8Å; H343-F667 AromaticContact CD2-CZ 3.97Å; H343-F667 AromaticContact CE1-CD1 3.32Å; H343-F667 WeakPolarHBondContact CE1-CD1 3.47Å; H343-F667 AromaticContact CE1-CD2 3.59Å; H343-F667 AromaticContact CE1-CE1 3.36Å; H343-F667 WeakPolarHBondContact CE1-CE1 3.48Å; H343-F667 AromaticContact CE1-CE2 3.65Å; H343-F667 AromaticContact CE1-CG 3.44Å; H343-F667 VanDerWaalsContact CE1-CG 3.44Å; H343-F667 WeakPolarHBondContact CE1-CG 3.37Å; H343-F667 AromaticContact CE1-CZ 3.54Å; H343-F667 AromaticContact CG-CZ 3.9Å; H343-F667 AromaticContact ND1-CD1 3.9Å; H343-F667 AromaticContact ND1-CE1 3.49Å; H343-F667 WeakPolarHBondContact ND1-CE1 3.39Å; H343-F667 AromaticContact ND1-CZ 3.63Å; H343-F667 AromaticContact NE2-CD2 3.38Å; H343-F667 WeakPolarHBondContact NE2-CD2 3.49Å; H343-F667 AromaticContact NE2-CE2 3.42Å; H343-F667 WeakPolarHBondContact NE2-CE2 3.22Å; H343-F667 AromaticContact NE2-CG 3.7Å; H343-F667 AromaticContact NE2-CZ 3.75Å
344	A	89.6	Confident	82	Confident	5 Å²	5	31.8 Å²	31.8	4%	0.041	18%	0.178	C	C	.	.	H	α-helix	trans	-66.7	-34.8	178.8	0	0	0	0	0	113.5	V340 E341 S342 L348 F370 T374	V340-A344 WeakPolarHBondContact O-CB 3.48Å; V340-A344 PolarHBondContact O-N 3.45Å; V340-A344 VanDerWaalsContact O-N 3.11Å; E341-A344 PolarHBondContact O-N 2.85Å; S342-A344 VanDerWaalsContact C-N 3.29Å; S342-A344 PolarHBondContact O-N 2.88Å; A344-L348 HydrophobicContact CB-CD1 3.94Å; A344-L348 WeakPolarHBondContact O-CB 3.29Å; A344-F370 HydrophobicContact CB-CB 3.37Å; A344-F370 HydrophobicContact CB-CD1 3.85Å; A344-F370 HydrophobicContact CB-CD2 4.48Å; A344-F370 HydrophobicContact CB-CG 3.66Å; A344-T374 WeakPolarHBondContact O-CG2 3.41Å
345	F	89.8	Confident	79.8	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-70.9	-46.8	178.3	-177.2	-95.2	0	0	0	112.5	D105 Y106 F145 E341 S342 H343 F370 K373 T374 E375	D105-F345 HydrophobicContact CB-CE2 4.24Å; Y106-F345 AromaticContact CD1-CE1 3.95Å; Y106-F345 HydrophobicContact CD1-CE1 3.95Å; Y106-F345 AromaticContact CD1-CZ 3.58Å; Y106-F345 HydrophobicContact CD1-CZ 3.58Å; Y106-F345 AromaticContact CE1-CE1 3.95Å; Y106-F345 HydrophobicContact CE1-CE1 3.95Å; Y106-F345 AromaticContact CE1-CZ 3.68Å; Y106-F345 HydrophobicContact CE1-CZ 3.68Å; Y106-F345 HydrophobicContact CG-CZ 4.36Å; F145-F345 HydrophobicContact CB-CD1 3.57Å; F145-F345 HydrophobicContact CB-CE1 3.41Å; F145-F345 VanDerWaalsContact CB-CE1 3.41Å; F145-F345 HydrophobicContact CB-CE2 4.45Å; F145-F345 HydrophobicContact CB-CG 4.17Å; F145-F345 HydrophobicContact CB-CZ 3.9Å; F145-F345 HydrophobicContact CD1-CB 4.13Å; F145-F345 HydrophobicContact CD1-CD1 4.06Å; F145-F345 HydrophobicContact CD1-CG 4.06Å; F145-F345 HydrophobicContact CD2-CB 4.32Å; F145-F345 AromaticContact CD2-CD1 3.98Å; F145-F345 HydrophobicContact CD2-CD1 3.98Å; F145-F345 AromaticContact CD2-CD2 3.55Å; F145-F345 HydrophobicContact CD2-CD2 3.55Å; F145-F345 HydrophobicContact CD2-CE1 4.17Å; F145-F345 AromaticContact CD2-CE2 3.76Å; F145-F345 HydrophobicContact CD2-CE2 3.76Å; F145-F345 AromaticContact CD2-CG 3.67Å; F145-F345 HydrophobicContact CD2-CG 3.67Å; F145-F345 HydrophobicContact CD2-CZ 4.07Å; F145-F345 HydrophobicContact CE1-CB 4.05Å; F145-F345 HydrophobicContact CE1-CG 4.36Å; F145-F345 HydrophobicContact CE2-CB 4.23Å; F145-F345 AromaticContact CE2-CD2 3.8Å; F145-F345 HydrophobicContact CE2-CD2 3.8Å; F145-F345 HydrophobicContact CE2-CE2 4.35Å; F145-F345 AromaticContact CE2-CG 3.99Å; F145-F345 HydrophobicContact CE2-CG 3.99Å; F145-F345 HydrophobicContact CG-CB 4.27Å; F145-F345 AromaticContact CG-CD1 3.61Å; F145-F345 HydrophobicContact CG-CD1 3.61Å; F145-F345 HydrophobicContact CG-CD2 4.06Å; F145-F345 AromaticContact CG-CE1 3.9Å; F145-F345 HydrophobicContact CG-CE1 3.9Å; F145-F345 HydrophobicContact CG-CE2 4.32Å; F145-F345 AromaticContact CG-CG 3.7Å; F145-F345 HydrophobicContact CG-CG 3.7Å; F145-F345 HydrophobicContact CG-CZ 4.25Å; F145-F345 HydrophobicContact CZ-CB 4.08Å; F145-F345 HydrophobicContact CZ-CD2 4.49Å; F145-F345 HydrophobicContact CZ-CG 4.32Å; E341-F345 WeakPolarHBondContact O-CB 3.47Å; E341-F345 PolarHBondContact O-N 2.91Å; S342-F345 PolarHBondContact O-N 2.85Å; S342-F345 VanDerWaalsContact O-N 3.13Å; H343-F345 PolarHBondContact O-N 3.06Å; F345-F370 HydrophobicContact CB-CZ 4.3Å; F345-F370 HydrophobicContact CD2-CZ 4.01Å; F345-K373 WeakPolarHBondContact CD2-O 3.24Å; F345-T374 WeakPolarHBondContact O-CB 3.44Å; F345-E375 HydrophobicContact CD1-CB 4.08Å; F345-E375 HydrophobicContact CE1-CB 3.63Å; F345-E375 HydrophobicContact CE1-CG 4.18Å; F345-E375 HydrophobicContact CZ-CB 3.93Å; F345-E375 HydrophobicContact CZ-CG 4.48Å; F345-E375 PolarHBondContact O-N 2.81Å
346	F	88.2	Confident	77.5	Confident	35 Å²	35	43.1 Å²	43.1	15%	0.154	24%	0.242	C	C	.	.	H	α-helix	trans	-87.4	-32.2	-173.4	-65.8	-66.9	0	0	0	114.3	F145 Y146 P274 W291 S342 E375	F145-F346 HydrophobicContact CB-CE1 4.47Å; F145-F346 HydrophobicContact CB-CE2 4.32Å; F145-F346 HydrophobicContact CB-CZ 3.76Å; F145-F346 HydrophobicContact CD1-CE2 4.04Å; F145-F346 HydrophobicContact CD1-CZ 4.34Å; F145-F346 HydrophobicContact CG-CZ 4.47Å; Y146-F346 VanDerWaalsContact O-CE1 3.25Å; Y146-F346 WeakPolarHBondContact O-CE1 2.88Å; Y146-F346 VanDerWaalsContact O-CZ 3.23Å; Y146-F346 WeakPolarHBondContact O-CZ 3.5Å; P274-F346 HydrophobicContact CB-CD1 4.34Å; P274-F346 HydrophobicContact CB-CE1 3.84Å; P274-F346 HydrophobicContact CB-CE2 4.33Å; P274-F346 HydrophobicContact CB-CZ 3.84Å; P274-F346 HydrophobicContact CG-CZ 4.28Å; P274-F346 VanDerWaalsContact O-CG 3.31Å; P274-F346 WeakPolarHBondContact O-CG 3.28Å; W291-F346 AromaticContact NE1-CD2 3.88Å; S342-F346 WeakPolarHBondContact O-CD2 3.26Å; S342-F346 PolarHBondContact O-N 2.84Å; F346-E375 WeakPolarHBondContact CD1-OE2 3.36Å
347	R	84.5	Confident	75	Confident	42 Å²	42	46 Å²	46	16%	0.158	26%	0.263	C	S	.	.	H	α-helix	trans	-88.6	-41.6	-176.8	-174.1	177.8	169.9	166.4	-6.8	113.6	W291 P292 I294 H343	W291-R347 HydrophobicContact CB-CB 4.43Å; W291-R347 PolarHBondContact O-NH1 2.82Å; P292-R347 PolarHBondContact O-NH1 2.85Å; I294-R347 PolarHBondContact O-NH1 3.37Å; H343-R347 PolarHBondContact NE2-NH1 3.3Å; H343-R347 WeakPolarHBondContact O-CB 3.33Å; H343-R347 PolarHBondContact O-N 3.35Å
348	L	80.6	Confident	72.8	Confident	25 Å²	25	56.3 Å²	56.3	13%	0.131	30%	0.301	C	S	.	.			trans	-88.3	136.6	-163.5	-53.7	176.1	0	0	0	112.6	A344 Q350 T352 T374	A344-L348 HydrophobicContact CB-CD1 3.94Å; A344-L348 WeakPolarHBondContact O-CB 3.29Å; L348-Q350 VanDerWaalsContact CB-O 3.29Å; L348-Q350 WeakPolarHBondContact CB-O 3.5Å; L348-Q350 PolarHBondContact O-N 2.97Å; L348-T352 HydrophobicContact CD1-CG2 3.57Å; L348-T374 HydrophobicContact CB-CG2 4.24Å; L348-T374 WeakPolarHBondContact O-CB 3.12Å; L348-T374 WeakPolarHBondContact O-CG2 3.5Å; L348-T374 PolarHBondContact O-OG1 3.41Å
349	R	74.5	Confident	70.7	Confident	98 Å²	98	59.5 Å²	59.5	37%	0.37	32%	0.324	S	S	.	.	S	Bend	trans	-67.7	-24	171.3	-68.5	-177.5	178.7	172.5	0.5	113.5	Y376 Q377	R349-Y376 HydrophobicContact CB-CD1 3.87Å; R349-Y376 HydrophobicContact CB-CE1 4.22Å; R349-Y376 HydrophobicContact CB-CG 4.23Å; R349-Y376 HydrophobicContact CG-CD1 4.09Å; R349-Y376 HydrophobicContact CG-CD2 4.26Å; R349-Y376 HydrophobicContact CG-CE1 4.31Å; R349-Y376 HydrophobicContact CG-CE2 4.47Å; R349-Y376 HydrophobicContact CG-CG 4.07Å; R349-Y376 WeakPolarHBondContact O-CD1 3.13Å; R349-Q377 WeakPolarHBondContact O-CG 3.44Å
350	Q	67.6	Low	68.5	Low	132 Å²	132	61.7 Å²	61.7	62%	0.617	34%	0.335	S	S	*	.	S	Bend	trans	-146.9	151.9	173.2	-56	-170.5	22.1	0	0	109.8	L348 T352	L348-Q350 VanDerWaalsContact CB-O 3.29Å; L348-Q350 WeakPolarHBondContact CB-O 3.5Å; L348-Q350 PolarHBondContact O-N 2.97Å; Q350-T352 PolarHBondContact O-N 2.94Å
351	P	64.6	Low	66.3	Low	30 Å²	30	71.1 Å²	71.1	20%	0.195	38%	0.376	C	S	.	.	S	Bend	trans	-60.5	134.4	174.6	-19.5	32.1	0	0	0	110	A353 F370 G372 T374 Q377	P351-A353 WeakPolarHBondContact O-CA 3.09Å; P351-A353 PolarHBondContact O-N 2.76Å; P351-F370 HydrophobicContact CB-CD1 4.12Å; P351-F370 HydrophobicContact CG-CD1 4.37Å; P351-F370 HydrophobicContact CG-CE1 4.42Å; P351-G372 WeakPolarHBondContact CG-O 3.36Å; P351-T374 HydrophobicContact CG-CG2 4.04Å; P351-Q377 VanDerWaalsContact CD-OE1 3.31Å
352	T	60.7	Low	63.9	Low	36 Å²	36	75.6 Å²	75.6	22%	0.221	41%	0.405	C	S	.	.			trans	-43.1	104.4	-171	56.6	0	0	0	0	112.2	L348 Q350 G354	L348-T352 HydrophobicContact CD1-CG2 3.57Å; Q350-T352 PolarHBondContact O-N 2.94Å; T352-G354 PolarHBondContact O-N 3.38Å
353	A	50.8	Low	61.7	Low	74 Å²	74	83.2 Å²	83.2	61%	0.612	43%	0.432	S	S	*	.			trans	-64.1	111.4	-165.3	0	0	0	0	0	110.2	P351 K355	P351-A353 WeakPolarHBondContact O-CA 3.09Å; P351-A353 PolarHBondContact O-N 2.76Å; A353-K355 PolarHBondContact O-N 2.92Å
354	G	49.8	Very low	59.3	Low	53 Å²	53	90.5 Å²	90.5	55%	0.546	47%	0.47	S	S	.	.			trans	-70.4	75.4	-178.5	0	0	0	0	0	112.5	T352 A356	T352-G354 PolarHBondContact O-N 3.38Å; G354-A356 PolarHBondContact O-N 2.96Å
355	K	43	Very low	57.3	Low	196 Å²	196	92.1 Å²	92.1	85%	0.852	49%	0.487	S	S	*	.			trans	-56.3	91.6	156.1	-74.1	177.3	-178	166	0	106.9	A353 S357	A353-K355 PolarHBondContact O-N 2.92Å; K355-S357 PolarHBondContact O-N 2.92Å
356	A	45.2	Very low	55.2	Low	83 Å²	83	94.7 Å²	94.7	69%	0.686	51%	0.505	S	S	*	.			trans	-72.3	79.8	-175	0	0	0	0	0	109.2	G354 R358	G354-A356 PolarHBondContact O-N 2.96Å; A356-R358 PolarHBondContact O-N 3.4Å
357	S	41.9	Very low	53.8	Low	69 Å²	69	98.6 Å²	98.6	48%	0.483	52%	0.519	S	S	.	.			trans	-54.4	128.7	176.1	-179.8	0	0	0	0	108.8	K355 S359 D360	K355-S357 PolarHBondContact O-N 2.92Å; S357-S359 PolarHBondContact O-N 2.88Å; S357-S359 PolarHBondContact OG-OG 3.29Å; S357-D360 PolarHBondContact O-N 2.93Å; S357-D360 VanDerWaalsContact O-N 3.11Å
358	R	45.9	Very low	53	Low	253 Å²	253	98.2 Å²	98.2	96%	0.955	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	7.2	-172.7	-60	175.5	72.4	147.1	-0.2	113.6	A356	A356-R358 PolarHBondContact O-N 3.4Å
359	S	48.1	Very low	52.6	Low	78 Å²	78	101.3 Å²	101.3	55%	0.545	53%	0.529	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.2	-5.8	177	60.6	0	0	0	0	114.5	S357 F361	S357-S359 PolarHBondContact O-N 2.88Å; S357-S359 PolarHBondContact OG-OG 3.29Å; S359-F361 PolarHBondContact O-N 3.37Å
360	D	47.5	Very low	52.7	Low	48 Å²	48	97.7 Å²	97.7	26%	0.257	52%	0.515	S	S	.	.	G	3₁₀ helix	trans	-67.7	-7.8	-172.7	-88.9	-24.1	0	0	0	115.5	S357 T362 R367	S357-D360 PolarHBondContact O-N 2.93Å; S357-D360 VanDerWaalsContact O-N 3.11Å; D360-T362 VanDerWaalsContact C-N 3.27Å; D360-T362 PolarHBondContact O-N 2.77Å; D360-R367 VanDerWaalsContact CG-CZ 3.47Å; D360-R367 VanDerWaalsContact CG-NH2 3.26Å; D360-R367 IonicContact OD1-CZ 3.71Å; D360-R367 IonicContact OD1-NH1 3.39Å; D360-R367 PolarHBondContact OD1-NH1 2.94Å; D360-R367 IonicContact OD1-NH2 2.7Å; D360-R367 PolarHBondContact OD1-NH2 3.13Å; D360-R367 IonicContact OD2-CZ 2.66Å; D360-R367 VanDerWaalsContact OD2-CZ 3.23Å; D360-R367 IonicContact OD2-NH1 2.61Å; D360-R367 PolarHBondContact OD2-NH1 3.45Å; D360-R367 IonicContact OD2-NH2 3.69Å; D360-R367 PolarHBondContact OD2-NH2 3.17Å
361	F	46.1	Very low	52.5	Low	200 Å²	200	96.7 Å²	96.7	88%	0.877	52%	0.523	S	S	*	.	G	3₁₀ helix	trans	-63.6	-20.3	-174.3	-171.9	-108.7	0	0	0	115.3	S359	S359-F361 PolarHBondContact O-N 3.37Å
362	T	41.7	Very low	53.1	Low	112 Å²	112	96.5 Å²	96.5	69%	0.687	53%	0.527	S	S	*	.	G	3₁₀ helix	trans	-104.6	-4.8	-169.9	57.3	0	0	0	0	115.3	D360 L364	D360-T362 VanDerWaalsContact C-N 3.27Å; D360-T362 PolarHBondContact O-N 2.77Å; T362-L364 PolarHBondContact O-N 2.99Å
363	R	45.3	Very low	54.1	Low	175 Å²	175	99 Å²	99	66%	0.66	53%	0.534	S	S	*	.			trans	-89.8	91.3	-176.8	-68.7	-170.1	-179.9	-151	3.7	112	G365	R363-G365 VanDerWaalsContact C-N 3.29Å; R363-G365 PolarHBondContact O-N 2.72Å
364	L	40.4	Very low	55.7	Low	156 Å²	156	95.4 Å²	95.4	82%	0.817	51%	0.505	S	S	*	.			trans	-64.1	84.2	169.5	-92.4	69	0	0	0	111.4	T362 L661	T362-L364 PolarHBondContact O-N 2.99Å; L364-L661 WeakPolarHBondContact O-CD2 3.23Å
365	G	46.6	Very low	57.4	Low	40 Å²	40	93.7 Å²	93.7	41%	0.412	48%	0.483	S	S	.	.	S	Bend	trans	-166	146.7	-179.9	0	0	0	0	0	113.1	R363 R367	R363-G365 VanDerWaalsContact C-N 3.29Å; R363-G365 PolarHBondContact O-N 2.72Å; G365-R367 VanDerWaalsContact C-N 3.26Å; G365-R367 PolarHBondContact O-N 3.44Å
366	S	46.5	Very low	59.3	Low	54 Å²	54	89.4 Å²	89.4	38%	0.378	46%	0.462	S	S	.	.			trans	-71.4	76.2	175.6	179.8	0	0	0	0	110.7	F368	S366-F368 PolarHBondContact O-N 2.98Å
367	R	59.3	Low	61.1	Low	117 Å²	117	87.9 Å²	87.9	44%	0.442	44%	0.441	S	S	.	.			trans	-69.4	66.7	168.1	-68.3	173.2	77	-143.4	26.1	109.7	D360 G365	D360-R367 VanDerWaalsContact CG-CZ 3.47Å; D360-R367 VanDerWaalsContact CG-NH2 3.26Å; D360-R367 IonicContact OD1-CZ 3.71Å; D360-R367 IonicContact OD1-NH1 3.39Å; D360-R367 PolarHBondContact OD1-NH1 2.94Å; D360-R367 IonicContact OD1-NH2 2.7Å; D360-R367 PolarHBondContact OD1-NH2 3.13Å; D360-R367 IonicContact OD2-CZ 2.66Å; D360-R367 VanDerWaalsContact OD2-CZ 3.23Å; D360-R367 IonicContact OD2-NH1 2.61Å; D360-R367 PolarHBondContact OD2-NH1 3.45Å; D360-R367 IonicContact OD2-NH2 3.69Å; D360-R367 PolarHBondContact OD2-NH2 3.17Å; G365-R367 VanDerWaalsContact C-N 3.26Å; G365-R367 PolarHBondContact O-N 3.44Å
368	F	66.3	Low	62.9	Low	33 Å²	33	85.3 Å²	85.3	15%	0.145	42%	0.424	C	S	.	.			trans	-62.5	137.7	169.8	178.9	-98.3	0	0	0	108.7	W336 K337 V340 E341 S366	W336-F368 HydrophobicContact CH2-CB 3.99Å; W336-F368 HydrophobicContact CZ3-CB 3.81Å; W336-F368 HydrophobicContact CZ3-CD1 4.47Å; K337-F368 HydrophobicContact CD-CG 4.47Å; K337-F368 VanDerWaalsContact CE-CD2 3.43Å; K337-F368 HydrophobicContact CG-CD1 4.08Å; K337-F368 HydrophobicContact CG-CG 4.13Å; K337-F368 VanDerWaalsContact NZ-CE2 3.29Å; V340-F368 HydrophobicContact CG1-CD1 4.21Å; V340-F368 HydrophobicContact CG1-CE1 4.25Å; E341-F368 HydrophobicContact CG-CE1 3.5Å; E341-F368 VanDerWaalsContact CG-CE1 3.5Å; E341-F368 HydrophobicContact CG-CZ 3.49Å; E341-F368 VanDerWaalsContact CG-CZ 3.49Å; E341-F368 WeakPolarHBondContact OE1-CZ 3.49Å; S366-F368 PolarHBondContact O-N 2.98Å
369	R	72.6	Confident	64.6	Low	91 Å²	91	73.8 Å²	73.8	34%	0.343	38%	0.381	S	S	.	.			trans	-141.3	144.5	175.8	-73.5	-175.5	165.5	-169.7	-9.8	106.9	F665	R369-F665 HydrophobicContact CG-CE2 4.15Å; R369-F665 HydrophobicContact CG-CZ 4.38Å
370	F	76.2	Confident	65.8	Low	21 Å²	21	75.8 Å²	75.8	9%	0.092	38%	0.382	C	S	.	.			trans	-63.7	138.6	171.1	-177.1	-107.7	0	0	0	110.2	F145 E341 A344 F345 P351 G372 K373 T374	F145-F370 HydrophobicContact CE2-CE2 4.16Å; F145-F370 HydrophobicContact CZ-CE2 4.06Å; E341-F370 HydrophobicContact CB-CD2 4.21Å; E341-F370 HydrophobicContact CG-CD2 4.22Å; A344-F370 HydrophobicContact CB-CB 3.37Å; A344-F370 HydrophobicContact CB-CD1 3.85Å; A344-F370 HydrophobicContact CB-CD2 4.48Å; A344-F370 HydrophobicContact CB-CG 3.66Å; F345-F370 HydrophobicContact CB-CZ 4.3Å; F345-F370 HydrophobicContact CD2-CZ 4.01Å; P351-F370 HydrophobicContact CB-CD1 4.12Å; P351-F370 HydrophobicContact CG-CD1 4.37Å; P351-F370 HydrophobicContact CG-CE1 4.42Å; F370-G372 VanDerWaalsContact CE1-O 3.25Å; F370-G372 WeakPolarHBondContact CE1-O 3.34Å; F370-K373 WeakPolarHBondContact CE1-O 3.24Å; F370-K373 VanDerWaalsContact CZ-O 3.24Å; F370-K373 WeakPolarHBondContact CZ-O 3.5Å; F370-T374 HydrophobicContact CD1-CG2 4.45Å; F370-T374 HydrophobicContact CE1-CG2 4.09Å
371	S	65.1	Low	66.6	Low	111 Å²	111	76.6 Å²	76.6	78%	0.776	40%	0.402	S	S	*	.			trans	-141.3	12	-175	72.3	0	0	0	0	114.1
372	G	76.9	Confident	67.4	Low	27 Å²	27	68.8 Å²	68.8	28%	0.278	38%	0.378	S	S	.	.	S	Bend	trans	-83.7	-172.7	163.1	0	0	0	0	0	110.4	P351 F370	P351-G372 WeakPolarHBondContact CG-O 3.36Å; F370-G372 VanDerWaalsContact CE1-O 3.25Å; F370-G372 WeakPolarHBondContact CE1-O 3.34Å
373	K	81.1	Confident	68.2	Low	87 Å²	87	75.3 Å²	75.3	38%	0.378	39%	0.39	S	S	.	.			trans	-81.7	155.5	165.4	-52.9	-175	-143.2	74	0	110.1	D105 F345 F370 Q377	D105-K373 HydrophobicContact CB-CB 4.43Å; D105-K373 WeakPolarHBondContact OD1-CB 3.42Å; D105-K373 VanDerWaalsContact OD1-CG 3.3Å; D105-K373 WeakPolarHBondContact OD1-CG 3.28Å; D105-K373 IonicContact OD1-NZ 2.8Å; D105-K373 PolarHBondContact OD1-NZ 3.41Å; D105-K373 IonicContact OD2-NZ 3.72Å; D105-K373 PolarHBondContact OD2-NZ 2.92Å; F345-K373 WeakPolarHBondContact CD2-O 3.24Å; F370-K373 WeakPolarHBondContact CE1-O 3.24Å; F370-K373 VanDerWaalsContact CZ-O 3.24Å; F370-K373 WeakPolarHBondContact CZ-O 3.5Å; K373-Q377 HydrophobicContact CB-CB 3.94Å
374	T	84.9	Confident	69.1	Low	0 Å²	0	73.6 Å²	73.6	0%	0	39%	0.393	C	S	.	.			trans	-88.3	167.1	174.5	69.5	0	0	0	0	111.3	A344 F345 L348 P351 F370 Y376 Q377 A378	A344-T374 WeakPolarHBondContact O-CG2 3.41Å; F345-T374 WeakPolarHBondContact O-CB 3.44Å; L348-T374 HydrophobicContact CB-CG2 4.24Å; L348-T374 WeakPolarHBondContact O-CB 3.12Å; L348-T374 WeakPolarHBondContact O-CG2 3.5Å; L348-T374 PolarHBondContact O-OG1 3.41Å; P351-T374 HydrophobicContact CG-CG2 4.04Å; F370-T374 HydrophobicContact CD1-CG2 4.45Å; F370-T374 HydrophobicContact CE1-CG2 4.09Å; T374-Y376 PolarHBondContact O-N 3.35Å; T374-Q377 PolarHBondContact O-N 3Å; T374-A378 PolarHBondContact O-N 3.17Å
375	E	85.1	Confident	70.6	Confident	17 Å²	17	69.2 Å²	69.2	8%	0.079	37%	0.366	C	S	.	.	H	α-helix	trans	-57.3	-40.6	178.4	-170.9	167.8	-134.7	0	0	111.3	Y106 S147 F345 F346 Q377 A378 T379	Y106-E375 HydrophobicContact CE1-CG 4.14Å; S147-E375 WeakPolarHBondContact CA-OE1 3.47Å; S147-E375 VanDerWaalsContact CB-OE1 3.25Å; S147-E375 WeakPolarHBondContact CB-OE1 3.38Å; S147-E375 PolarHBondContact OG-OE1 2.79Å; F345-E375 HydrophobicContact CD1-CB 4.08Å; F345-E375 HydrophobicContact CE1-CB 3.63Å; F345-E375 HydrophobicContact CE1-CG 4.18Å; F345-E375 HydrophobicContact CZ-CB 3.93Å; F345-E375 HydrophobicContact CZ-CG 4.48Å; F345-E375 PolarHBondContact O-N 2.81Å; F346-E375 WeakPolarHBondContact CD1-OE2 3.36Å; E375-Q377 VanDerWaalsContact C-N 3.31Å; E375-Q377 PolarHBondContact O-N 3.18Å; E375-A378 PolarHBondContact O-N 3.38Å; E375-T379 HydrophobicContact CG-CG2 4.36Å; E375-T379 WeakPolarHBondContact O-CB 3.33Å; E375-T379 WeakPolarHBondContact O-CG2 3.18Å; E375-T379 PolarHBondContact O-N 3.27Å; E375-T379 PolarHBondContact O-OG1 2.74Å
376	Y	82.3	Confident	71.8	Confident	105 Å²	105	78.4 Å²	78.4	41%	0.412	39%	0.388	S	S	.	.	H	α-helix	trans	-58.1	-41.1	173.8	-174.6	-94.1	0	0	0	112.3	R349 T374 T379 H380	R349-Y376 HydrophobicContact CB-CD1 3.87Å; R349-Y376 HydrophobicContact CB-CE1 4.22Å; R349-Y376 HydrophobicContact CB-CG 4.23Å; R349-Y376 HydrophobicContact CG-CD1 4.09Å; R349-Y376 HydrophobicContact CG-CD2 4.26Å; R349-Y376 HydrophobicContact CG-CE1 4.31Å; R349-Y376 HydrophobicContact CG-CE2 4.47Å; R349-Y376 HydrophobicContact CG-CG 4.07Å; R349-Y376 WeakPolarHBondContact O-CD1 3.13Å; T374-Y376 PolarHBondContact O-N 3.35Å; Y376-T379 WeakPolarHBondContact CA-OG1 3.08Å; Y376-T379 PolarHBondContact O-OG1 2.99Å; Y376-T379 VanDerWaalsContact O-OG1 3.08Å; Y376-H380 AromaticContact CD2-CE1 3.96Å; Y376-H380 AromaticContact CD2-ND1 3.78Å; Y376-H380 HydrophobicContact CE1-CB 4.44Å; Y376-H380 AromaticContact CE2-CE1 3.89Å; Y376-H380 AromaticContact CE2-ND1 3.86Å; Y376-H380 VanDerWaalsContact O-CB 3.24Å; Y376-H380 WeakPolarHBondContact O-CB 3.27Å; Y376-H380 PolarHBondContact O-N 3.38Å; Y376-H380 PolarHBondContact O-ND1 2.86Å
377	Q	82.6	Confident	72.8	Confident	51 Å²	51	80.2 Å²	80.2	24%	0.238	41%	0.406	C	S	.	.	H	α-helix	trans	-74.5	-37.3	177.4	-69.9	-173.2	-33.1	0	0	113.4	R349 P351 K373 T374 E375 T379 G381	R349-Q377 WeakPolarHBondContact O-CG 3.44Å; P351-Q377 VanDerWaalsContact CD-OE1 3.31Å; K373-Q377 HydrophobicContact CB-CB 3.94Å; T374-Q377 PolarHBondContact O-N 3Å; E375-Q377 VanDerWaalsContact C-N 3.31Å; E375-Q377 PolarHBondContact O-N 3.18Å; Q377-T379 VanDerWaalsContact C-N 3.35Å; Q377-G381 VanDerWaalsContact O-CA 3.29Å; Q377-G381 WeakPolarHBondContact O-CA 3.17Å; Q377-G381 PolarHBondContact O-N 3.47Å
378	A	81	Confident	73.3	Confident	15 Å²	15	76.7 Å²	76.7	12%	0.124	40%	0.399	C	S	.	.	H	α-helix	trans	-62.7	-44.6	175.5	0	0	0	0	0	110.7	D105 Y106 T374 E375	D105-A378 HydrophobicContact CB-CB 4.37Å; Y106-A378 HydrophobicContact CE2-CB 4.47Å; T374-A378 PolarHBondContact O-N 3.17Å; E375-A378 PolarHBondContact O-N 3.38Å
379	T	80.7	Confident	73.8	Confident	11 Å²	11	81.9 Å²	81.9	7%	0.067	43%	0.434	C	S	.	.	H	α-helix	trans	-72.9	-47.1	178.3	51.5	0	0	0	0	113.2	N152 R154 E375 Y376 Q377	N152-T379 HydrophobicContact CB-CG2 3.87Å; R154-T379 PolarHBondContact NE-O 3.32Å; R154-T379 PolarHBondContact NH1-O 2.95Å; R154-T379 VanDerWaalsContact NH1-O 3.09Å; R154-T379 PolarHBondContact NH2-O 3.12Å; E375-T379 HydrophobicContact CG-CG2 4.36Å; E375-T379 WeakPolarHBondContact O-CB 3.33Å; E375-T379 WeakPolarHBondContact O-CG2 3.18Å; E375-T379 PolarHBondContact O-N 3.27Å; E375-T379 PolarHBondContact O-OG1 2.74Å; Y376-T379 WeakPolarHBondContact CA-OG1 3.08Å; Y376-T379 PolarHBondContact O-OG1 2.99Å; Y376-T379 VanDerWaalsContact O-OG1 3.08Å; Q377-T379 VanDerWaalsContact C-N 3.35Å
380	H	74.6	Confident	74.5	Confident	120 Å²	120	79.8 Å²	79.8	56%	0.556	43%	0.428	S	S	*	.	H	α-helix	trans	-96.9	-22.3	-171	-63.8	69.5	0	0	0	114.6	Y376	Y376-H380 AromaticContact CD2-CE1 3.96Å; Y376-H380 AromaticContact CD2-ND1 3.78Å; Y376-H380 HydrophobicContact CE1-CB 4.44Å; Y376-H380 AromaticContact CE2-CE1 3.89Å; Y376-H380 AromaticContact CE2-ND1 3.86Å; Y376-H380 VanDerWaalsContact O-CB 3.24Å; Y376-H380 WeakPolarHBondContact O-CB 3.27Å; Y376-H380 PolarHBondContact O-N 3.38Å; Y376-H380 PolarHBondContact O-ND1 2.86Å
381	G	63.7	Low	75	Confident	66 Å²	66	87.3 Å²	87.3	68%	0.68	46%	0.463	S	S	*	.	S	Bend	trans	-84.7	-15.2	-174.8	0	0	0	0	0	115.4	Q377	Q377-G381 VanDerWaalsContact O-CA 3.29Å; Q377-G381 WeakPolarHBondContact O-CA 3.17Å; Q377-G381 PolarHBondContact O-N 3.47Å
382	G	61.6	Low	76.2	Confident	36 Å²	36	84.8 Å²	84.8	37%	0.371	44%	0.437	S	S	.	.	P	Polyproline II helix	trans	-80.1	123.5	-178	0	0	0	0	0	113.5	R154 L384	R154-G382 PolarHBondContact NH1-O 2.91Å; G382-L384 PolarHBondContact O-N 3.04Å
383	R	59.6	Low	76.7	Confident	249 Å²	249	87.6 Å²	87.6	94%	0.94	44%	0.439	S	S	*	.	P	Polyproline II helix	trans	-61.9	125	156.8	-86.8	-169	172.5	-154.9	-2.4	108.2	R385	R383-R385 PolarHBondContact O-N 3.34Å
384	L	63.2	Low	77	Confident	138 Å²	138	87.7 Å²	87.7	72%	0.723	45%	0.448	S	S	*	.	P	Polyproline II helix	trans	-62.2	119	176.4	-161.6	71.7	0	0	0	109.5	G382	G382-L384 PolarHBondContact O-N 3.04Å
385	R	73.1	Confident	77.2	Confident	64 Å²	64	88.9 Å²	88.9	24%	0.242	46%	0.457	C	S	.	.	P	Polyproline II helix	trans	-76.2	165.5	168.8	62.1	167.2	-179.1	-178.3	2.4	109.9	D100 V102 E155 R383 A387 S388	D100-R385 PolarHBondContact O-NH1 3.47Å; D100-R385 PolarHBondContact O-NH2 3.19Å; D100-R385 IonicContact OD1-NH1 2.76Å; D100-R385 PolarHBondContact OD1-NH1 3.26Å; D100-R385 IonicContact OD2-CZ 2.65Å; D100-R385 IonicContact OD2-NH1 3.05Å; D100-R385 PolarHBondContact OD2-NH1 2.93Å; D100-R385 IonicContact OD2-NH2 2.61Å; V102-R385 VanDerWaalsContact CG2-CZ 3.46Å; E155-R385 WeakPolarHBondContact OE1-CG 3.43Å; E155-R385 IonicContact OE1-CZ 3.75Å; E155-R385 IonicContact OE1-NE 2.72Å; E155-R385 PolarHBondContact OE1-NE 2.98Å; E155-R385 IonicContact OE1-NH2 3.58Å; E155-R385 IonicContact OE2-CZ 3.18Å; E155-R385 VanDerWaalsContact OE2-CZ 3.26Å; E155-R385 IonicContact OE2-NE 3.66Å; E155-R385 PolarHBondContact OE2-NE 3.21Å; E155-R385 IonicContact OE2-NH2 3.64Å; E155-R385 PolarHBondContact OE2-NH2 2.79Å; R383-R385 PolarHBondContact O-N 3.34Å; R385-A387 PolarHBondContact O-N 3.08Å; R385-S388 VanDerWaalsContact CZ-CB 3.47Å
386	R	72.3	Confident	77.4	Confident	233 Å²	233	93.5 Å²	93.5	88%	0.879	48%	0.477	S	S	*	.	P	Polyproline II helix	trans	-62.1	135.5	160.6	-79.1	-175.4	-79.5	110.5	-5.3	107.8	S388	R386-S388 PolarHBondContact O-N 2.66Å
387	A	67.6	Low	77.8	Confident	93 Å²	93	94.1 Å²	94.1	77%	0.769	48%	0.478	S	S	*	.	P	Polyproline II helix	trans	-50.5	126.1	-179.1	0	0	0	0	0	110.7	R385	R385-A387 PolarHBondContact O-N 3.08Å
388	S	69.5	Low	78.2	Confident	42 Å²	42	95.9 Å²	95.9	29%	0.294	48%	0.483	S	S	.	.	P	Polyproline II helix	trans	-85.1	123.9	179.3	-159	0	0	0	0	109	D100 R385 R386	D100-S388 PolarHBondContact OD2-OG 3.28Å; R385-S388 VanDerWaalsContact CZ-CB 3.47Å; R386-S388 PolarHBondContact O-N 2.66Å
389	T	75.3	Confident	78.7	Confident	143 Å²	143	99.1 Å²	99.1	88%	0.877	50%	0.503	S	S	*	.	P	Polyproline II helix	trans	-80.8	125.9	172.9	46.6	0	0	0	0	109.6
390	F	87.4	Confident	78.9	Confident	47 Å²	47	98.8 Å²	98.8	21%	0.206	50%	0.501	C	S	.	.			trans	-123.2	160.3	178.2	71.8	-81.7	0	0	0	110.2	E156 F157 Y160 R392	E156-F390 HydrophobicContact CB-CE1 3.95Å; E156-F390 HydrophobicContact CG-CE1 3.83Å; E156-F390 HydrophobicContact CG-CZ 4.31Å; F157-F390 HydrophobicContact CB-CD1 3.78Å; F157-F390 HydrophobicContact CB-CE1 3.97Å; F157-F390 HydrophobicContact CB-CG 4.15Å; F157-F390 HydrophobicContact CB-CZ 4.48Å; F157-F390 HydrophobicContact CD2-CB 4.17Å; F157-F390 HydrophobicContact CD2-CD1 4.12Å; F157-F390 AromaticContact CD2-CD2 3.49Å; F157-F390 HydrophobicContact CD2-CD2 3.49Å; F157-F390 VanDerWaalsContact CD2-CD2 3.49Å; F157-F390 HydrophobicContact CD2-CE1 4.43Å; F157-F390 AromaticContact CD2-CE2 3.83Å; F157-F390 HydrophobicContact CD2-CE2 3.83Å; F157-F390 AromaticContact CD2-CG 3.65Å; F157-F390 HydrophobicContact CD2-CG 3.65Å; F157-F390 HydrophobicContact CD2-CZ 4.29Å; F157-F390 HydrophobicContact CE2-CD2 4.06Å; F157-F390 HydrophobicContact CE2-CG 4.44Å; F157-F390 HydrophobicContact CG-CD1 4.35Å; F157-F390 HydrophobicContact CG-CD2 4.46Å; F157-F390 HydrophobicContact CG-CG 4.22Å; Y160-F390 HydrophobicContact CD1-CD2 4.28Å; Y160-F390 AromaticContact CD1-CE2 3.51Å; Y160-F390 HydrophobicContact CD1-CE2 3.51Å; Y160-F390 HydrophobicContact CD1-CZ 4.19Å; Y160-F390 HydrophobicContact CD2-CE2 4.23Å; Y160-F390 HydrophobicContact CE1-CE2 4.03Å; Y160-F390 AromaticContact CG-CE2 3.61Å; Y160-F390 HydrophobicContact CG-CE2 3.61Å; Y160-F390 AromaticContact CG-CZ 3.93Å; Y160-F390 HydrophobicContact CG-CZ 3.93Å; F390-R392 HydrophobicContact CD2-CG 4.47Å; F390-R392 HydrophobicContact CE2-CG 3.64Å; F390-R392 HydrophobicContact CZ-CG 4.14Å
391	E	86.8	Confident	79.4	Confident	178 Å²	178	96.4 Å²	96.4	83%	0.832	49%	0.487	S	S	*	.	P	Polyproline II helix	trans	-92.9	122.9	176.5	-166.7	174.7	154.7	0	0	109.3
392	R	90.4	Very high	80.1	Confident	59 Å²	59	97 Å²	97	22%	0.223	48%	0.478	C	S	.	.	P	Polyproline II helix	trans	-73.1	131.2	170.8	-72.4	174.8	170.8	76.4	3.6	108.2	E156 Y160 E240 F390	E156-R392 IonicContact OE1-CZ 3.86Å; E156-R392 VanDerWaalsContact OE1-CZ 3.29Å; E156-R392 IonicContact OE1-NH1 3.7Å; E156-R392 PolarHBondContact OE1-NH1 3.33Å; E156-R392 IonicContact OE1-NH2 3.29Å; E156-R392 PolarHBondContact OE1-NH2 2.98Å; Y160-R392 HydrophobicContact CD2-CG 3.99Å; Y160-R392 HydrophobicContact CE2-CB 4.1Å; Y160-R392 HydrophobicContact CE2-CG 3.88Å; E240-R392 IonicContact OE1-CZ 2.76Å; E240-R392 VanDerWaalsContact OE1-CZ 3.26Å; E240-R392 IonicContact OE1-NE 2.72Å; E240-R392 PolarHBondContact OE1-NE 3.43Å; E240-R392 IonicContact OE1-NH2 2.85Å; E240-R392 PolarHBondContact OE1-NH2 2.61Å; E240-R392 IonicContact OE2-CZ 2.73Å; E240-R392 IonicContact OE2-NE 3.29Å; E240-R392 IonicContact OE2-NH2 3.33Å; E240-R392 PolarHBondContact OE2-NH2 2.71Å; F390-R392 HydrophobicContact CD2-CG 4.47Å; F390-R392 HydrophobicContact CE2-CG 3.64Å; F390-R392 HydrophobicContact CZ-CG 4.14Å
393	R	88.1	Confident	80.7	Confident	85 Å²	85	100.6 Å²	100.6	32%	0.321	49%	0.485	S	S	.	.	P	Polyproline II helix	trans	-82.7	127	177.4	-165.7	-168.3	-160.7	142.7	25.1	109	D74 T76 Y160	D74-R393 HydrophobicContact CB-CB 4.38Å; D74-R393 WeakPolarHBondContact O-CD 3.32Å; D74-R393 PolarHBondContact O-NH1 2.9Å; D74-R393 IonicContact OD2-CZ 2.71Å; D74-R393 IonicContact OD2-NH1 2.64Å; D74-R393 PolarHBondContact OD2-NH1 3.27Å; T76-R393 PolarHBondContact OG1-NH1 3.1Å; Y160-R393 PolarHBondContact OH-N 2.78Å
394	P	88.2	Confident	81	Confident	89 Å²	89	91.9 Å²	91.9	58%	0.578	46%	0.462	S	S	*	.	P	Polyproline II helix	trans	-56.7	143.8	170.4	-25.5	35.1	0	0	0	112	E193	E193-P394 WeakPolarHBondContact OE1-CA 3.39Å
395	S	89.2	Confident	81	Confident	26 Å²	26	91.2 Å²	91.2	18%	0.182	46%	0.458	C	S	.	.	P	Polyproline II helix	trans	-61.8	151.9	173.5	-69.2	0	0	0	0	111	R167 E193 R397	R167-S395 PolarHBondContact NH1-OG 3.05Å; R167-S395 PolarHBondContact NH2-OG 2.84Å; E193-S395 WeakPolarHBondContact OE1-CB 3.45Å; E193-S395 PolarHBondContact OE1-N 3.49Å; E193-S395 WeakPolarHBondContact OE2-CB 3.32Å; E193-S395 PolarHBondContact OE2-N 2.77Å; E193-S395 PolarHBondContact OE2-OG 3.04Å; S395-R397 PolarHBondContact O-N 2.77Å
396	K	88.4	Confident	80	Confident	114 Å²	114	89.8 Å²	89.8	50%	0.496	46%	0.464	S	S	.	.			trans	-66.2	106.9	166.1	-179.9	-179	167	-158.6	0	109.3	Y398	K396-Y398 HydrophobicContact CB-CE2 4.44Å; K396-Y398 HydrophobicContact CD-CE1 4.41Å; K396-Y398 HydrophobicContact CD-CE2 4.26Å; K396-Y398 WeakPolarHBondContact CD-OH 3.44Å; K396-Y398 WeakPolarHBondContact CE-OH 3.21Å; K396-Y398 HydrophobicContact CG-CE2 4.08Å; K396-Y398 PolarHBondContact NZ-OH 3.22Å; K396-Y398 VanDerWaalsContact O-CD2 3.27Å; K396-Y398 WeakPolarHBondContact O-CD2 3.47Å; K396-Y398 WeakPolarHBondContact O-CE2 3.3Å
397	R	91.6	Very high	78.9	Confident	117 Å²	117	87.4 Å²	87.4	44%	0.442	46%	0.46	S	S	.	.			trans	-70.9	151.1	168.4	-68.6	172.2	177.6	-129	8.9	111.2	L206 E209 S395	L206-R397 VanDerWaalsContact CD1-NH1 3.3Å; E209-R397 HydrophobicContact CB-CB 4.31Å; E209-R397 HydrophobicContact CB-CG 4.35Å; E209-R397 CarbonylContact O-C 3.59Å; E209-R397 WeakPolarHBondContact O-CA 3.11Å; E209-R397 VanDerWaalsContact OE2-CD 3.3Å; E209-R397 WeakPolarHBondContact OE2-CD 3.18Å; E209-R397 IonicContact OE2-CZ 2.85Å; E209-R397 IonicContact OE2-NE 2.77Å; E209-R397 IonicContact OE2-NH1 3.78Å; E209-R397 PolarHBondContact OE2-NH1 3.25Å; S395-R397 PolarHBondContact O-N 2.77Å
398	Y	91.1	Very high	78	Confident	89 Å²	89	89.2 Å²	89.2	35%	0.349	46%	0.461	S	S	.	.			trans	-125.4	160.9	177.2	-67	-94.4	0	0	0	109.2	E209 R211 K396 S400	E209-Y398 WeakPolarHBondContact CA-O 3.33Å; E209-Y398 WeakPolarHBondContact CB-O 3.27Å; E209-Y398 PolarHBondContact O-N 2.87Å; R211-Y398 HydrophobicContact CG-CD2 3.76Å; R211-Y398 HydrophobicContact CG-CE2 3.84Å; R211-Y398 HydrophobicContact CG-CG 4.41Å; K396-Y398 HydrophobicContact CB-CE2 4.44Å; K396-Y398 HydrophobicContact CD-CE1 4.41Å; K396-Y398 HydrophobicContact CD-CE2 4.26Å; K396-Y398 WeakPolarHBondContact CD-OH 3.44Å; K396-Y398 WeakPolarHBondContact CE-OH 3.21Å; K396-Y398 HydrophobicContact CG-CE2 4.08Å; K396-Y398 PolarHBondContact NZ-OH 3.22Å; K396-Y398 VanDerWaalsContact O-CD2 3.27Å; K396-Y398 WeakPolarHBondContact O-CD2 3.47Å; K396-Y398 WeakPolarHBondContact O-CE2 3.3Å; Y398-S400 PolarHBondContact O-N 2.5Å
399	P	89.7	Confident	77	Confident	82 Å²	82	91.3 Å²	91.3	53%	0.532	48%	0.481	S	S	.	.			trans	-57.3	132.2	171.7	-23.3	34.2	0	0	0	111.3
400	S	85.9	Confident	75.6	Confident	4 Å²	4	91.4 Å²	91.4	3%	0.028	48%	0.475	C	S	.	.			trans	-55.6	153.4	176.9	173.9	0	0	0	0	112.4	E205 S208 Y398 T402 Q403 S404	E205-S400 PolarHBondContact O-OG 3.2Å; S208-S400 WeakPolarHBondContact OG-CA 3.43Å; S208-S400 PolarHBondContact OG-OG 3.17Å; Y398-S400 PolarHBondContact O-N 2.5Å; S400-T402 VanDerWaalsContact C-N 3.25Å; S400-T402 PolarHBondContact O-N 3.36Å; S400-T402 PolarHBondContact OG-OG1 3Å; S400-Q403 PolarHBondContact O-N 2.8Å; S400-Q403 VanDerWaalsContact O-N 3.1Å; S400-S404 PolarHBondContact O-N 2.62Å
401	R	84.9	Confident	73	Confident	70 Å²	70	94.4 Å²	94.4	26%	0.264	50%	0.501	S	S	.	.	H	α-helix	trans	-53.2	-40.6	179.4	-174.1	178.8	-61.1	-88.3	-5.3	112.5	S208 Q216 E221 S404 L405	S208-R401 PolarHBondContact OG-N 2.75Å; Q216-R401 PolarHBondContact O-NH2 2.81Å; E221-R401 IonicContact OE1-CZ 2.64Å; E221-R401 IonicContact OE1-NE 2.67Å; E221-R401 IonicContact OE1-NH2 2.73Å; E221-R401 PolarHBondContact OE1-NH2 3.02Å; E221-R401 IonicContact OE2-CZ 3.76Å; E221-R401 VanDerWaalsContact OE2-CZ 3.29Å; E221-R401 IonicContact OE2-NE 3.6Å; E221-R401 PolarHBondContact OE2-NE 2.78Å; E221-R401 IonicContact OE2-NH2 2.66Å; E221-R401 PolarHBondContact OE2-NH2 2.62Å; R401-S404 PolarHBondContact O-N 3.3Å; R401-S404 PolarHBondContact O-OG 3.28Å; R401-L405 PolarHBondContact O-N 3.04Å
402	T	77.8	Confident	70.7	Confident	79 Å²	79	91.6 Å²	91.6	49%	0.485	50%	0.499	S	S	.	.	H	α-helix	trans	-68	-42.9	177.9	54.7	0	0	0	0	111.9	E205 S400 S404 L405 G406	E205-T402 HydrophobicContact CG-CG2 4.06Å; S400-T402 VanDerWaalsContact C-N 3.25Å; S400-T402 PolarHBondContact O-N 3.36Å; S400-T402 PolarHBondContact OG-OG1 3Å; T402-S404 VanDerWaalsContact C-N 3.29Å; T402-S404 PolarHBondContact O-N 2.96Å; T402-L405 PolarHBondContact O-N 3.05Å; T402-G406 PolarHBondContact O-N 2.82Å
403	Q	74.1	Confident	68.2	Low	112 Å²	112	93.4 Å²	93.4	52%	0.523	53%	0.526	S	S	.	.	H	α-helix	trans	-67.1	-27.7	177.2	-62.1	179.8	23.6	0	0	113.1	S400	S400-Q403 PolarHBondContact O-N 2.8Å; S400-Q403 VanDerWaalsContact O-N 3.1Å
404	S	66.7	Low	65.7	Low	65 Å²	65	98.4 Å²	98.4	46%	0.455	55%	0.55	S	S	.	*	H	α-helix	trans	-74.9	-40.4	176.7	76.9	0	0	0	0	112.1	S400 R401 T402	S400-S404 PolarHBondContact O-N 2.62Å; R401-S404 PolarHBondContact O-N 3.3Å; R401-S404 PolarHBondContact O-OG 3.28Å; T402-S404 VanDerWaalsContact C-N 3.29Å; T402-S404 PolarHBondContact O-N 2.96Å
405	L	62.7	Low	63.2	Low	124 Å²	124	100.3 Å²	100.3	65%	0.649	56%	0.563	S	S	*	*	H	α-helix	trans	-67.8	-41.6	172.4	-101.9	67.6	0	0	0	112.6	R401 T402 K407 V408	R401-L405 PolarHBondContact O-N 3.04Å; T402-L405 PolarHBondContact O-N 3.05Å; L405-K407 PolarHBondContact O-N 2.87Å; L405-V408 PolarHBondContact O-N 3.3Å
406	G	51.9	Low	60.5	Low	35 Å²	35	107 Å²	107	36%	0.361	60%	0.596	S	S	.	*	H	α-helix	trans	-57.3	-24	-174.9	0	0	0	0	0	115	T402 V408 A409	T402-G406 PolarHBondContact O-N 2.82Å; G406-V408 VanDerWaalsContact C-N 3.28Å; G406-V408 PolarHBondContact O-N 3.07Å; G406-A409 PolarHBondContact O-N 3.23Å
407	K	50.1	Low	57.9	Low	182 Å²	182	110.6 Å²	110.6	79%	0.791	61%	0.614	S	S	*	*	H	α-helix	trans	-73.4	-13.1	176.5	-74.3	-175.7	176	179.2	0	114.8	L405	L405-K407 PolarHBondContact O-N 2.87Å
408	V	48.7	Very low	55.1	Low	132 Å²	132	112.2 Å²	112.2	80%	0.8	63%	0.629	S	S	*	*	H	α-helix	trans	-85.5	-25.6	174.6	-175.2	0	0	0	0	111.4	L405 G406	L405-V408 PolarHBondContact O-N 3.3Å; G406-V408 VanDerWaalsContact C-N 3.28Å; G406-V408 PolarHBondContact O-N 3.07Å
409	A	47.1	Very low	52	Low	85 Å²	85	113.7 Å²	113.7	70%	0.702	65%	0.653	S	S	*	*	H	α-helix	trans	-93.7	-13.6	-168.9	0	0	0	0	0	115.6	G406	G406-A409 PolarHBondContact O-N 3.23Å
410	I	47.1	Very low	49.1	Very low	146 Å²	146	114.4 Å²	114.4	75%	0.749	66%	0.66	S	S	*	*			trans	-127.7	82	-172.6	-47	-179.3	0	0	0	111.3
411	S	32	Very low	46.4	Very low	109 Å²	109	124 Å²	124	76%	0.762	70%	0.704	S	S	*	*			trans	-123.4	111.5	160.7	-171.6	0	0	0	0	108.3	A413	S411-A413 PolarHBondContact O-N 3.18Å
412	P	40	Very low	43.8	Very low	120 Å²	120	125 Å²	125	78%	0.779	73%	0.727	S	S	*	*			trans	-74.8	97.2	-173.1	28.9	-33.8	0	0	0	111	K414	P412-K414 PolarHBondContact O-N 2.75Å
413	A	36.1	Very low	41.3	Very low	97 Å²	97	126.8 Å²	126.8	80%	0.802	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-62.8	133.3	173.9	0	0	0	0	0	111	S411	S411-A413 PolarHBondContact O-N 3.18Å
414	K	37	Very low	40	Very low	189 Å²	189	127 Å²	127	82%	0.822	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-70.1	142.4	172.3	-63.8	176.2	-178.5	176.4	0	109.4	P412 L416	P412-K414 PolarHBondContact O-N 2.75Å; K414-L416 PolarHBondContact O-N 3.26Å
415	P	36.1	Very low	38.2	Very low	130 Å²	130	131.3 Å²	131.3	84%	0.844	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-64.7	134.3	177.3	27.3	-34.3	0	0	0	110.7
416	L	31.9	Very low	37.2	Very low	167 Å²	167	131.5 Å²	131.5	87%	0.874	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-87.1	143.8	175.3	-128.9	77.2	0	0	0	110.7	K414	K414-L416 PolarHBondContact O-N 3.26Å
417	H	33.8	Very low	36.1	Very low	188 Å²	188	135 Å²	135	87%	0.87	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-79.4	138.7	177	-134.3	-86.8	0	0	0	110.9
418	I	32.3	Very low	35.5	Very low	151 Å²	151	131.2 Å²	131.2	77%	0.774	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-83.7	139.7	177.9	-63.1	171.5	0	0	0	110.2
419	S	26.8	Very low	34.5	Very low	121 Å²	121	133.8 Å²	133.8	85%	0.846	80%	0.797	S	S	*	*			trans	-151.5	151.7	160.1	-170.4	0	0	0	0	109.4
420	S	28.4	Very low	33.6	Very low	96 Å²	96	134.2 Å²	134.2	67%	0.671	80%	0.8	S	S	*	*			trans	-154.1	134.8	-168	51.1	0	0	0	0	113.8
421	Q	30	Very low	32.7	Very low	206 Å²	206	135.5 Å²	135.5	96%	0.963	81%	0.808	S	S	*	*			trans	-175.2	174.3	151	-106.2	168.6	64.3	0	0	111.1
422	A	28.6	Very low	32.8	Very low	90 Å²	90	138.4 Å²	138.4	74%	0.744	81%	0.814	S	S	*	*			trans	-151.9	154.7	-135.5	0	0	0	0	0	117.9
423	S	27.1	Very low	32.3	Very low	118 Å²	118	141.4 Å²	141.4	83%	0.825	82%	0.817	S	S	*	*			trans	66.5	162.5	155.9	-70.1	0	0	0	0	119.6
424	P	46.8	Very low	32	Very low	116 Å²	116	143.6 Å²	143.6	75%	0.753	82%	0.815	S	S	*	*			cis	-135.3	161.9	-28.4	34.5	-16.2	0	0	0	116.3
425	N	28.8	Very low	32.1	Very low	156 Å²	156	139.7 Å²	139.7	83%	0.834	81%	0.809	S	S	*	*			trans	11.8	150.8	149.1	-74.9	3	0	0	0	123
426	P	39.7	Very low	31.7	Very low	127 Å²	127	139.9 Å²	139.9	83%	0.825	80%	0.803	S	S	*	*			cis	-140	-168.5	41.1	41.1	-20.9	0	0	0	118.2
427	S	28.8	Very low	31.4	Very low	110 Å²	110	141.1 Å²	141.1	77%	0.769	80%	0.804	S	S	*	*			trans	-102	-174.5	-164	61.1	0	0	0	0	113.7
428	P	38	Very low	31.2	Very low	102 Å²	102	141.2 Å²	141.2	66%	0.662	80%	0.798	S	S	*	*			cis	-134	162.1	-0.9	41.9	-26.4	0	0	0	116.8
429	H	28.2	Very low	30.9	Very low	186 Å²	186	141 Å²	141	86%	0.861	79%	0.794	S	S	*	*			trans	175.9	165.4	130.9	-98.8	-69.4	0	0	0	111
430	A	29	Very low	30.9	Very low	94 Å²	94	144.4 Å²	144.4	78%	0.777	80%	0.796	S	S	*	*			trans	64.6	102.9	175.9	0	0	0	0	0	118
431	L	27.9	Very low	30.8	Very low	173 Å²	173	146.4 Å²	146.4	91%	0.906	80%	0.799	S	S	*	*			trans	-130.6	102.6	158.7	-80.3	178.1	0	0	0	109.7
432	L	32.7	Very low	30.8	Very low	169 Å²	169	143.5 Å²	143.5	89%	0.885	79%	0.788	S	S	*	*			trans	-157.2	94.5	160.5	-84.3	-171.2	0	0	0	109.2
433	H	30.3	Very low	30.8	Very low	183 Å²	183	145.3 Å²	145.3	85%	0.847	79%	0.792	S	S	*	*			trans	-167.9	125.5	161.7	-103	-72.2	0	0	0	109.5
434	D	29.6	Very low	30.8	Very low	144 Å²	144	146 Å²	146	77%	0.77	79%	0.786	S	S	*	*				169.3	163.3	114.5	-147.5	36.6	0	0	0	109.6
435	P	40.4	Very low	29.8	Very low	106 Å²	106	145.2 Å²	145.2	69%	0.688	78%	0.783	S	S	*	*			cis	-114.4	168.3	-23.5	8.3	15.5	0	0	0	113.7
436	L	27.7	Very low	29.7	Very low	135 Å²	135	146.8 Å²	146.8	71%	0.707	79%	0.785	S	S	*	*			trans	-85.3	129.9	172.5	-69.9	157	0	0	0	111.6	Y438	L436-Y438 HydrophobicContact CB-CD2 4.26Å; L436-Y438 HydrophobicContact CB-CE2 4.28Å; L436-Y438 HydrophobicContact CD1-CE2 4.29Å
437	Q	25.2	Very low	29.1	Very low	193 Å²	193	149.1 Å²	149.1	90%	0.902	79%	0.785	S	S	*	*			trans	-96	114.4	162.8	-73.4	-166.3	3.2	0	0	110.8	Q439	Q437-Q439 PolarHBondContact O-N 2.95Å
438	Y	28.3	Very low	29.2	Very low	189 Å²	189	149 Å²	149	74%	0.741	78%	0.782	S	S	*	*			trans	-94.2	96.2	175.4	-95.7	-80	0	0	0	113	L436	L436-Y438 HydrophobicContact CB-CD2 4.26Å; L436-Y438 HydrophobicContact CB-CE2 4.28Å; L436-Y438 HydrophobicContact CD1-CE2 4.29Å
439	Q	27.3	Very low	28.7	Very low	148 Å²	148	155.6 Å²	155.6	69%	0.692	79%	0.793	S	S	*	*			trans	24.1	115.2	144.8	-61.8	-175.8	-36.8	0	0	119.1	Q437	Q437-Q439 PolarHBondContact O-N 2.95Å
440	H	25.9	Very low	28.6	Very low	192 Å²	192	154.9 Å²	154.9	89%	0.889	79%	0.79	S	S	*	*			trans	-92.8	127.7	146.6	-82.7	47.9	0	0	0	109.4	I442	H440-I442 PolarHBondContact O-N 2.95Å
441	N	26.6	Very low	28.9	Very low	137 Å²	137	155.8 Å²	155.8	73%	0.733	79%	0.788	S	S	*	*			trans	-94.7	87.3	-177.4	-83.6	-22.4	0	0	0	113
442	I	30	Very low	29.1	Very low	145 Å²	145	153.5 Å²	153.5	74%	0.744	78%	0.784	S	S	*	*			trans	-140	114.7	149.4	-54.4	-179.5	0	0	0	107.7	H440 I444	H440-I442 PolarHBondContact O-N 2.95Å; I442-I444 PolarHBondContact O-N 2.9Å
443	P	27.9	Very low	28.8	Very low	128 Å²	128	154.2 Å²	154.2	83%	0.831	78%	0.782	S	S	*	*			trans	-76.2	112.6	-179.7	29.6	-32.8	0	0	0	111.1
444	I	26.8	Very low	29.2	Very low	134 Å²	134	151.7 Å²	151.7	69%	0.687	78%	0.782	S	S	*	*			trans	-117.9	120.4	160.2	-60.8	176.2	0	0	0	106.6	I442	I442-I444 PolarHBondContact O-N 2.9Å
445	S	26.6	Very low	29.1	Very low	99 Å²	99	149.7 Å²	149.7	69%	0.692	79%	0.785	S	S	*	*			trans	-135.2	131	170.2	53.3	0	0	0	0	110
446	H	27.4	Very low	28.5	Very low	189 Å²	189	152.2 Å²	152.2	88%	0.875	79%	0.792	S	S	*	*			trans	178.1	116.5	140.6	-94.5	-61.4	0	0	0	108
447	E	26.6	Very low	28.6	Very low	176 Å²	176	152.3 Å²	152.3	82%	0.822	80%	0.799	S	S	*	*			trans	-124.3	164.6	162.2	-109.2	-155.9	95.2	0	0	108.6
448	P	30.6	Very low	29.5	Very low	108 Å²	108	148.1 Å²	148.1	70%	0.701	79%	0.788	S	S	*	*			trans	-78	154.8	-160.8	30.9	-36.1	0	0	0	114.3
449	W	27.1	Very low	29.7	Very low	239 Å²	239	144.9 Å²	144.9	91%	0.905	79%	0.79	S	S	*	*			trans	-108.4	132.6	177.2	-81.6	86.5	0	0	0	112.1
450	H	27.7	Very low	29.7	Very low	171 Å²	171	143.7 Å²	143.7	79%	0.792	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-98.3	147.6	160.8	-70.4	-78.7	0	0	0	110.3
451	P	33.4	Very low	29.8	Very low	113 Å²	113	144.4 Å²	144.4	73%	0.734	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-88.4	141.7	-179.3	34	-33.8	0	0	0	113.1
452	P	32.4	Very low	29.8	Very low	126 Å²	126	145.7 Å²	145.7	82%	0.818	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-88.4	144.4	170.7	34	-32.8	0	0	0	112.7
453	H	27.3	Very low	29.8	Very low	184 Å²	184	146.6 Å²	146.6	85%	0.852	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-85.4	145.6	172.2	-63.8	-92.9	0	0	0	112
454	P	37.5	Very low	30.2	Very low	129 Å²	129	146.1 Å²	146.1	84%	0.838	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-85	136.3	167.4	33.2	-31.9	0	0	0	112.1
455	A	28.1	Very low	30.2	Very low	102 Å²	102	144.9 Å²	144.9	84%	0.843	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-101.8	173.6	170.1	0	0	0	0	0	111.8
456	L	28.5	Very low	30.2	Very low	160 Å²	160	143.2 Å²	143.2	84%	0.838	80%	0.795	S	S	*	*			trans	-106.3	159.8	-158.3	-70.7	164.1	0	0	0	116
457	T	29.5	Very low	30.3	Very low	137 Å²	137	143.2 Å²	143.2	84%	0.84	79%	0.794	S	S	*	*			trans	79.5	155.1	151.3	41.8	0	0	0	0	121.6
458	P	45.1	Very low	30.5	Very low	104 Å²	104	141.1 Å²	141.1	68%	0.675	79%	0.794	S	S	*	*			trans	-130.4	-178.2	-153.1	45.3	-29.5	0	0	0	116.6
459	P	32.3	Very low	31.2	Very low	122 Å²	122	141.3 Å²	141.3	79%	0.792	80%	0.795	S	S	*	*				-132.4	158.5	121.1	35.9	-26.3	0	0	0	111.9
460	V	27.1	Very low	32.1	Very low	123 Å²	123	134.1 Å²	134.1	75%	0.745	78%	0.779	S	S	*	*			cis	115.4	108.4	15.9	167	0	0	0	0	113
461	Y	27.3	Very low	32.3	Very low	207 Å²	207	134.3 Å²	134.3	81%	0.812	78%	0.78	S	S	*	*			trans	64.6	115.4	156.9	-98.2	-105.2	0	0	0	122.7
462	L	27.3	Very low	32	Very low	163 Å²	163	134.3 Å²	134.3	85%	0.853	78%	0.783	S	S	*	*				-173.4	162.5	95.9	-101.9	167.9	0	0	0	112.6
463	Q	30.5	Very low	32.2	Very low	165 Å²	165	137.8 Å²	137.8	77%	0.771	79%	0.786	S	S	*	*			trans	-138.9	162.1	175.9	-152.5	-167.6	25.6	0	0	109.7
464	P	34.7	Very low	33	Very low	118 Å²	118	135 Å²	135	77%	0.766	78%	0.784	S	S	*	*				-148	175.7	111.4	38.2	-21.9	0	0	0	116.8
465	S	27.5	Very low	32.6	Very low	108 Å²	108	136.6 Å²	136.6	76%	0.755	79%	0.785	S	S	*	*			trans	-40	163.6	172.3	-45.8	0	0	0	0	118.2
466	G	26.1	Very low	32.7	Very low	64 Å²	64	137 Å²	137	66%	0.66	78%	0.781	S	S	*	*			cis	162.5	-159.9	-0.4	0	0	0	0	0	113.6
467	H	29.7	Very low	32.7	Very low	188 Å²	188	134.6 Å²	134.6	87%	0.87	78%	0.778	S	S	*	*			trans	84.7	163.7	173.1	-54.6	-76.4	0	0	0	119.6
468	T	30.8	Very low	32.7	Very low	132 Å²	132	133.9 Å²	133.9	81%	0.81	78%	0.778	S	S	*	*			trans	-140.5	-150.7	-154.8	47.6	0	0	0	0	112.7
469	P	45.8	Very low	32	Very low	112 Å²	112	133.2 Å²	133.2	73%	0.727	78%	0.781	S	S	*	*				-111.2	-146	-105.2	40.2	-19.1	0	0	0	111.3
470	P	46.5	Very low	32	Very low	88 Å²	88	132.2 Å²	132.2	57%	0.571	78%	0.778	S	S	*	*			cis	-143.8	178.5	-9.6	44.4	-26.1	0	0	0	118.6
471	H	30.6	Very low	32.2	Very low	175 Å²	175	132.8 Å²	132.8	81%	0.81	78%	0.777	S	S	*	*			trans	66.3	164.7	156.4	-47.7	-46.1	0	0	0	118.4
472	S	28.1	Very low	32.4	Very low	114 Å²	114	130.6 Å²	130.6	80%	0.797	77%	0.773	S	S	*	*			cis	-147.1	162	12.3	-55.6	0	0	0	0	113.2
473	F	36	Very low	32.5	Very low	198 Å²	198	129.7 Å²	129.7	87%	0.868	77%	0.765	S	S	*	*			trans	-85.5	167.7	157.2	-69	-89.8	0	0	0	110.7
474	P	43.9	Very low	32.4	Very low	126 Å²	126	131 Å²	131	82%	0.818	76%	0.764	S	S	*	*				-147	-175.9	99.6	39.6	-23.5	0	0	0	115.6
475	L	30.2	Very low	31.9	Very low	163 Å²	163	130.4 Å²	130.4	85%	0.853	76%	0.762	S	S	*	*			trans	-124.6	165.5	177.6	-91.3	164.1	0	0	0	111.4
476	S	30	Very low	31.9	Very low	110 Å²	110	129.8 Å²	129.8	77%	0.769	76%	0.758	S	S	*	*			trans	108.9	139	149.2	79.1	0	0	0	0	120.6
477	S	27.2	Very low	32.1	Very low	109 Å²	109	131.9 Å²	131.9	76%	0.762	76%	0.763	S	S	*	*			trans	5.7	148.6	152.7	53.2	0	0	0	0	120.8
478	S	29.5	Very low	32.3	Very low	122 Å²	122	131.8 Å²	131.8	85%	0.853	76%	0.763	S	S	*	*				-161.8	-168.3	51.9	59.6	0	0	0	0	116.3
479	A	31	Very low	32.2	Very low	90 Å²	90	132.4 Å²	132.4	74%	0.744	76%	0.761	S	S	*	*			trans	-89.5	-161.4	-161.2	0	0	0	0	0	117.9
480	S	32.1	Very low	31.6	Very low	102 Å²	102	133.8 Å²	133.8	71%	0.713	76%	0.758	S	S	*	*			trans	89	97.1	164.2	27.7	0	0	0	0	122
481	D	30.4	Very low	30.9	Very low	135 Å²	135	135.9 Å²	135.9	72%	0.722	76%	0.764	S	S	*	*				75.6	146.2	114.6	-74.6	-61.2	0	0	0	126.4
482	H	32.8	Very low	31	Very low	160 Å²	160	132 Å²	132	74%	0.741	76%	0.756	S	S	*	*			trans	75.5	146.9	160.5	-56.5	-24.5	0	0	0	118.2
483	Q	29	Very low	31.4	Very low	144 Å²	144	137 Å²	137	67%	0.673	76%	0.759	S	S	*	*			cis	-164.3	163.7	-4	-128.5	-179.3	5.3	0	0	113.4
484	Y	27.6	Very low	31.3	Very low	193 Å²	193	132.7 Å²	132.7	76%	0.757	75%	0.754	S	S	*	*			trans	60.6	156.4	164.3	-78.9	-79.4	0	0	0	118.1
485	S	25.5	Very low	30.6	Very low	105 Å²	105	129.7 Å²	129.7	73%	0.734	75%	0.746	S	S	*	*			cis	-139.1	-160.9	4.9	-154.5	0	0	0	0	113.7
486	S	27.5	Very low	30.9	Very low	96 Å²	96	131.4 Å²	131.4	67%	0.671	75%	0.746	S	S	*	*			trans	-161.3	141.9	-132.2	-64.2	0	0	0	0	114.8
487	S	30.8	Very low	30.9	Very low	107 Å²	107	131.5 Å²	131.5	75%	0.748	74%	0.742	S	S	*	*			trans	-167.5	101.3	160.6	57.8	0	0	0	0	108.5
488	E	33.8	Very low	31.2	Very low	187 Å²	187	133.4 Å²	133.4	87%	0.874	74%	0.739	S	S	*	*				65.7	124.8	84	-64	-173.9	137.1	0	0	112.6
489	N	28.5	Very low	31.3	Very low	144 Å²	144	134.7 Å²	134.7	77%	0.77	73%	0.731	S	S	*	*				-157.8	151.4	69	-162.9	38.5	0	0	0	115.1
490	E	31.8	Very low	31.3	Very low	142 Å²	142	141 Å²	141	66%	0.664	74%	0.736	S	S	*	*			trans	36.1	122	158.3	-62.8	-93.6	75.9	0	0	121
491	N	32.3	Very low	31.5	Very low	131 Å²	131	144.9 Å²	144.9	70%	0.701	74%	0.742	S	S	*	*				77.6	144.8	62.7	-73.3	-28	0	0	0	115
492	S	33.1	Very low	31.2	Very low	93 Å²	93	150.2 Å²	150.2	65%	0.65	75%	0.752	S	S	*	*			cis	-156.3	143.9	23.4	-110.9	0	0	0	0	114.9
493	Y	35.5	Very low	31.1	Very low	219 Å²	219	153.4 Å²	153.4	86%	0.859	76%	0.758	S	S	*	*			trans	50.1	155.3	148.5	-72.3	-99.9	0	0	0	122.1
494	S	34.2	Very low	31	Very low	109 Å²	109	155 Å²	155	76%	0.762	77%	0.765	S	S	*	*			cis	-146.5	139.8	8.6	-169.9	0	0	0	0	110.4
495	G	30.2	Very low	31.2	Very low	62 Å²	62	151.3 Å²	151.3	64%	0.639	76%	0.763	S	S	*	*				96.8	103.4	95.2	0	0	0	0	0	112.9
496	K	35.2	Very low	31.2	Very low	199 Å²	199	154.8 Å²	154.8	87%	0.865	77%	0.767	S	S	*	*				61.1	136.9	74.8	-68.4	-177	178.7	174.5	0	113.4
497	T	31.3	Very low	31.2	Very low	112 Å²	112	154.3 Å²	154.3	69%	0.687	76%	0.764	S	S	*	*			cis	-164.2	150.9	19.9	-4.4	0	0	0	0	113.2
498	H	32.5	Very low	31.2	Very low	150 Å²	150	157 Å²	157	69%	0.694	76%	0.764	S	S	*	*			trans	23.8	152.2	131	-65.9	-116.4	0	0	0	121.2
499	H	33.1	Very low	31	Very low	149 Å²	149	154 Å²	154	69%	0.69	76%	0.755	S	S	*	*			cis	-173	166.2	17.4	-123.5	-23	0	0	0	114.6
500	R	30.4	Very low	31.2	Very low	221 Å²	221	154.6 Å²	154.6	83%	0.834	76%	0.764	S	S	*	*			trans	81.1	147.1	144.8	-79.2	-179.5	176.4	175.9	-0.6	124.8
501	H	35.1	Very low	31.1	Very low	184 Å²	184	155.2 Å²	155.2	85%	0.852	77%	0.77	S	S	*	*			trans	-67.1	164.7	-169.6	-49.4	-85.3	0	0	0	120.4
502	R	25.4	Very low	30.8	Very low	247 Å²	247	153.8 Å²	153.8	93%	0.932	77%	0.77	S	S	*	*			trans	-149.9	164.7	131.8	-147.8	166.8	-176.7	161.5	0.6	112.2
503	R	29.5	Very low	30.5	Very low	228 Å²	228	158.3 Å²	158.3	86%	0.86	78%	0.78	S	S	*	*			trans	-117.3	152.8	173.8	-66	178.5	175.7	176.9	-2.1	110.4
504	H	28.2	Very low	30.3	Very low	178 Å²	178	153.4 Å²	153.4	82%	0.824	77%	0.773	S	S	*	*				-170.8	-165.3	128.3	-111.4	-68.8	0	0	0	113.9
505	T	30.8	Very low	30.2	Very low	115 Å²	115	157 Å²	157	71%	0.706	78%	0.777	S	S	*	*			trans	-151.3	133.3	-144.5	47.3	0	0	0	0	115.7
506	H	27.1	Very low	30.2	Very low	177 Å²	177	159.6 Å²	159.6	82%	0.819	78%	0.781	S	S	*	*			trans	-171.4	145	148.1	-130.9	36.4	0	0	0	109.1
507	S	27.3	Very low	30.2	Very low	87 Å²	87	159 Å²	159	61%	0.608	78%	0.778	S	S	*	*				55.8	139.5	73.6	-124.5	0	0	0	0	114.6
508	Q	30.2	Very low	30	Very low	162 Å²	162	161.7 Å²	161.7	76%	0.757	79%	0.789	S	S	*	*			cis	-152.2	-177.4	13.6	-167.8	160.7	-3	0	0	113
509	D	29.2	Very low	30.1	Very low	126 Å²	126	163.7 Å²	163.7	67%	0.674	80%	0.795	S	S	*	*			trans	-56.8	160.3	-176.4	-45.5	-81.6	0	0	0	118.4
510	T	32	Very low	29.9	Very low	156 Å²	156	168.5 Å²	168.5	96%	0.957	81%	0.808	S	S	*	*				-173.4	178.5	125.3	19.7	0	0	0	0	113.2
511	L	29.8	Very low	29.8	Very low	154 Å²	154	169.1 Å²	169.1	81%	0.806	81%	0.81	S	S	*	*			trans	-134.8	141	-152.7	-178	69.2	0	0	0	113.8
512	C	27.4	Very low	29.5	Very low	102 Å²	102	164.6 Å²	164.6	69%	0.689	80%	0.804	S	S	*	*			trans	40.5	136.3	159	-67.1	0	0	0	0	122.2
513	H	27.2	Very low	30.7	Very low	188 Å²	188	158.6 Å²	158.6	87%	0.87	80%	0.797	S	S	*	*				-159.1	155.7	125.8	-113.4	-75.6	0	0	0	113.2
514	T	30.4	Very low	31.7	Very low	115 Å²	115	153.3 Å²	153.3	71%	0.706	79%	0.793	S	S	*	*			trans	-114.3	150.2	-177.5	53.8	0	0	0	0	112.1
515	H	31.6	Very low	31.7	Very low	185 Å²	185	150.3 Å²	150.3	86%	0.856	79%	0.79	S	S	*	*			trans	-157	169.2	154	-96.4	-59.8	0	0	0	113.2
516	T	30.6	Very low	32.6	Very low	116 Å²	116	150.3 Å²	150.3	71%	0.712	79%	0.792	S	S	*	*			trans	-146.3	146.9	-160.3	59.3	0	0	0	0	115.5
517	K	35.9	Very low	32.8	Very low	186 Å²	186	145.9 Å²	145.9	81%	0.809	79%	0.786	S	S	*	*			trans	59.9	128.4	153.7	-65.3	170.6	180	174.6	0	119.8
518	N	27.4	Very low	33	Very low	170 Å²	170	149 Å²	149	91%	0.909	80%	0.796	S	S	*	*				-170	-173.4	106.2	-105.1	-30.9	0	0	0	114.8
519	K	33.3	Very low	32.9	Very low	191 Å²	191	144.2 Å²	144.2	83%	0.83	79%	0.79	S	S	*	*			trans	-156.5	137.6	-151.6	164.2	-171.1	177.7	-179.2	0	113.5
520	R	28.7	Very low	33.2	Very low	251 Å²	251	147.5 Å²	147.5	95%	0.947	80%	0.804	S	S	*	*			trans	168.1	175.6	152.3	-96.1	162.2	-167.8	-129.9	6.8	111.9
521	R	29.2	Very low	33.2	Very low	234 Å²	234	146 Å²	146	88%	0.883	79%	0.79	S	S	*	*				-168.4	122.7	-83.2	-179.5	-171.1	-165.5	-163.4	5.9	113.5
522	A	29.3	Very low	33.4	Very low	89 Å²	89	145.1 Å²	145.1	74%	0.736	79%	0.785	S	S	*	*			trans	60.9	176.7	156.1	0	0	0	0	0	117.3
523	P	49.8	Very low	33.6	Very low	120 Å²	120	145.8 Å²	145.8	78%	0.779	79%	0.791	S	S	*	*			cis	-112.9	-155.5	-1.8	45.3	-30.8	0	0	0	111.6
524	P	51.1	Low	34.1	Very low	118 Å²	118	145.5 Å²	145.5	77%	0.766	79%	0.79	S	S	*	*			cis	-129.1	-121	-3.5	41.4	-20	0	0	0	115.4
525	C	28	Very low	34.2	Very low	115 Å²	115	144.6 Å²	144.6	78%	0.777	79%	0.788	S	S	*	*			trans	-158.8	-178.9	-158.4	-67.5	0	0	0	0	110
526	P	48.8	Very low	34.2	Very low	115 Å²	115	143.6 Å²	143.6	75%	0.747	79%	0.788	S	S	*	*			cis	-111.4	-152.1	-3	33.8	-12.9	0	0	0	110.5
527	A	32.4	Very low	34.5	Very low	83 Å²	83	146.6 Å²	146.6	69%	0.686	80%	0.799	S	S	*	*			cis	-156.6	-155.9	7.7	0	0	0	0	0	111
528	D	30.8	Very low	34.1	Very low	153 Å²	153	147.4 Å²	147.4	82%	0.818	80%	0.803	S	S	*	*				-158.3	165.5	-92.2	-72.8	-45.9	0	0	0	107.7
529	G	28.6	Very low	34.2	Very low	62 Å²	62	143.6 Å²	143.6	64%	0.639	79%	0.794	S	S	*	*			cis	173	168.8	-4.8	0	0	0	0	0	111.2
530	M	36.3	Very low	33.9	Very low	195 Å²	195	142.3 Å²	142.3	96%	0.961	80%	0.796	S	S	*	*			trans	64.5	154.9	176.3	-69.5	-177.9	166.9	0	0	118.4
531	D	31.6	Very low	33.8	Very low	123 Å²	123	139.3 Å²	139.3	66%	0.658	79%	0.793	S	S	*	*			cis	-161.5	157.9	-37.1	-155.3	5.8	0	0	0	104.7
532	I	32.5	Very low	33.8	Very low	136 Å²	136	134 Å²	134	70%	0.697	79%	0.786	S	S	*	*				-161	117.7	65	-72.1	159.7	0	0	0	107.1
533	S	32.4	Very low	33.7	Very low	117 Å²	117	137.2 Å²	137.2	82%	0.818	79%	0.791	S	S	*	*	S	Bend	trans	-158.4	21.2	169.2	-79.4	0	0	0	0	114.4
534	Q	36.8	Very low	32.7	Very low	181 Å²	181	135.8 Å²	135.8	85%	0.846	78%	0.784	S	S	*	*			trans	-135.4	71.7	-179.9	-70	-170	61	0	0	111.8
535	S	32.5	Very low	31.4	Very low	96 Å²	96	137 Å²	137	67%	0.671	78%	0.784	S	S	*	*	S	Bend	trans	-141.8	7.4	-175.9	-43.4	0	0	0	0	115.6
536	L	32.5	Very low	31.4	Very low	164 Å²	164	136.9 Å²	136.9	86%	0.859	79%	0.785	S	S	*	*	S	Bend	trans	-149.8	16.5	-176.5	-119.9	165.8	0	0	0	116.6
537	L	36.7	Very low	30.5	Very low	180 Å²	180	137.1 Å²	137.1	94%	0.942	79%	0.786	S	S	*	*	S	Bend	trans	-140.4	47.6	168.5	-78.8	-179.3	0	0	0	111.6
538	K	28.1	Very low	31.1	Very low	203 Å²	203	137.7 Å²	137.7	88%	0.883	78%	0.783	S	S	*	*			trans	-148.3	52.2	170.9	-144.1	176.2	-174.6	-176	0	115.2
539	A	29.1	Very low	30.8	Very low	89 Å²	89	141.7 Å²	141.7	74%	0.736	79%	0.786	S	S	*	*			trans	-145.2	130.9	153.8	0	0	0	0	0	106
540	L	26.6	Very low	31.1	Very low	165 Å²	165	143.5 Å²	143.5	86%	0.864	79%	0.787	S	S	*	*			cis	-127.2	127.7	10.7	-67.4	156.9	0	0	0	111.2
541	E	27.2	Very low	30.5	Very low	188 Å²	188	139.1 Å²	139.1	88%	0.879	78%	0.776	S	S	*	*			trans	-137.3	113.9	153.4	-85.1	-171	148.3	0	0	106.9
542	T	29.6	Very low	30	Very low	122 Å²	122	139.9 Å²	139.9	75%	0.748	78%	0.779	S	S	*	*			trans	-155.9	108.7	168.1	-47.1	0	0	0	0	108
543	D	26.9	Very low	29.6	Very low	156 Å²	156	140.8 Å²	140.8	83%	0.834	78%	0.78	S	S	*	*			trans	28.8	152.3	148	-53.7	-21.4	0	0	0	121.7
544	S	28.8	Very low	29.1	Very low	91 Å²	91	141.3 Å²	141.3	64%	0.636	77%	0.772	S	S	*	*			cis	178.9	148.1	-18.4	171.7	0	0	0	0	106.5
545	D	24.1	Very low	28.4	Very low	143 Å²	143	138.8 Å²	138.8	77%	0.765	76%	0.764	S	S	*	*				162.7	149.4	124	-88.2	-2.5	0	0	0	117.5
546	S	26.7	Very low	28.1	Very low	113 Å²	113	141.2 Å²	141.2	79%	0.79	77%	0.768	S	S	*	*			trans	81	152.4	150.7	-68.3	0	0	0	0	122.5
547	P	30.2	Very low	27.7	Very low	120 Å²	120	140.6 Å²	140.6	78%	0.779	77%	0.766	S	S	*	*			trans	-135.1	-140.5	-158	35.3	-7.9	0	0	0	113.2
548	P	46	Very low	27.3	Very low	94 Å²	94	138.6 Å²	138.6	61%	0.61	76%	0.756	S	S	*	*				-130.8	174.1	-78.4	34.8	-16.5	0	0	0	117.8
549	W	22.8	Very low	27.2	Very low	237 Å²	237	138.8 Å²	138.8	90%	0.898	76%	0.757	S	S	*	*			trans	77	177	163.3	-56.7	113.4	0	0	0	118.2
550	P	35.9	Very low	27.1	Very low	101 Å²	101	137.9 Å²	137.9	66%	0.656	76%	0.756	S	S	*	*				-145.3	172.5	-65.5	45.4	-29.9	0	0	0	119.3
551	S	22.8	Very low	27	Very low	103 Å²	103	139.5 Å²	139.5	72%	0.72	76%	0.76	S	S	*	*			trans	63	129.1	133.1	-76.1	0	0	0	0	127.2
552	L	22.8	Very low	27	Very low	138 Å²	138	139 Å²	139	72%	0.723	76%	0.757	S	S	*	*			trans	87.2	135.3	134.8	-69	169.8	0	0	0	124.2
553	H	22.5	Very low	26.9	Very low	156 Å²	156	143.5 Å²	143.5	72%	0.722	77%	0.766	S	S	*	*			trans	66.1	154.8	146.2	-70.8	-39.4	0	0	0	119.4
554	I	23.2	Very low	26.9	Very low	127 Å²	127	144.1 Å²	144.1	65%	0.651	76%	0.764	S	S	*	*			cis	-161.2	155.5	-15.6	-122	168.3	0	0	0	111.5
555	N	22.3	Very low	26.6	Very low	128 Å²	128	147.5 Å²	147.5	68%	0.684	78%	0.775	S	S	*	*			trans	38.5	145.3	156	-65.5	-3.4	0	0	0	125.8
556	I	25.1	Very low	26.7	Very low	148 Å²	148	145.7 Å²	145.7	76%	0.759	77%	0.773	S	S	*	*			trans	71.8	142.9	137.2	-73.8	168.4	0	0	0	115.8
557	D	24.8	Very low	26.6	Very low	150 Å²	150	148.5 Å²	148.5	80%	0.802	77%	0.773	S	S	*	*			cis	-140.5	-179.5	37.7	-147.9	-15.5	0	0	0	115.7
558	N	27.9	Very low	26.5	Very low	139 Å²	139	152.3 Å²	152.3	74%	0.743	78%	0.778	S	S	*	*			trans	-127.8	119.9	-167.6	-171.1	17.1	0	0	0	112.8
559	K	26.2	Very low	25.5	Very low	206 Å²	206	152.6 Å²	152.6	90%	0.896	78%	0.782	S	S	*	*			trans	-178.1	138.1	166.7	-100.6	153.7	-174.9	175.4	0	108.4
560	G	27.3	Very low	25.7	Very low	70 Å²	70	149.2 Å²	149.2	72%	0.722	78%	0.781	S	S	*	*			cis	121.1	92.2	-7.6	0	0	0	0	0	113.3
561	E	24.7	Very low	25.4	Very low	200 Å²	200	153 Å²	153	94%	0.935	79%	0.789	S	S	*	*			trans	-158.7	136.4	161.8	-126.7	168.2	-165.3	0	0	111.4
562	E	27.3	Very low	25.8	Very low	178 Å²	178	153.3 Å²	153.3	83%	0.832	79%	0.789	S	S	*	*			trans	-110.2	147.1	172.8	-63.5	178.2	95.7	0	0	110.2
563	K	26	Very low	26.1	Very low	215 Å²	215	152.4 Å²	152.4	94%	0.935	79%	0.792	S	S	*	*				-166.7	165	127.6	-111.1	161.5	-174.1	170.9	0	115.4
564	Q	26.6	Very low	26.5	Very low	169 Å²	169	150.1 Å²	150.1	79%	0.79	80%	0.799	S	S	*	*			trans	-102.6	-170.1	-168.8	-56.4	172.4	-10.6	0	0	112.7
565	L	24.2	Very low	26.7	Very low	163 Å²	163	149.2 Å²	149.2	85%	0.853	80%	0.804	S	S	*	*			trans	103.6	138.3	164.7	-58.3	177.8	0	0	0	114.6
566	S	25	Very low	27.2	Very low	105 Å²	105	149.1 Å²	149.1	73%	0.734	81%	0.811	S	S	*	*			cis	-153.3	173.9	-6.5	-160	0	0	0	0	111.7
567	E	26.1	Very low	27.3	Very low	171 Å²	171	148.8 Å²	148.8	80%	0.799	82%	0.815	S	S	*	*			trans	-65.4	153.4	-178.8	-55.4	167.5	72.6	0	0	115.4
568	K	27	Very low	27.4	Very low	200 Å²	200	149.8 Å²	149.8	87%	0.87	82%	0.817	S	S	*	*				-170.4	128.1	107.2	-104.5	165.8	-175.9	174.1	0	116.5
569	S	24.6	Very low	27.4	Very low	101 Å²	101	150.7 Å²	150.7	71%	0.706	82%	0.821	S	S	*	*			trans	53.8	109.3	139.6	-171.8	0	0	0	0	120.9
570	L	26.9	Very low	27.6	Very low	166 Å²	166	146.4 Å²	146.4	87%	0.869	82%	0.815	S	S	*	*				-163.6	159.8	115.8	-100.8	166.6	0	0	0	110.2
571	H	29.8	Very low	28.1	Very low	180 Å²	180	150.7 Å²	150.7	83%	0.833	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-76.9	137.7	-167.2	-79.1	-96.9	0	0	0	115
572	P	31.5	Very low	28.4	Very low	109 Å²	109	148.8 Å²	148.8	71%	0.708	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-91.7	157.5	163.2	36.2	-33.1	0	0	0	112.7
573	P	29.9	Very low	28.5	Very low	120 Å²	120	148.8 Å²	148.8	78%	0.779	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-75.9	168.9	171.9	33.1	-35.6	0	0	0	112.9
574	A	29.3	Very low	28.7	Very low	107 Å²	107	146.3 Å²	146.3	88%	0.884	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-65.1	131.6	-171.1	0	0	0	0	0	114.2
575	S	28.7	Very low	29	Very low	108 Å²	108	142.2 Å²	142.2	76%	0.755	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-90.1	154.6	168.3	-64.4	0	0	0	0	111.3
576	P	32	Very low	29.5	Very low	126 Å²	126	140.4 Å²	140.4	82%	0.818	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-66.3	154.3	178.2	27.6	-34.8	0	0	0	112.9
577	V	27.9	Very low	29.9	Very low	141 Å²	141	140 Å²	140	86%	0.855	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-63.6	131.3	-173.3	175.8	0	0	0	0	112.1
578	M	25.5	Very low	30.5	Very low	172 Å²	172	134 Å²	134	85%	0.847	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-70.9	132.7	168.6	-67.6	-143.4	70.8	0	0	111.2
579	L	29.8	Very low	31.2	Very low	157 Å²	157	128.1 Å²	128.1	82%	0.822	72%	0.722	S	S	*	*	P	Polyproline II helix	trans	-74.1	144.6	174.1	-79.8	168	0	0	0	111.3	D581	L579-D581 PolarHBondContact O-N 2.93Å
580	P	30.3	Very low	31.9	Very low	117 Å²	117	126.7 Å²	126.7	76%	0.76	72%	0.717	S	S	*	*	P	Polyproline II helix	trans	-76.7	123.3	178.8	-14.4	30.1	0	0	0	113.1	H582	P580-H582 VanDerWaalsContact C-N 3.33Å; P580-H582 PolarHBondContact O-N 2.73Å
581	D	36	Very low	32.8	Very low	160 Å²	160	122.4 Å²	122.4	86%	0.856	69%	0.692	S	S	*	*	S	Bend	trans	-67.9	87.4	157.8	-87.6	-46.3	0	0	0	110	L579	L579-D581 PolarHBondContact O-N 2.93Å
582	H	31.3	Very low	33.4	Very low	159 Å²	159	117.6 Å²	117.6	74%	0.736	67%	0.671	S	S	*	*			trans	-174.2	92.1	153.7	-96.3	-53.8	0	0	0	112.5	P580	P580-H582 VanDerWaalsContact C-N 3.33Å; P580-H582 PolarHBondContact O-N 2.73Å
583	L	29.4	Very low	34	Very low	179 Å²	179	118 Å²	118	94%	0.937	66%	0.663	S	S	*	*			trans	-124.3	62.2	163.5	-76.7	175.3	0	0	0	111.5
584	K	30	Very low	34.7	Very low	162 Å²	162	116 Å²	116	70%	0.704	66%	0.657	S	S	*	*			trans	-87.3	140	164.1	-67.7	-169.5	176.3	-171.5	0	109.5	N586	K584-N586 PolarHBondContact O-N 3.33Å
585	C	33.5	Very low	35.3	Very low	83 Å²	83	114.4 Å²	114.4	56%	0.561	64%	0.644	S	S	*	*			trans	-73.7	64.1	-176.7	-76.6	0	0	0	0	113.5	I587	C585-I587 PolarHBondContact O-N 2.9Å; C585-I587 VanDerWaalsContact O-N 3.14Å
586	N	34.7	Very low	35.7	Very low	125 Å²	125	117.7 Å²	117.7	67%	0.668	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.1	5.1	-175.5	-73.5	-6.8	0	0	0	115.5	K584	K584-N586 PolarHBondContact O-N 3.33Å
587	I	34.1	Very low	36.1	Very low	98 Å²	98	123 Å²	123	50%	0.503	65%	0.648	S	S	.	*	T	Hydrogen-bonded Turn	trans	-102.2	-2.4	-173.4	-27	175.4	0	0	0	112.6	C585 K757	C585-I587 PolarHBondContact O-N 2.9Å; C585-I587 VanDerWaalsContact O-N 3.14Å; I587-K757 HydrophobicContact CB-CD 3.67Å; I587-K757 HydrophobicContact CB-CG 4.49Å; I587-K757 HydrophobicContact CG2-CD 3.81Å; I587-K757 WeakPolarHBondContact O-CD 3.46Å; I587-K757 PolarHBondContact O-NZ 3.06Å
588	L	38.4	Very low	36.7	Very low	43 Å²	43	124.9 Å²	124.9	23%	0.225	65%	0.645	C	S	.	*	S	Bend	trans	-76.4	-40.5	170.8	-76.1	161.1	0	0	0	110.4	A590 Q591 E761	L588-A590 VanDerWaalsContact C-N 3.26Å; L588-A590 PolarHBondContact O-N 2.99Å; L588-Q591 PolarHBondContact O-N 3.37Å; L588-E761 HydrophobicContact CD2-CG 4.46Å
589	K	42	Very low	36.9	Very low	78 Å²	78	124.4 Å²	124.4	34%	0.339	65%	0.646	S	S	.	*	H	α-helix	trans	-40.7	-48.4	178	-161.1	164.5	-160.3	156.5	0	115.4	D313 Q591 M592	D313-K589 HydrophobicContact CB-CB 3.52Å; D313-K589 HydrophobicContact CB-CD 3.78Å; D313-K589 HydrophobicContact CB-CG 3.51Å; D313-K589 VanDerWaalsContact CG-CB 3.46Å; D313-K589 WeakPolarHBondContact O-CE 3.33Å; D313-K589 PolarHBondContact O-NZ 2.79Å; D313-K589 WeakPolarHBondContact OD1-CA 3.17Å; D313-K589 WeakPolarHBondContact OD1-CB 3.29Å; D313-K589 PolarHBondContact OD1-N 3.39Å; D313-K589 WeakPolarHBondContact OD2-CA 3.45Å; D313-K589 PolarHBondContact OD2-N 3.24Å; K589-Q591 PolarHBondContact O-N 3.17Å; K589-Q591 VanDerWaalsContact O-N 3.14Å; K589-M592 PolarHBondContact O-N 2.82Å
590	A	39.9	Very low	36.9	Very low	71 Å²	71	121.3 Å²	121.3	59%	0.587	64%	0.643	S	S	*	*	H	α-helix	trans	-62.5	-24.9	-167.2	0	0	0	0	0	113.7	L588	L588-A590 VanDerWaalsContact C-N 3.26Å; L588-A590 PolarHBondContact O-N 2.99Å
591	Q	44.9	Very low	37.1	Very low	76 Å²	76	122 Å²	122	36%	0.355	65%	0.648	S	S	.	*	H	α-helix	trans	-97.8	-17.5	-178.1	-59.1	-156.7	20.9	0	0	113.6	L588 K589 E761	L588-Q591 PolarHBondContact O-N 3.37Å; K589-Q591 PolarHBondContact O-N 3.17Å; K589-Q591 VanDerWaalsContact O-N 3.14Å; Q591-E761 WeakPolarHBondContact CB-OE1 3.48Å; Q591-E761 VanDerWaalsContact CD-OE2 3.28Å; Q591-E761 PolarHBondContact OE1-OE1 2.98Å; Q591-E761 PolarHBondContact OE1-OE2 2.82Å
592	M	42.7	Very low	36.9	Very low	78 Å²	78	122.5 Å²	122.5	38%	0.384	65%	0.65	S	S	.	*	H	α-helix	trans	-77.1	-39.8	176	-163.3	175.8	80.8	0	0	112.5	K589 A594 A595	K589-M592 PolarHBondContact O-N 2.82Å; M592-A594 VanDerWaalsContact C-N 3.26Å; M592-A594 PolarHBondContact O-N 2.76Å; M592-A595 PolarHBondContact O-N 2.85Å
593	E	43.5	Very low	37	Very low	117 Å²	117	121.4 Å²	121.4	55%	0.547	65%	0.654	S	S	.	*	H	α-helix	trans	-69.4	-22.2	-179.9	-69.4	-170.4	150.7	0	0	113.5
594	A	44.1	Very low	37.3	Very low	79 Å²	79	118.9 Å²	118.9	65%	0.653	65%	0.649	S	S	*	*	H	α-helix	trans	-70.4	-29.2	176.3	0	0	0	0	0	113.2	M592	M592-A594 VanDerWaalsContact C-N 3.26Å; M592-A594 PolarHBondContact O-N 2.76Å
595	A	42.1	Very low	37.2	Very low	73 Å²	73	123.4 Å²	123.4	60%	0.603	66%	0.661	S	S	*	*	H	α-helix	trans	-79	-34.5	-177.7	0	0	0	0	0	113.1	M592 R597	M592-A595 PolarHBondContact O-N 2.85Å; A595-R597 VanDerWaalsContact C-N 3.31Å; A595-R597 PolarHBondContact O-N 3.44Å
596	F	38.2	Very low	36.8	Very low	178 Å²	178	122.7 Å²	122.7	78%	0.781	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.8	19.1	-172.9	-89	-80.4	0	0	0	115.4
597	R	40.1	Very low	36.6	Very low	236 Å²	236	128.9 Å²	128.9	89%	0.891	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.4	17.7	173.8	-80.6	-163.6	174.7	-134.1	2	114.9	A595	A595-R597 VanDerWaalsContact C-N 3.31Å; A595-R597 PolarHBondContact O-N 3.44Å
598	K	39.8	Very low	36.2	Very low	181 Å²	181	128.9 Å²	128.9	79%	0.787	69%	0.691	S	S	*	*	S	Bend	trans	-115	145.4	160.2	-77.4	-172.2	173.6	-177.4	0	110.8
599	D	29.3	Very low	35.6	Very low	162 Å²	162	131 Å²	131	87%	0.866	71%	0.709	S	S	*	*			trans	76.9	72.1	170.2	-53.2	-13.3	0	0	0	117.8
600	A	31.8	Very low	34.9	Very low	93 Å²	93	133.9 Å²	133.9	77%	0.769	73%	0.728	S	S	*	*			trans	-118.3	116.6	151.1	0	0	0	0	0	109
601	P	33.1	Very low	34.3	Very low	131 Å²	131	136.1 Å²	136.1	85%	0.851	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-72.2	129.3	-174	-20.8	33.4	0	0	0	114.1
602	L	32.9	Very low	33.5	Very low	171 Å²	171	138 Å²	138	90%	0.895	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-86.2	136.4	167.3	-76	167.6	0	0	0	110.9
603	T	32.9	Very low	32.7	Very low	136 Å²	136	139.3 Å²	139.3	83%	0.834	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-94.1	124.1	177.2	43.8	0	0	0	0	111.7
604	P	34.8	Very low	31.9	Very low	126 Å²	126	138.7 Å²	138.7	82%	0.818	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-86.3	136.9	176.4	32.6	-32.7	0	0	0	111.7
605	R	28.1	Very low	31	Very low	256 Å²	256	140.1 Å²	140.1	97%	0.966	77%	0.769	S	S	*	*			trans	-128.7	67.7	-177.4	-157.8	-171.6	-167.6	-161.7	5.6	114.9
606	G	26.3	Very low	30.4	Very low	69 Å²	69	145.2 Å²	145.2	71%	0.711	77%	0.773	S	S	*	*			trans	91.6	144.2	140.7	0	0	0	0	0	120.3
607	R	29.3	Very low	29.8	Very low	255 Å²	255	145.1 Å²	145.1	96%	0.962	77%	0.769	S	S	*	*			trans	70.6	144.4	164.5	-71.4	-178.3	175.1	-176	-2.6	116.7
608	S	25.1	Very low	29.3	Very low	98 Å²	98	141.5 Å²	141.5	69%	0.685	76%	0.762	S	S	*	*			cis	-148.6	169.9	3.1	56	0	0	0	0	114.1
609	S	26.8	Very low	28.5	Very low	87 Å²	87	137.4 Å²	137.4	61%	0.608	76%	0.756	S	S	*	*			trans	64.7	120.9	141.3	55.3	0	0	0	0	121.6
610	N	27.1	Very low	28.5	Very low	138 Å²	138	134.2 Å²	134.2	74%	0.738	75%	0.746	S	S	*	*			trans	74.3	149.5	140.4	-66.3	47.9	0	0	0	117.9
611	D	27.4	Very low	28.5	Very low	119 Å²	119	133.8 Å²	133.8	64%	0.636	74%	0.738	S	S	*	*			cis	-154.3	158.8	2.2	-127	-31.2	0	0	0	115.6
612	T	28.2	Very low	28.5	Very low	115 Å²	115	135.2 Å²	135.2	71%	0.706	73%	0.733	S	S	*	*			trans	54.3	154.1	152.8	54.4	0	0	0	0	125.4
613	S	26.2	Very low	28.2	Very low	106 Å²	106	132.5 Å²	132.5	74%	0.741	72%	0.719	S	S	*	*			trans	71.9	114.6	160.5	62.2	0	0	0	0	117.4
614	S	25.4	Very low	28.2	Very low	103 Å²	103	131.1 Å²	131.1	72%	0.72	72%	0.715	S	S	*	*				71.2	138.8	82.1	-86.9	0	0	0	0	112.8
615	D	26.6	Very low	28.1	Very low	109 Å²	109	129.6 Å²	129.6	58%	0.583	71%	0.713	S	S	*	*			cis	-160.2	168.9	12.2	-111.8	-19.7	0	0	0	106.5
616	R	28.3	Very low	28.1	Very low	180 Å²	180	121.3 Å²	121.3	68%	0.679	70%	0.7	S	S	*	*			cis	174.3	159.4	-11.2	-149.5	-172.2	-68.7	179.1	2.3	104.5
617	Y	27.2	Very low	28.3	Very low	177 Å²	177	123.6 Å²	123.6	69%	0.694	71%	0.705	S	S	*	*			trans	68.1	125.5	172.3	-74	-99.5	0	0	0	116.2
618	Q	27.7	Very low	28.4	Very low	160 Å²	160	116.4 Å²	116.4	75%	0.748	69%	0.694	S	S	*	*				70.7	143.9	71.7	-68.1	-172.8	2	0	0	113.4
619	S	24.7	Very low	28.6	Very low	95 Å²	95	117.2 Å²	117.2	66%	0.664	69%	0.694	S	S	*	*			cis	-152.9	176.1	11.1	-149.3	0	0	0	0	114.7
620	S	29.6	Very low	28.7	Very low	95 Å²	95	119.7 Å²	119.7	66%	0.664	71%	0.706	S	S	*	*			trans	-11.4	160.5	143.2	68.1	0	0	0	0	118.8
621	S	31	Very low	28.9	Very low	84 Å²	84	117.4 Å²	117.4	59%	0.587	71%	0.706	S	S	*	*			cis	-173.7	162.3	22.6	-138.8	0	0	0	0	113
622	Q	32.1	Very low	28.8	Very low	161 Å²	161	118.9 Å²	118.9	75%	0.752	71%	0.709	S	S	*	*			trans	61.4	160.6	141.1	-74	166.1	-89.9	0	0	120.2
623	D	26.6	Very low	28.9	Very low	113 Å²	113	121.4 Å²	121.4	60%	0.604	71%	0.71	S	S	*	*			cis	-150.8	168.7	-3.7	-134.8	-51.3	0	0	0	113.2
624	S	34.6	Very low	29.1	Very low	108 Å²	108	122.2 Å²	122.2	76%	0.755	71%	0.711	S	S	*	*			trans	26.9	148.4	141.9	-70.7	0	0	0	0	122.5
625	A	31.2	Very low	29.8	Very low	93 Å²	93	122.5 Å²	122.5	77%	0.769	71%	0.71	S	S	*	*			cis	-164.2	-174.2	-5.4	0	0	0	0	0	107.5
626	A	29.2	Very low	29.8	Very low	83 Å²	83	127.2 Å²	127.2	69%	0.686	72%	0.72	S	S	*	*			cis	-159.7	161.3	15.2	0	0	0	0	0	112.7
627	S	30.3	Very low	29.7	Very low	117 Å²	117	127.2 Å²	127.2	82%	0.818	72%	0.72	S	S	*	*			trans	40.6	142.2	139.6	-54	0	0	0	0	121.6
628	S	30.8	Very low	29.7	Very low	104 Å²	104	125 Å²	125	73%	0.727	72%	0.716	S	S	*	*			cis	179.5	-170.8	-2.3	46.2	0	0	0	0	106.8
629	V	30.1	Very low	29.7	Very low	115 Å²	115	123.4 Å²	123.4	70%	0.697	71%	0.712	S	S	*	*			cis	-154.2	158.1	9.3	-158.9	0	0	0	0	108.2
630	T	29	Very low	29.9	Very low	138 Å²	138	129.6 Å²	129.6	85%	0.847	72%	0.721	S	S	*	*			trans	62.4	148.9	160.5	36.7	0	0	0	0	119.5
631	A	29.9	Very low	29.7	Very low	91 Å²	91	129.3 Å²	129.3	75%	0.752	72%	0.72	S	S	*	*			cis	-152.2	173.5	-7	0	0	0	0	0	111.8
632	E	26.8	Very low	29.7	Very low	150 Å²	150	132.9 Å²	132.9	70%	0.701	73%	0.731	S	S	*	*			trans	-50.9	167.4	168.3	-63.1	-171.6	97.2	0	0	114.4
633	K	29.1	Very low	29.7	Very low	167 Å²	167	131.1 Å²	131.1	73%	0.726	73%	0.731	S	S	*	*			cis	-160.9	143.6	33.8	-145.1	136.1	-169.5	151.6	0	114.1
634	T	31.1	Very low	30.5	Very low	123 Å²	123	131.4 Å²	131.4	76%	0.755	74%	0.739	S	S	*	*			trans	-101.3	160.5	158.6	-19.9	0	0	0	0	108.7
635	P	41	Very low	30.1	Very low	109 Å²	109	135.7 Å²	135.7	71%	0.708	75%	0.748	S	S	*	*				-152.2	162	91.3	41	-23.6	0	0	0	116.6
636	R	25.6	Very low	30.1	Very low	209 Å²	209	140.3 Å²	140.3	79%	0.789	75%	0.751	S	S	*	*			trans	31.6	148.1	130.2	-60.2	179.9	168.3	-161.6	-0.2	119.9
637	R	26	Very low	29.9	Very low	179 Å²	179	143.6 Å²	143.6	68%	0.675	76%	0.756	S	S	*	*			cis	-175.5	158.3	4.5	-120.3	172.3	157.9	-143.8	9.7	108.8
638	Q	27.2	Very low	29.7	Very low	132 Å²	132	146.1 Å²	146.1	62%	0.617	76%	0.755	S	S	*	*			trans	63.8	158.4	148.9	-67.5	175.9	-91.4	0	0	117.3
639	D	26.9	Very low	29.7	Very low	125 Å²	125	145.7 Å²	145.7	67%	0.668	76%	0.757	S	S	*	*			cis	-156.6	168.6	-15.5	-110.8	-30.3	0	0	0	110.5
640	R	29.4	Very low	29.5	Very low	225 Å²	225	150.6 Å²	150.6	85%	0.849	77%	0.769	S	S	*	*			trans	55.9	99	155.5	-78.4	-177.1	162.4	-173.4	-5.7	122.2
641	S	26.8	Very low	29.3	Very low	90 Å²	90	147.7 Å²	147.7	63%	0.629	77%	0.767	S	S	*	*				45.2	139.7	106.3	72	0	0	0	0	123.8
642	L	29.7	Very low	29.5	Very low	158 Å²	158	151.1 Å²	151.1	83%	0.827	77%	0.772	S	S	*	*			trans	73.6	145.3	163	-51	170.5	0	0	0	115.4
643	T	31.7	Very low	30	Very low	124 Å²	124	149.4 Å²	149.4	76%	0.761	78%	0.775	S	S	*	*			cis	-154.1	167.9	-12.1	8.3	0	0	0	0	108.4
644	P	43.3	Very low	30	Very low	119 Å²	119	146.4 Å²	146.4	77%	0.773	78%	0.775	S	S	*	*			trans	-93.4	151.5	-165.1	36.2	-35.4	0	0	0	115.4
645	E	27.9	Very low	29.9	Very low	198 Å²	198	146.2 Å²	146.2	93%	0.925	78%	0.778	S	S	*	*			trans	-148	179.4	140.3	-129.8	-177.1	162.7	0	0	112.3
646	K	30.1	Very low	29.3	Very low	191 Å²	191	148.2 Å²	148.2	83%	0.83	78%	0.783	S	S	*	*			trans	-147.4	129.7	-146.4	164.2	-167	176.2	-174.1	0	111.6
647	L	25.7	Very low	29.6	Very low	152 Å²	152	149.9 Å²	149.9	80%	0.796	79%	0.789	S	S	*	*			trans	-170.8	137.3	152.2	-102.8	165.5	0	0	0	114.3
648	Q	26.7	Very low	29.8	Very low	170 Å²	170	153.2 Å²	153.2	79%	0.794	80%	0.802	S	S	*	*			trans	43.9	101.4	153	-69.5	179	42.7	0	0	124.2
649	A	30	Very low	29.9	Very low	94 Å²	94	157 Å²	157	78%	0.777	82%	0.816	S	S	*	*				44.2	113.1	114.3	0	0	0	0	0	123.2
650	K	26.1	Very low	30.1	Very low	218 Å²	218	161 Å²	161	95%	0.948	82%	0.822	S	S	*	*				-179.2	153.4	125.1	-102.3	166.5	-176.5	174.1	0	111.4
651	G	24.8	Very low	30.1	Very low	78 Å²	78	156.1 Å²	156.1	80%	0.804	81%	0.812	S	S	*	*			trans	124.9	106.5	162	0	0	0	0	0	117.3
652	N	32.8	Very low	30.3	Very low	162 Å²	162	155.8 Å²	155.8	87%	0.866	81%	0.806	S	S	*	*			trans	-83.5	167.5	160.2	-101.1	-31.3	0	0	0	109.2
653	P	38.5	Very low	31.1	Very low	115 Å²	115	153.7 Å²	153.7	75%	0.747	79%	0.787	S	S	*	*			cis	-151.9	167.5	38.5	42.9	-22.1	0	0	0	120.4
654	S	29.7	Very low	31.5	Very low	104 Å²	104	155.4 Å²	155.4	73%	0.727	79%	0.786	S	S	*	*			trans	52.1	116.3	139.4	-167.7	0	0	0	0	121.9
655	S	27.7	Very low	31.5	Very low	118 Å²	118	151.3 Å²	151.3	83%	0.825	76%	0.756	S	S	*	*				-152.2	156.7	118.6	67.4	0	0	0	0	112
656	N	29.3	Very low	32.2	Very low	152 Å²	152	144.3 Å²	144.3	81%	0.813	73%	0.729	S	S	*	*			trans	-92	128.1	-175.4	-90.4	-69	0	0	0	112.9
657	R	30.9	Very low	33.3	Very low	244 Å²	244	136.3 Å²	136.3	92%	0.921	70%	0.695	S	S	*	*			trans	-130.4	128.5	146.7	-79.6	-166.7	169.5	-173.1	-2.9	111.2	K659	R657-K659 PolarHBondContact O-N 3.43Å
658	R	29.8	Very low	33.9	Very low	248 Å²	248	133.4 Å²	133.4	94%	0.936	68%	0.68	S	S	*	*			trans	-67.4	110	-164.5	-66.8	168.7	170.5	159.8	-6	112.5	R660	R658-R660 PolarHBondContact O-N 3.12Å; R658-R660 VanDerWaalsContact O-N 3.16Å
659	K	30.2	Very low	34.8	Very low	211 Å²	211	130.4 Å²	130.4	92%	0.917	67%	0.666	S	S	*	*			trans	-70.3	105.5	162.1	-70.7	-172.2	178.4	-177	0	109.1	R657	R657-K659 PolarHBondContact O-N 3.43Å
660	R	32	Very low	35.3	Very low	210 Å²	210	132.5 Å²	132.5	79%	0.792	66%	0.659	S	S	*	*			trans	-73.7	123.9	-179.6	-167.6	177.3	-166.3	158.1	7.1	109.4	R658 V662	R658-R660 PolarHBondContact O-N 3.12Å; R658-R660 VanDerWaalsContact O-N 3.16Å; R660-V662 PolarHBondContact O-N 3.16Å
661	L	27.7	Very low	36	Very low	123 Å²	123	128 Å²	128	64%	0.644	65%	0.646	S	S	*	*			trans	-64.7	106.4	-175.9	-162.9	73.6	0	0	0	111	L364	L364-L661 WeakPolarHBondContact O-CD2 3.23Å
662	V	32.5	Very low	36.9	Very low	83 Å²	83	127.9 Å²	127.9	50%	0.503	62%	0.624	S	S	.	*			trans	-86.2	144.4	170.5	179.9	0	0	0	0	108.3	R660 Q664	R660-V662 PolarHBondContact O-N 3.16Å; V662-Q664 HydrophobicContact CG1-CG 4.08Å
663	R	46.5	Very low	37.1	Very low	114 Å²	114	126.3 Å²	126.3	43%	0.43	62%	0.616	S	S	.	*			trans	-88.9	131.7	169.9	-62.1	176.9	-168.9	126.8	6.3	106.7	D298 F299	D298-R663 VanDerWaalsContact OD1-C 3.29Å; D298-R663 VanDerWaalsContact OD1-O 3.05Å; F299-R663 VanDerWaalsContact CE2-NH1 3.33Å; F299-R663 VanDerWaalsContact CZ-NH1 3.26Å
664	Q	38.9	Very low	37.1	Very low	159 Å²	159	128 Å²	128	74%	0.743	62%	0.619	S	S	*	*			trans	-134.5	127.1	179.3	-67	-176.3	-80.3	0	0	108.8	D298 V662	D298-Q664 WeakPolarHBondContact OD1-CA 3.37Å; D298-Q664 PolarHBondContact OD1-N 3.43Å; D298-Q664 VanDerWaalsContact OD2-CA 3.3Å; D298-Q664 WeakPolarHBondContact OD2-CA 3.45Å; V662-Q664 HydrophobicContact CG1-CG 4.08Å
665	F	42.8	Very low	37.3	Very low	33 Å²	33	127.6 Å²	127.6	15%	0.145	61%	0.608	C	S	.	*			trans	-127.2	102	167	-147.2	-75.3	0	0	0	108	D298 W336 R369 F667	D298-F665 PolarHBondContact OD1-N 3.38Å; D298-F665 PolarHBondContact OD2-N 3.27Å; D298-F665 VanDerWaalsContact OD2-N 3.15Å; W336-F665 HydrophobicContact CZ2-CD2 4.49Å; R369-F665 HydrophobicContact CG-CE2 4.15Å; R369-F665 HydrophobicContact CG-CZ 4.38Å; F665-F667 HydrophobicContact CD1-CD1 4.01Å; F665-F667 AromaticContact CD1-CE1 3.58Å; F665-F667 HydrophobicContact CD1-CE1 3.58Å; F665-F667 HydrophobicContact CD1-CZ 4.23Å; F665-F667 HydrophobicContact CE1-CD1 4.03Å; F665-F667 AromaticContact CE1-CE1 3.67Å; F665-F667 HydrophobicContact CE1-CE1 3.67Å
666	S	43.4	Very low	37.6	Very low	51 Å²	51	126.9 Å²	126.9	36%	0.357	60%	0.6	S	S	.	*	B	Isolated β-bridge	trans	-97.5	135.4	174	-150.4	0	0	0	0	108.3	R296	R296-S666 PolarHBondContact NE-OG 2.97Å
667	F	53.6	Low	37.8	Very low	24 Å²	24	128 Å²	128	11%	0.105	60%	0.601	C	S	.	*			trans	-88.1	114.8	168.5	-53.5	-60.6	0	0	0	107.5	I294 T295 L297 H343 F665	I294-F667 HydrophobicContact CG2-CE2 4.33Å; T295-F667 VanDerWaalsContact O-CD2 3.22Å; T295-F667 WeakPolarHBondContact O-CD2 3.45Å; T295-F667 PolarHBondContact O-N 2.78Å; T295-F667 VanDerWaalsContact O-N 3.09Å; L297-F667 HydrophobicContact CB-CE2 4.44Å; H343-F667 AromaticContact CD2-CE2 3.8Å; H343-F667 AromaticContact CD2-CZ 3.97Å; H343-F667 AromaticContact CE1-CD1 3.32Å; H343-F667 WeakPolarHBondContact CE1-CD1 3.47Å; H343-F667 AromaticContact CE1-CD2 3.59Å; H343-F667 AromaticContact CE1-CE1 3.36Å; H343-F667 WeakPolarHBondContact CE1-CE1 3.48Å; H343-F667 AromaticContact CE1-CE2 3.65Å; H343-F667 AromaticContact CE1-CG 3.44Å; H343-F667 VanDerWaalsContact CE1-CG 3.44Å; H343-F667 WeakPolarHBondContact CE1-CG 3.37Å; H343-F667 AromaticContact CE1-CZ 3.54Å; H343-F667 AromaticContact CG-CZ 3.9Å; H343-F667 AromaticContact ND1-CD1 3.9Å; H343-F667 AromaticContact ND1-CE1 3.49Å; H343-F667 WeakPolarHBondContact ND1-CE1 3.39Å; H343-F667 AromaticContact ND1-CZ 3.63Å; H343-F667 AromaticContact NE2-CD2 3.38Å; H343-F667 WeakPolarHBondContact NE2-CD2 3.49Å; H343-F667 AromaticContact NE2-CE2 3.42Å; H343-F667 WeakPolarHBondContact NE2-CE2 3.22Å; H343-F667 AromaticContact NE2-CG 3.7Å; H343-F667 AromaticContact NE2-CZ 3.75Å; F665-F667 HydrophobicContact CD1-CD1 4.01Å; F665-F667 AromaticContact CD1-CE1 3.58Å; F665-F667 HydrophobicContact CD1-CE1 3.58Å; F665-F667 HydrophobicContact CD1-CZ 4.23Å; F665-F667 HydrophobicContact CE1-CD1 4.03Å; F665-F667 AromaticContact CE1-CE1 3.67Å; F665-F667 HydrophobicContact CE1-CE1 3.67Å
668	N	38.6	Very low	37.9	Very low	90 Å²	90	120.8 Å²	120.8	48%	0.481	59%	0.593	S	S	.	*			trans	-82	144.2	174.6	-74.9	30.4	0	0	0	109	E670	N668-E670 PolarHBondContact ND2-OE2 3.34Å
669	H	46	Very low	38.2	Very low	108 Å²	108	115.2 Å²	115.2	50%	0.5	58%	0.581	S	S	.	*	G	3₁₀ helix	trans	-80.6	-18.8	174.1	-77.9	-114.2	0	0	0	112.8	D671 E672	H669-D671 PolarHBondContact O-N 3.49Å; H669-E672 WeakPolarHBondContact O-CB 3.32Å; H669-E672 PolarHBondContact O-N 2.95Å
670	E	39.1	Very low	38.4	Very low	137 Å²	137	108.6 Å²	108.6	64%	0.64	57%	0.566	S	S	*	*	G	3₁₀ helix	trans	-60.1	-15.3	-177	-56	168.4	126.1	0	0	115.1	N668 E672	N668-E670 PolarHBondContact ND2-OE2 3.34Å; E670-E672 VanDerWaalsContact C-N 3.3Å
671	D	41.4	Very low	38.5	Very low	124 Å²	124	102.8 Å²	102.8	66%	0.663	56%	0.563	S	S	*	*	G	3₁₀ helix	trans	-79.5	-8.5	175.9	-78.1	-39.2	0	0	0	112.7	H669	H669-D671 PolarHBondContact O-N 3.49Å
672	E	43.3	Very low	38.7	Very low	76 Å²	76	104.2 Å²	104.2	36%	0.355	57%	0.57	S	S	.	*	S	Bend	trans	-86.1	-33.8	178	-64.9	-71.9	132.1	0	0	113.5	H669 E670 N674	H669-E672 WeakPolarHBondContact O-CB 3.32Å; H669-E672 PolarHBondContact O-N 2.95Å; E670-E672 VanDerWaalsContact C-N 3.3Å; E672-N674 PolarHBondContact O-N 2.9Å
673	D	38.4	Very low	38.6	Very low	129 Å²	129	105.9 Å²	105.9	69%	0.69	59%	0.585	S	S	*	*			trans	-72.9	6.6	-161	-66	-48.4	0	0	0	116.3	L675	D673-L675 PolarHBondContact O-N 3.26Å
674	N	37.5	Very low	37.9	Very low	150 Å²	150	105 Å²	105	80%	0.802	60%	0.596	S	S	*	*			trans	-101	65.2	178.3	-79.4	-99.2	0	0	0	112	E672	E672-N674 PolarHBondContact O-N 2.9Å
675	L	34.5	Very low	37.5	Very low	95 Å²	95	106.7 Å²	106.7	50%	0.497	60%	0.604	S	S	.	*			trans	-102.6	127.8	169.3	-94.5	154.6	0	0	0	110.4	D673	D673-L675 PolarHBondContact O-N 3.26Å
676	P	32.4	Very low	36.7	Very low	103 Å²	103	110.9 Å²	110.9	67%	0.669	64%	0.637	S	S	*	*			trans	-61	138.6	165.9	-22.4	34.3	0	0	0	111.2	A678	P676-A678 PolarHBondContact O-N 2.72Å
677	E	35.3	Very low	36	Very low	176 Å²	176	113.7 Å²	113.7	82%	0.822	66%	0.664	S	S	*	*	G	3₁₀ helix	trans	-56.6	-22.4	-170.5	-164.2	169.7	-174.8	0	0	114.7	L679 A680	E677-L679 PolarHBondContact O-N 3.18Å; E677-A680 PolarHBondContact O-N 3.38Å; E677-A680 VanDerWaalsContact O-N 3.14Å
678	A	32	Very low	34.8	Very low	93 Å²	93	116 Å²	116	77%	0.769	69%	0.694	S	S	*	*	G	3₁₀ helix	trans	-63.3	-1.5	-176.4	0	0	0	0	0	116.6	P676	P676-A678 PolarHBondContact O-N 2.72Å
679	L	35.9	Very low	34.4	Very low	131 Å²	131	121.3 Å²	121.3	69%	0.686	71%	0.713	S	S	*	*	G	3₁₀ helix	trans	-121.5	1.2	175	-69.3	177	0	0	0	114.5	E677 A681	E677-L679 PolarHBondContact O-N 3.18Å; L679-A681 VanDerWaalsContact C-N 3.25Å; L679-A681 PolarHBondContact O-N 2.97Å
680	A	35.4	Very low	33.5	Very low	71 Å²	71	122.1 Å²	122.1	59%	0.587	73%	0.731	S	S	*	*	S	Bend	trans	-73.7	-17.9	173.9	0	0	0	0	0	113.1	E677 I682	E677-A680 PolarHBondContact O-N 3.38Å; E677-A680 VanDerWaalsContact O-N 3.14Å; A680-I682 VanDerWaalsContact C-N 3.34Å; A680-I682 PolarHBondContact O-N 3.02Å
681	A	32.9	Very low	32.9	Very low	88 Å²	88	119 Å²	119	73%	0.727	74%	0.735	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.7	29.4	-165.9	0	0	0	0	0	115.9	L679	L679-A681 VanDerWaalsContact C-N 3.25Å; L679-A681 PolarHBondContact O-N 2.97Å
682	I	33.5	Very low	32.3	Very low	154 Å²	154	118.3 Å²	118.3	79%	0.79	74%	0.74	S	S	*	*	T	Hydrogen-bonded Turn	trans	-135.7	15.9	176.3	-24.3	179.1	0	0	0	113.8	A680	A680-I682 VanDerWaalsContact C-N 3.34Å; A680-I682 PolarHBondContact O-N 3.02Å
683	S	30.1	Very low	31.5	Very low	118 Å²	118	119.7 Å²	119.7	83%	0.825	76%	0.758	S	S	*	*	S	Bend	trans	-139.8	28.9	-176.7	-166.7	0	0	0	0	114.7
684	S	30.8	Very low	31	Very low	94 Å²	94	119 Å²	119	66%	0.657	76%	0.763	S	S	*	*			trans	-147.7	58.5	-171.2	48.5	0	0	0	0	113.9
685	Q	29.7	Very low	30.6	Very low	196 Å²	196	116.5 Å²	116.5	92%	0.916	76%	0.758	S	S	*	*			trans	-153.3	84.7	169	-127.7	174.7	100.3	0	0	115
686	S	27.7	Very low	30.4	Very low	121 Å²	121	119.1 Å²	119.1	85%	0.846	77%	0.772	S	S	*	*			trans	-177.9	155.4	141.2	43.9	0	0	0	0	111
687	A	28.7	Very low	30.2	Very low	110 Å²	110	118.9 Å²	118.9	91%	0.909	77%	0.765	S	S	*	*			trans	59.6	108.3	-176	0	0	0	0	0	116.4
688	G	27.8	Very low	30	Very low	72 Å²	72	118.1 Å²	118.1	74%	0.742	76%	0.758	S	S	*	*			cis	161.1	-162.2	-4.6	0	0	0	0	0	113.7
689	K	30.6	Very low	29.7	Very low	201 Å²	201	121.2 Å²	121.2	87%	0.874	76%	0.757	S	S	*	*			trans	81.2	99.8	173.6	-62.8	-177.4	176.6	177.3	0	119.2
690	S	26.7	Very low	29.4	Very low	126 Å²	126	121.9 Å²	121.9	88%	0.881	76%	0.76	S	S	*	*				57.4	111	116	-50.3	0	0	0	0	120.9
691	G	26.5	Very low	28.9	Very low	71 Å²	71	126.4 Å²	126.4	73%	0.732	77%	0.769	S	S	*	*			trans	-160.4	109.2	164.7	0	0	0	0	0	114.8
692	S	27.7	Very low	28.8	Very low	109 Å²	109	127.6 Å²	127.6	76%	0.762	77%	0.769	S	S	*	*			trans	35.7	99.1	151.1	58.9	0	0	0	0	122.4
693	S	28.1	Very low	28.4	Very low	106 Å²	106	125 Å²	125	74%	0.741	77%	0.765	S	S	*	*				58.6	146.7	117.6	65.9	0	0	0	0	124.7
694	S	27.7	Very low	28.2	Very low	114 Å²	114	127.1 Å²	127.1	80%	0.797	77%	0.765	S	S	*	*			trans	80.9	143	158.6	86.6	0	0	0	0	116.5
695	S	28.8	Very low	27.9	Very low	97 Å²	97	133.2 Å²	133.2	68%	0.678	78%	0.775	S	S	*	*			cis	-164.8	160.1	-10.9	-136.4	0	0	0	0	111.5
696	L	30	Very low	28.5	Very low	151 Å²	151	128.7 Å²	128.7	79%	0.791	76%	0.763	S	S	*	*			trans	65.3	148.1	152.2	-70.3	164.3	0	0	0	118.1
697	D	29.2	Very low	28.4	Very low	98 Å²	98	131 Å²	131	52%	0.524	76%	0.76	S	S	.	*			cis	-168.6	150.8	-15.5	-155.9	-2.9	0	0	0	110.7
698	K	30.4	Very low	28.3	Very low	159 Å²	159	131.5 Å²	131.5	69%	0.691	75%	0.751	S	S	*	*			trans	54.6	168.1	159.8	-71.8	150.2	-167.3	153.5	0	117.8
699	Q	26.4	Very low	28.3	Very low	158 Å²	158	134.4 Å²	134.4	74%	0.738	75%	0.75	S	S	*	*			cis	-160	175.2	-25.2	-107.8	173.2	-59.8	0	0	105.9
700	I	28.3	Very low	28.2	Very low	145 Å²	145	131.5 Å²	131.5	74%	0.744	74%	0.744	S	S	*	*			cis	-150.9	-171.6	9.5	-144.9	162.4	0	0	0	109.8
701	Q	25.3	Very low	28.1	Very low	167 Å²	167	133 Å²	133	78%	0.78	74%	0.739	S	S	*	*			trans	-136.5	145.5	166.7	-143.1	-171.7	31.4	0	0	110.2
702	P	31.3	Very low	28.8	Very low	112 Å²	112	135.6 Å²	135.6	73%	0.727	74%	0.743	S	S	*	*				-137.2	162.2	98.9	15.3	8.1	0	0	0	112.4
703	S	25.4	Very low	28.9	Very low	100 Å²	100	134.2 Å²	134.2	70%	0.699	74%	0.738	S	S	*	*			cis	97.1	146.2	34	-162.6	0	0	0	0	114.6
704	I	25	Very low	29	Very low	163 Å²	163	136.7 Å²	136.7	84%	0.836	74%	0.743	S	S	*	*			trans	118.2	137.2	168.7	-61.4	161.7	0	0	0	116.6
705	Y	23.8	Very low	29.1	Very low	222 Å²	222	138.7 Å²	138.7	87%	0.871	74%	0.739	S	S	*	*			trans	-125.5	-176.9	-180	-110.9	-91	0	0	0	107.3
706	P	42.5	Very low	29.2	Very low	101 Å²	101	141.7 Å²	141.7	66%	0.656	75%	0.747	S	S	*	*			cis	-139.7	-152.5	-2.1	36.7	-11.5	0	0	0	115.2
707	Q	25.2	Very low	28.9	Very low	170 Å²	170	137.8 Å²	137.8	79%	0.794	74%	0.743	S	S	*	*			trans	89.7	134.1	166.9	-53.8	-149.9	-15.7	0	0	117.1
708	V	28	Very low	29.1	Very low	119 Å²	119	138.9 Å²	138.9	72%	0.721	76%	0.758	S	S	*	*			cis	100.2	110.8	22	172.4	0	0	0	0	113.3
709	D	27.3	Very low	30.2	Very low	133 Å²	133	136.9 Å²	136.9	71%	0.711	76%	0.761	S	S	*	*				-179.7	156.2	112	-125.7	-19	0	0	0	118
710	N	28.2	Very low	30.4	Very low	140 Å²	140	135 Å²	135	75%	0.749	77%	0.765	S	S	*	*			trans	61.1	151.3	150.2	-73.8	-53.1	0	0	0	127.4
711	M	26.1	Very low	30.5	Very low	158 Å²	158	133.2 Å²	133.2	78%	0.778	76%	0.764	S	S	*	*			trans	-116.4	166.9	174.1	-81.1	-89	-68.2	0	0	110.9
712	P	40.3	Very low	30.6	Very low	126 Å²	126	131.7 Å²	131.7	82%	0.818	77%	0.766	S	S	*	*				-145.7	-170.1	108.7	38	-21.5	0	0	0	114.7
713	A	28.8	Very low	30.6	Very low	80 Å²	80	131.4 Å²	131.4	66%	0.661	77%	0.767	S	S	*	*			trans	-141	-166.7	-173.5	0	0	0	0	0	113.1
714	L	30.5	Very low	31.8	Very low	158 Å²	158	132.6 Å²	132.6	83%	0.827	77%	0.772	S	S	*	*			trans	86.2	147.1	175.8	-56.2	177.5	0	0	0	116.7
715	E	29.5	Very low	32.2	Very low	156 Å²	156	130 Å²	130	73%	0.729	77%	0.769	S	S	*	*			cis	-167	174	-28.6	-142.4	-167.1	171.7	0	0	112.2
716	L	31.2	Very low	33.7	Very low	159 Å²	159	125.5 Å²	125.5	83%	0.832	77%	0.766	S	S	*	*			trans	72.6	138.5	151.4	-125.5	75.6	0	0	0	122.8
717	G	25	Very low	33.4	Very low	69 Å²	69	126 Å²	126	71%	0.711	77%	0.772	S	S	*	*			trans	159.8	109.3	162.6	0	0	0	0	0	116.5
718	S	32.6	Very low	35	Very low	121 Å²	121	122.4 Å²	122.4	85%	0.846	76%	0.763	S	S	*	*			trans	-163.5	155.2	169.9	-71.4	0	0	0	0	109.6
719	P	53.4	Low	35.1	Very low	117 Å²	117	124.9 Å²	124.9	76%	0.76	77%	0.767	S	S	*	*				-158.2	157.8	100.1	39.5	-20.6	0	0	0	118.4
720	C	30.9	Very low	35.2	Very low	119 Å²	119	126.4 Å²	126.4	80%	0.804	77%	0.774	S	S	*	*			trans	55.4	151.3	143.7	-62.9	0	0	0	0	121.3
721	C	29.7	Very low	35.3	Very low	108 Å²	108	125.1 Å²	125.1	73%	0.73	78%	0.776	S	S	*	*			cis	-163.5	-167.9	-11.5	-107	0	0	0	0	107
722	T	27.8	Very low	36.3	Very low	135 Å²	135	123.4 Å²	123.4	83%	0.828	78%	0.777	S	S	*	*			cis	-159.5	176.4	16.9	-24.8	0	0	0	0	110.1
723	S	30.6	Very low	35.8	Very low	105 Å²	105	123 Å²	123	73%	0.734	78%	0.777	S	S	*	*			trans	-131.2	173.5	165.6	61	0	0	0	0	111
724	P	51.5	Low	35.9	Very low	125 Å²	125	129.5 Å²	129.5	81%	0.812	79%	0.786	S	S	*	*				-153.8	179.8	94.8	40.9	-22.8	0	0	0	116.4
725	S	34.3	Very low	35.8	Very low	110 Å²	110	133.1 Å²	133.1	77%	0.769	79%	0.79	S	S	*	*			trans	-146.2	166.4	164.5	61.9	0	0	0	0	110.4
726	P	54.4	Low	35.7	Very low	126 Å²	126	136.3 Å²	136.3	82%	0.818	80%	0.796	S	S	*	*			trans	-141.6	168.4	140.6	34.8	-18.8	0	0	0	115
727	S	36.2	Very low	35.4	Very low	111 Å²	111	133.9 Å²	133.9	78%	0.776	79%	0.792	S	S	*	*			trans	-98	-147	-176.5	-36.6	0	0	0	0	111.4
728	P	57.7	Low	35.6	Very low	95 Å²	95	135.5 Å²	135.5	62%	0.617	79%	0.792	S	S	*	*			cis	-148.4	178.4	16.8	43.2	-20.6	0	0	0	120.2
729	H	30.2	Very low	35.5	Very low	171 Å²	171	138 Å²	138	79%	0.792	79%	0.793	S	S	*	*			trans	69.2	153.7	162	-50.4	-46.9	0	0	0	118.1
730	L	29.3	Very low	34.6	Very low	165 Å²	165	137.9 Å²	137.9	86%	0.864	79%	0.792	S	S	*	*			cis	-124.3	-175.6	14.9	-80.7	164.8	0	0	0	113.7
731	S	30.6	Very low	34.4	Very low	113 Å²	113	141.1 Å²	141.1	79%	0.79	80%	0.795	S	S	*	*			trans	-144.3	-162	-178.3	-51.1	0	0	0	0	112.2
732	P	47.8	Very low	34.2	Very low	122 Å²	122	144.3 Å²	144.3	79%	0.792	80%	0.804	S	S	*	*				-118.7	-179.3	-109.2	37.7	-19.9	0	0	0	115.2
733	S	29.2	Very low	34.2	Very low	119 Å²	119	142.1 Å²	142.1	83%	0.832	80%	0.8	S	S	*	*			trans	-130.1	153.5	170	59.5	0	0	0	0	112.6
734	Y	30.6	Very low	34.6	Very low	215 Å²	215	142.1 Å²	142.1	84%	0.843	80%	0.797	S	S	*	*			trans	-94.6	154.1	-166.4	-66.7	-106.1	0	0	0	113.2
735	Y	29.9	Very low	33.3	Very low	234 Å²	234	147.5 Å²	147.5	92%	0.918	80%	0.803	S	S	*	*				-148.3	167.9	120.5	-120.5	-83.7	0	0	0	111.2
736	R	26.3	Very low	33.1	Very low	223 Å²	223	149.8 Å²	149.8	84%	0.842	81%	0.806	S	S	*	*			trans	-141	153.1	-163.3	-171.4	-173.3	-167.5	-171.7	6.2	111
737	S	25.5	Very low	31.7	Very low	108 Å²	108	149.9 Å²	149.9	76%	0.755	80%	0.804	S	S	*	*			trans	74.5	150.6	169.9	-118.9	0	0	0	0	115.4
738	S	28.8	Very low	31.4	Very low	103 Å²	103	149 Å²	149	72%	0.72	80%	0.804	S	S	*	*			cis	-142.7	150.2	1.4	-71.1	0	0	0	0	111.7
739	M	30.5	Very low	30	Very low	174 Å²	174	152.9 Å²	152.9	86%	0.857	81%	0.814	S	S	*	*			trans	-89.1	148.8	158.8	-84.1	-75.6	-169.2	0	0	110.7
740	P	33.9	Very low	30.2	Very low	114 Å²	114	152.2 Å²	152.2	74%	0.74	82%	0.816	S	S	*	*			trans	-120.5	119.8	148.3	33.3	-21.8	0	0	0	111.3
741	H	27.4	Very low	30.4	Very low	188 Å²	188	150.2 Å²	150.2	87%	0.87	81%	0.806	S	S	*	*			trans	-72.7	132.2	161.7	-77.6	-85	0	0	0	109.4
742	L	26.7	Very low	30.7	Very low	174 Å²	174	149.1 Å²	149.1	91%	0.911	80%	0.798	S	S	*	*			trans	-154.3	112.1	161.8	-117.2	168.9	0	0	0	112
743	A	27.2	Very low	30	Very low	90 Å²	90	146 Å²	146	74%	0.744	79%	0.788	S	S	*	*			trans	-162.3	161.3	167.9	0	0	0	0	0	108
744	P	37.8	Very low	30.2	Very low	105 Å²	105	147.3 Å²	147.3	68%	0.682	78%	0.781	S	S	*	*			cis	-115.1	171.6	-5.2	39.9	-29.2	0	0	0	112.7
745	Y	25.9	Very low	30.4	Very low	238 Å²	238	144.2 Å²	144.2	93%	0.933	77%	0.774	S	S	*	*			trans	-132.4	131.7	150.8	-108.2	-87.2	0	0	0	109.9
746	L	28.3	Very low	30.9	Very low	157 Å²	157	139 Å²	139	82%	0.822	76%	0.761	S	S	*	*			trans	-101.2	121.4	-179.1	-71.9	165.2	0	0	0	109.9
747	T	26.1	Very low	31.5	Very low	128 Å²	128	130 Å²	130	79%	0.785	73%	0.728	S	S	*	*			trans	-146.7	110.7	157.3	26.3	0	0	0	0	108.8
748	A	29.4	Very low	31.9	Very low	94 Å²	94	128.6 Å²	128.6	78%	0.777	71%	0.711	S	S	*	*			trans	-88.4	131.3	176.4	0	0	0	0	0	110.5
749	H	29.2	Very low	32.7	Very low	176 Å²	176	127.1 Å²	127.1	82%	0.815	70%	0.696	S	S	*	*			trans	-115.6	66	168.7	-88.8	-76.8	0	0	0	110.9	N751	H749-N751 PolarHBondContact O-N 3.4Å
750	N	33.2	Very low	33.5	Very low	156 Å²	156	122.1 Å²	122.1	83%	0.834	67%	0.667	S	S	*	*			trans	-74.2	99.8	159.4	-85.4	-9.7	0	0	0	108.2
751	N	34.2	Very low	34.1	Very low	124 Å²	124	117.7 Å²	117.7	66%	0.663	64%	0.636	S	S	*	*			trans	-151.2	22.7	170.9	-134.8	21.8	0	0	0	115.9	H749	H749-N751 PolarHBondContact O-N 3.4Å
752	S	37.5	Very low	35.1	Very low	90 Å²	90	114.2 Å²	114.2	63%	0.629	62%	0.619	S	S	*	*	S	Bend	trans	-87.6	-5.5	178.2	51.2	0	0	0	0	114.8	I756	S752-I756 WeakPolarHBondContact O-CD1 3.1Å
753	G	32.8	Very low	36.2	Very low	55 Å²	55	107.2 Å²	107.2	57%	0.567	58%	0.582	S	S	*	*	H	α-helix	trans	-83.3	-37.2	-172.5	0	0	0	0	0	115.6
754	E	34.1	Very low	37.3	Very low	148 Å²	148	104.7 Å²	104.7	69%	0.692	56%	0.556	S	S	*	*	H	α-helix	trans	-84.7	-39.8	-173	-64.6	-128.8	112.7	0	0	113	K757 L758	E754-K757 PolarHBondContact O-N 2.97Å; E754-K757 VanDerWaalsContact O-N 3.1Å; E754-L758 PolarHBondContact O-N 3.41Å
755	E	34.7	Very low	38	Very low	150 Å²	150	106.3 Å²	106.3	70%	0.701	55%	0.548	S	S	*	.	H	α-helix	trans	-62.2	-48.1	-174.4	-168.1	166.3	-133.8	0	0	111.9	K757 L758 D759	E755-K757 PolarHBondContact O-N 3.29Å; E755-L758 PolarHBondContact O-N 3.4Å; E755-D759 PolarHBondContact O-N 2.98Å
756	I	39.6	Very low	39	Very low	125 Å²	125	97.2 Å²	97.2	64%	0.641	52%	0.522	S	S	*	.	H	α-helix	trans	-55.1	-39.3	173.9	-61.7	177.4	0	0	0	111.4	S752 R760	S752-I756 WeakPolarHBondContact O-CD1 3.1Å; I756-R760 PolarHBondContact O-N 3.26Å; I756-R760 VanDerWaalsContact O-N 3.08Å
757	K	39.3	Very low	39.9	Very low	32 Å²	32	90.8 Å²	90.8	14%	0.139	49%	0.489	C	S	.	.	H	α-helix	trans	-78.3	-32.1	-175	-153	-114	70.7	178.5	0	112	I587 E754 E755 E761	I587-K757 HydrophobicContact CB-CD 3.67Å; I587-K757 HydrophobicContact CB-CG 4.49Å; I587-K757 HydrophobicContact CG2-CD 3.81Å; I587-K757 WeakPolarHBondContact O-CD 3.46Å; I587-K757 PolarHBondContact O-NZ 3.06Å; E754-K757 PolarHBondContact O-N 2.97Å; E754-K757 VanDerWaalsContact O-N 3.1Å; E755-K757 PolarHBondContact O-N 3.29Å; K757-E761 IonicContact NZ-OE2 2.99Å; K757-E761 PolarHBondContact NZ-OE2 3.2Å; K757-E761 PolarHBondContact O-N 3.43Å
758	L	34.5	Very low	41.1	Very low	79 Å²	79	87.6 Å²	87.6	41%	0.414	47%	0.467	S	S	.	.	H	α-helix	trans	-67.8	-39.2	175.5	-163.7	72	0	0	0	111.2	E754 E755 E761 K762	E754-L758 PolarHBondContact O-N 3.41Å; E755-L758 PolarHBondContact O-N 3.4Å; L758-E761 PolarHBondContact O-N 3.1Å; L758-K762 WeakPolarHBondContact O-CG 3.16Å; L758-K762 PolarHBondContact O-N 3.33Å; L758-K762 VanDerWaalsContact O-N 3.16Å
759	D	45.2	Very low	41.4	Very low	73 Å²	73	89.1 Å²	89.1	39%	0.39	46%	0.459	S	S	.	.	H	α-helix	trans	-70.9	-43.1	174.7	-90.3	9.7	0	0	0	112.8	E755 E761 K762 I763	E755-D759 PolarHBondContact O-N 2.98Å; D759-E761 PolarHBondContact O-N 2.56Å; D759-E761 VanDerWaalsContact O-N 3.14Å; D759-K762 PolarHBondContact O-N 3.25Å; D759-K762 VanDerWaalsContact O-N 3.12Å; D759-K762 WeakPolarHBondContact OD1-CE 3.46Å; D759-K762 IonicContact OD1-NZ 2.76Å; D759-K762 PolarHBondContact OD1-NZ 3.03Å; D759-I763 HydrophobicContact CB-CD1 4.37Å; D759-I763 WeakPolarHBondContact O-CB 3.33Å; D759-I763 WeakPolarHBondContact O-CD1 3.31Å; D759-I763 VanDerWaalsContact O-CG1 3.32Å; D759-I763 WeakPolarHBondContact O-CG1 3.35Å; D759-I763 PolarHBondContact O-N 3.34Å
760	R	46.8	Very low	41.8	Very low	69 Å²	69	85.6 Å²	85.6	26%	0.26	45%	0.45	S	S	.	.	H	α-helix	trans	-54.3	-36.2	173.2	-176.6	175.9	173.3	-158.8	-4.4	111.7	E310 I756 L764	E310-R760 IonicContact OE2-NH2 3.62Å; E310-R760 PolarHBondContact OE2-NH2 3.35Å; I756-R760 PolarHBondContact O-N 3.26Å; I756-R760 VanDerWaalsContact O-N 3.08Å; R760-L764 HydrophobicContact CG-CD1 4.02Å; R760-L764 HydrophobicContact CG-CG 4.41Å; R760-L764 VanDerWaalsContact O-CB 3.28Å; R760-L764 WeakPolarHBondContact O-CB 3.49Å; R760-L764 VanDerWaalsContact O-CG 3.26Å; R760-L764 WeakPolarHBondContact O-CG 3.43Å; R760-L764 PolarHBondContact O-N 3.32Å
761	E	46.6	Very low	41.9	Very low	20 Å²	20	87.4 Å²	87.4	9%	0.093	45%	0.454	C	S	.	.	H	α-helix	trans	-74.3	-40	178.4	-155.6	-179.6	138.3	0	0	113.2	L588 Q591 K757 L758 D759 R765	L588-E761 HydrophobicContact CD2-CG 4.46Å; Q591-E761 WeakPolarHBondContact CB-OE1 3.48Å; Q591-E761 VanDerWaalsContact CD-OE2 3.28Å; Q591-E761 PolarHBondContact OE1-OE1 2.98Å; Q591-E761 PolarHBondContact OE1-OE2 2.82Å; K757-E761 IonicContact NZ-OE2 2.99Å; K757-E761 PolarHBondContact NZ-OE2 3.2Å; K757-E761 PolarHBondContact O-N 3.43Å; L758-E761 PolarHBondContact O-N 3.1Å; D759-E761 PolarHBondContact O-N 2.56Å; D759-E761 VanDerWaalsContact O-N 3.14Å; E761-R765 VanDerWaalsContact O-CG 3.28Å; E761-R765 WeakPolarHBondContact O-CG 3.34Å; E761-R765 PolarHBondContact O-N 3.46Å; E761-R765 IonicContact OE1-CZ 3.58Å; E761-R765 IonicContact OE1-NE 3.67Å; E761-R765 IonicContact OE1-NH2 2.7Å; E761-R765 PolarHBondContact OE1-NH2 3.13Å
762	K	47.9	Very low	41.8	Very low	115 Å²	115	93.3 Å²	93.3	50%	0.5	48%	0.484	S	S	.	.	H	α-helix	trans	-60.7	-44.5	171.9	-65.9	168.2	-158.3	159.9	0	111.6	L758 D759 R765 A766	L758-K762 WeakPolarHBondContact O-CG 3.16Å; L758-K762 PolarHBondContact O-N 3.33Å; L758-K762 VanDerWaalsContact O-N 3.16Å; D759-K762 PolarHBondContact O-N 3.25Å; D759-K762 VanDerWaalsContact O-N 3.12Å; D759-K762 WeakPolarHBondContact OD1-CE 3.46Å; D759-K762 IonicContact OD1-NZ 2.76Å; D759-K762 PolarHBondContact OD1-NZ 3.03Å; K762-R765 WeakPolarHBondContact O-CB 3.33Å; K762-R765 PolarHBondContact O-N 3.05Å; K762-A766 PolarHBondContact O-N 2.72Å
763	I	50.4	Low	42	Very low	28 Å²	28	93.5 Å²	93.5	14%	0.144	48%	0.477	C	S	.	.	H	α-helix	trans	-74	-37.5	-176.2	-63.3	160.8	0	0	0	110.9	E281 I286 D759 R765 A766 L767	E281-I763 VanDerWaalsContact OE2-CD1 3.3Å; E281-I763 WeakPolarHBondContact OE2-CD1 3.42Å; I286-I763 HydrophobicContact CD1-CG2 4.41Å; D759-I763 HydrophobicContact CB-CD1 4.37Å; D759-I763 WeakPolarHBondContact O-CB 3.33Å; D759-I763 WeakPolarHBondContact O-CD1 3.31Å; D759-I763 VanDerWaalsContact O-CG1 3.32Å; D759-I763 WeakPolarHBondContact O-CG1 3.35Å; D759-I763 PolarHBondContact O-N 3.34Å; I763-R765 VanDerWaalsContact C-N 3.33Å; I763-R765 PolarHBondContact O-N 3.43Å; I763-A766 PolarHBondContact O-N 2.91Å; I763-L767 HydrophobicContact CG2-CD1 3.85Å; I763-L767 HydrophobicContact CG2-CG 4.2Å; I763-L767 WeakPolarHBondContact O-CB 3.47Å; I763-L767 WeakPolarHBondContact O-CG 3.14Å; I763-L767 PolarHBondContact O-N 3.46Å
764	L	51	Low	42.5	Very low	37 Å²	37	95.5 Å²	95.5	19%	0.194	47%	0.472	C	S	.	.	H	α-helix	trans	-61.5	-41.3	170.2	-80.3	172	0	0	0	111.6	F322 R760 L768	F322-L764 HydrophobicContact CE1-CD2 4.34Å; F322-L764 HydrophobicContact CZ-CD2 4.37Å; R760-L764 HydrophobicContact CG-CD1 4.02Å; R760-L764 HydrophobicContact CG-CG 4.41Å; R760-L764 VanDerWaalsContact O-CB 3.28Å; R760-L764 WeakPolarHBondContact O-CB 3.49Å; R760-L764 VanDerWaalsContact O-CG 3.26Å; R760-L764 WeakPolarHBondContact O-CG 3.43Å; R760-L764 PolarHBondContact O-N 3.32Å; L764-L768 HydrophobicContact CD2-CD1 4.44Å; L764-L768 WeakPolarHBondContact O-CB 3.42Å; L764-L768 WeakPolarHBondContact O-CD1 3.11Å; L764-L768 WeakPolarHBondContact O-CG 3.3Å; L764-L768 PolarHBondContact O-N 3.5Å
765	R	50.6	Low	43	Very low	138 Å²	138	92.6 Å²	92.6	52%	0.521	46%	0.46	S	S	.	.	H	α-helix	trans	-58.6	-51.6	171.3	-68.7	170.8	-168.1	-145.9	8	110.3	E761 K762 I763 L767 L768 M769	E761-R765 VanDerWaalsContact O-CG 3.28Å; E761-R765 WeakPolarHBondContact O-CG 3.34Å; E761-R765 PolarHBondContact O-N 3.46Å; E761-R765 IonicContact OE1-CZ 3.58Å; E761-R765 IonicContact OE1-NE 3.67Å; E761-R765 IonicContact OE1-NH2 2.7Å; E761-R765 PolarHBondContact OE1-NH2 3.13Å; K762-R765 WeakPolarHBondContact O-CB 3.33Å; K762-R765 PolarHBondContact O-N 3.05Å; I763-R765 VanDerWaalsContact C-N 3.33Å; I763-R765 PolarHBondContact O-N 3.43Å; R765-L767 PolarHBondContact O-N 3.46Å; R765-L768 CarbonylContact O-C 3.6Å; R765-L768 PolarHBondContact O-N 3.39Å; R765-M769 WeakPolarHBondContact O-CG 3.3Å; R765-M769 PolarHBondContact O-N 2.83Å; R765-M769 VanDerWaalsContact O-SD 3.39Å
766	A	47.9	Very low	43.4	Very low	47 Å²	47	89.2 Å²	89.2	39%	0.388	45%	0.445	S	S	.	.	H	α-helix	trans	-56.8	-47	179.6	0	0	0	0	0	113.9	K762 I763 L768	K762-A766 PolarHBondContact O-N 2.72Å; I763-A766 PolarHBondContact O-N 2.91Å; A766-L768 PolarHBondContact O-N 3.3Å
767	L	47.9	Very low	43.7	Very low	23 Å²	23	86.9 Å²	86.9	12%	0.12	43%	0.433	C	S	.	.	H	α-helix	trans	-70.3	-28.3	179.5	-71.9	173.4	0	0	0	113.3	Y268 F322 I763 R765	Y268-L767 HydrophobicContact CE2-CD2 4.02Å; F322-L767 HydrophobicContact CD1-CB 4.38Å; F322-L767 HydrophobicContact CD1-CD1 4.47Å; F322-L767 HydrophobicContact CE1-CB 4.42Å; F322-L767 HydrophobicContact CE1-CD1 4.44Å; I763-L767 HydrophobicContact CG2-CD1 3.85Å; I763-L767 HydrophobicContact CG2-CG 4.2Å; I763-L767 WeakPolarHBondContact O-CB 3.47Å; I763-L767 WeakPolarHBondContact O-CG 3.14Å; I763-L767 PolarHBondContact O-N 3.46Å; R765-L767 PolarHBondContact O-N 3.46Å
768	L	50.1	Low	44	Very low	61 Å²	61	90.6 Å²	90.6	32%	0.319	45%	0.453	S	S	.	.	H	α-helix	trans	-96.7	1.3	-178.9	-63	171.1	0	0	0	113.8	H320 F322 L764 R765 A766 T770	H320-L768 HydrophobicContact CB-CD2 4.38Å; F322-L768 HydrophobicContact CE1-CD2 4.29Å; L764-L768 HydrophobicContact CD2-CD1 4.44Å; L764-L768 WeakPolarHBondContact O-CB 3.42Å; L764-L768 WeakPolarHBondContact O-CD1 3.11Å; L764-L768 WeakPolarHBondContact O-CG 3.3Å; L764-L768 PolarHBondContact O-N 3.5Å; R765-L768 CarbonylContact O-C 3.6Å; R765-L768 PolarHBondContact O-N 3.39Å; A766-L768 PolarHBondContact O-N 3.3Å; L768-T770 PolarHBondContact O-N 3.31Å
769	M	35.5	Very low	44.7	Very low	125 Å²	125	91.4 Å²	91.4	62%	0.616	46%	0.456	S	S	*	.			trans	-57.6	99.8	-179	-69.7	-50.4	-79.2	0	0	112.4	R263 R765	R263-M769 PolarHBondContact NH1-O 3Å; R263-M769 VanDerWaalsContact NH1-O 3.08Å; R765-M769 WeakPolarHBondContact O-CG 3.3Å; R765-M769 PolarHBondContact O-N 2.83Å; R765-M769 VanDerWaalsContact O-SD 3.39Å
770	T	37.6	Very low	44.6	Very low	102 Å²	102	92.8 Å²	92.8	63%	0.626	46%	0.461	S	S	*	.			trans	-156.5	80.4	157.6	10.4	0	0	0	0	108.7	R263 L768	R263-T770 PolarHBondContact NH1-OG1 3.49Å; L768-T770 PolarHBondContact O-N 3.31Å
771	E	35.6	Very low	44.4	Very low	194 Å²	194	94.8 Å²	94.8	91%	0.907	48%	0.477	S	S	*	.			trans	-171.9	95.5	134	-106.4	174.7	-156.4	0	0	111.1
772	L	32.1	Very low	44.2	Very low	248 Å²	248	101.6 Å²	101.6	100%	1.298	51%	0.512	S	S	*	.			trans	-158.6	0	147.2	-104.9	173	0	0	0	107.5

Retrieved 772 of 772 residues in 493.6 ms (Link to these results)

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