A0A087YNF2_POEFO Loading...

Frizzled-6

AlphaFold DB , UniProt , Accession A0A087YNF2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 695 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	32.1	Very low	40.1	Very low	238 Å²	238	147.5 Å²	147.5	100%	1.172	76%	0.76	S	S	*	*				0	135.8	0	-74.7	163.5	157	0	0	107.7
2	L	31.8	Very low	40.3	Very low	173 Å²	173	142.2 Å²	142.2	91%	0.906	75%	0.746	S	S	*	*			trans	-72.1	146.1	175.4	-79	72.4	0	0	0	109.4
3	M	31	Very low	40.4	Very low	152 Å²	152	140 Å²	140	75%	0.749	73%	0.734	S	S	*	*			trans	-100.4	130.1	175	-57.1	-145.6	77.6	0	0	110	G5 F380	M3-G5 PolarHBondContact O-N 2.94Å; M3-F380 HydrophobicContact CE-CZ 4.3Å
4	P	39.8	Very low	40.1	Very low	128 Å²	128	135.6 Å²	135.6	83%	0.831	73%	0.728	S	S	*	*			trans	-81.4	98.5	175.4	31.5	-32.5	0	0	0	111.1
5	G	40.5	Very low	39.6	Very low	64 Å²	64	140.9 Å²	140.9	66%	0.66	73%	0.734	S	S	*	*			trans	-85.9	170.3	145.8	0	0	0	0	0	110.3	M3	M3-G5 PolarHBondContact O-N 2.94Å
6	P	49.9	Very low	39.7	Very low	83 Å²	83	138.3 Å²	138.3	54%	0.539	73%	0.726	S	S	.	*	S	Bend	cis	-124.4	25.1	5.9	41.3	-27	0	0	0	113.7	W8 L9	P6-W8 PolarHBondContact O-N 3.46Å; P6-L9 PolarHBondContact O-N 3.2Å
7	L	40.8	Very low	39.2	Very low	134 Å²	134	134.4 Å²	134.4	70%	0.702	73%	0.726	S	S	*	*	H	α-helix	trans	-51.8	-34.9	-165.7	-129.6	79.1	0	0	0	115.4	L9 W10 L11	L7-L9 VanDerWaalsContact C-N 3.29Å; L7-L9 PolarHBondContact O-N 3.37Å; L7-W10 PolarHBondContact O-N 3.25Å; L7-L11 PolarHBondContact O-N 3.4Å
8	W	44.7	Very low	38.9	Very low	220 Å²	220	133.2 Å²	133.2	83%	0.833	73%	0.73	S	S	*	*	H	α-helix	trans	-62.9	-29	-178.9	-75.3	91	0	0	0	114.2	P6 W10 S12	P6-W8 PolarHBondContact O-N 3.46Å; W8-W10 VanDerWaalsContact C-N 3.31Å; W8-W10 PolarHBondContact O-N 3.2Å; W8-S12 PolarHBondContact O-N 2.98Å; W8-S12 PolarHBondContact O-OG 3Å
9	L	45.5	Very low	38.5	Very low	118 Å²	118	132.5 Å²	132.5	62%	0.618	73%	0.734	S	S	*	*	H	α-helix	trans	-69.1	-28.7	177.7	-89.3	157.8	0	0	0	112.9	P6 L7 S12	P6-L9 PolarHBondContact O-N 3.2Å; L7-L9 VanDerWaalsContact C-N 3.29Å; L7-L9 PolarHBondContact O-N 3.37Å; L9-S12 PolarHBondContact O-OG 3.13Å
10	W	41.1	Very low	38.1	Very low	196 Å²	196	128.2 Å²	128.2	74%	0.742	72%	0.721	S	S	*	*	H	α-helix	trans	-78.7	-36.4	178.7	-77.6	71.1	0	0	0	111.9	L7 W8 S12 L13 A14	L7-W10 PolarHBondContact O-N 3.25Å; W8-W10 VanDerWaalsContact C-N 3.31Å; W8-W10 PolarHBondContact O-N 3.2Å; W10-S12 VanDerWaalsContact C-N 3.29Å; W10-S12 PolarHBondContact O-N 3.38Å; W10-L13 PolarHBondContact O-N 2.97Å; W10-L13 VanDerWaalsContact O-N 3.08Å; W10-A14 PolarHBondContact O-N 3.42Å; W10-A14 VanDerWaalsContact O-N 3.11Å
11	L	43.8	Very low	37.6	Very low	116 Å²	116	127.6 Å²	127.6	61%	0.607	73%	0.725	S	S	*	*	H	α-helix	trans	-63.6	-33.2	175.2	-74.7	164.8	0	0	0	112.5	L7 L13	L7-L11 PolarHBondContact O-N 3.4Å; L11-L13 VanDerWaalsContact C-N 3.32Å; L11-L13 PolarHBondContact O-N 2.86Å
12	S	42.5	Very low	37.4	Very low	84 Å²	84	124.5 Å²	124.5	59%	0.587	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.1	-21.4	172.3	42.1	0	0	0	0	114.7	W8 L9 W10	W8-S12 PolarHBondContact O-N 2.98Å; W8-S12 PolarHBondContact O-OG 3Å; L9-S12 PolarHBondContact O-OG 3.13Å; W10-S12 VanDerWaalsContact C-N 3.29Å; W10-S12 PolarHBondContact O-N 3.38Å
13	L	41.9	Very low	37.6	Very low	114 Å²	114	119.5 Å²	119.5	60%	0.597	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.6	-19.1	177	-74.6	165.4	0	0	0	112.8	W10 L11 W15	W10-L13 PolarHBondContact O-N 2.97Å; W10-L13 VanDerWaalsContact O-N 3.08Å; L11-L13 VanDerWaalsContact C-N 3.32Å; L11-L13 PolarHBondContact O-N 2.86Å; L13-W15 PolarHBondContact O-N 3.43Å
14	A	35.7	Very low	38.3	Very low	78 Å²	78	118.8 Å²	118.8	65%	0.645	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.9	-2	179.6	0	0	0	0	0	114.7	W10	W10-A14 PolarHBondContact O-N 3.42Å; W10-A14 VanDerWaalsContact O-N 3.11Å
15	W	33.4	Very low	39.2	Very low	215 Å²	215	117.5 Å²	117.5	81%	0.814	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.2	25.6	179.4	-129.6	54	0	0	0	114	L13 G17	L13-W15 PolarHBondContact O-N 3.43Å; W15-G17 PolarHBondContact O-N 3.24Å
16	V	40.1	Very low	40.5	Very low	100 Å²	100	117.1 Å²	117.1	61%	0.606	65%	0.652	S	S	*	*			trans	-73.4	80.1	164	-177.7	0	0	0	0	109	S18	V16-S18 PolarHBondContact O-N 3.43Å
17	G	31.7	Very low	42.1	Very low	71 Å²	71	114.1 Å²	114.1	73%	0.732	63%	0.633	S	S	*	*			trans	-66.7	94.8	165.9	0	0	0	0	0	109.6	W15 C19	W15-G17 PolarHBondContact O-N 3.24Å; G17-C19 PolarHBondContact O-N 2.97Å
18	S	34.4	Very low	44	Very low	114 Å²	114	110 Å²	110	80%	0.797	61%	0.61	S	S	*	*			trans	-70.6	92.1	179.5	-168.8	0	0	0	0	110.5	V16 G20	V16-S18 PolarHBondContact O-N 3.43Å; S18-G20 PolarHBondContact O-N 3.49Å
19	C	30	Very low	46	Very low	120 Å²	120	102.2 Å²	102.2	81%	0.811	59%	0.588	S	S	*	*			trans	-84.8	89.1	168.7	-161.6	0	0	0	0	108.7	G17 S21	G17-C19 PolarHBondContact O-N 2.97Å; C19-S21 PolarHBondContact O-N 3.02Å
20	G	31.5	Very low	48.1	Very low	46 Å²	46	97.6 Å²	97.6	47%	0.474	56%	0.563	S	S	.	*			trans	-71.7	113.3	172.4	0	0	0	0	0	110.6	S18 H22	S18-G20 PolarHBondContact O-N 3.49Å; G20-H22 PolarHBondContact O-CD2 3.26Å; G20-H22 VanDerWaalsContact O-CD2 3.3Å; G20-H22 PolarHBondContact O-N 3.4Å
21	S	28.1	Very low	50.3	Low	116 Å²	116	93.6 Å²	93.6	81%	0.811	55%	0.551	S	S	*	*			trans	-67.8	87.9	177.1	-60.2	0	0	0	0	111.7	C19 S23	C19-S21 PolarHBondContact O-N 3.02Å; S21-S23 PolarHBondContact O-N 2.91Å
22	H	27.8	Very low	52.4	Low	173 Å²	173	88.8 Å²	88.8	80%	0.801	53%	0.527	S	S	*	.			trans	-75.1	99.6	172	-73.9	-82.2	0	0	0	110.9	G20	G20-H22 PolarHBondContact O-CD2 3.26Å; G20-H22 VanDerWaalsContact O-CD2 3.3Å; G20-H22 PolarHBondContact O-N 3.4Å
23	S	35.7	Very low	54.5	Low	67 Å²	67	92.3 Å²	92.3	47%	0.469	53%	0.534	S	S	.	.			trans	-116.7	104.7	162.2	-169	0	0	0	0	109.1	S21	S21-S23 PolarHBondContact O-N 2.91Å
24	L	44.6	Very low	56.6	Low	138 Å²	138	91.9 Å²	91.9	72%	0.723	52%	0.524	S	S	*	.			trans	-115.9	85.7	177.5	-78.6	171.5	0	0	0	109.3	T26	L24-T26 PolarHBondContact O-N 2.84Å; L24-T26 VanDerWaalsContact O-N 3.14Å; L24-T26 PolarHBondContact O-OG1 2.88Å; L24-T26 VanDerWaalsContact O-OG1 3.12Å
25	F	58.9	Low	59.1	Low	101 Å²	101	88.2 Å²	88.2	44%	0.443	49%	0.494	S	S	.	.			trans	-53.7	117.3	170.6	-54.9	-86.4	0	0	0	109.4	F44 N92 W157	F25-F44 HydrophobicContact CB-CE2 4.02Å; F25-F44 HydrophobicContact CB-CZ 3.87Å; F25-N92 PolarHBondContact O-ND2 3.5Å; F25-W157 AromaticContact CZ-NE1 3.84Å
26	T	68	Low	61.7	Low	56 Å²	56	82.5 Å²	82.5	34%	0.344	48%	0.478	S	S	.	.			trans	-148.6	146.3	-176.8	41.4	0	0	0	0	109.2	L24 N92 R152	L24-T26 PolarHBondContact O-N 2.84Å; L24-T26 VanDerWaalsContact O-N 3.14Å; L24-T26 PolarHBondContact O-OG1 2.88Å; L24-T26 VanDerWaalsContact O-OG1 3.12Å; T26-N92 WeakPolarHBondContact CA-OD1 3.41Å; T26-R152 VanDerWaalsContact OG1-CZ 3.28Å; T26-R152 PolarHBondContact OG1-NH1 3.36Å; T26-R152 PolarHBondContact OG1-NH2 2.94Å
27	C	83.1	Confident	63.5	Low	20 Å²	20	81.9 Å²	81.9	14%	0.135	49%	0.492	C	S	.	.			trans	-48.8	147.2	176.1	-49.6	0	0	0	0	112.5	M42 T43 C88 S89 N92	C27-M42 HydrophobicContact CB-CB 4.25Å; C27-M42 HydrophobicContact CB-CE 3.7Å; C27-T43 WeakPolarHBondContact CA-O 3.29Å; C27-C88 VanDerWaalsContact CA-SG 3.59Å; C27-C88 HydrophobicContact CB-CB 3.67Å; C27-C88 WeakPolarHBondContact CB-SG 3.23Å; C27-C88 WeakPolarHBondContact SG-CB 3.49Å; C27-C88 CovalentContact SG-SG 2.03Å; C27-C88 PolarHBondContact SG-SG 3.39Å; C27-S89 PolarHBondContact SG-O 3.46Å; C27-N92 PolarHBondContact N-OD1 3.31Å
28	E	82.3	Confident	66	Low	48 Å²	48	79.4 Å²	79.4	22%	0.224	46%	0.462	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	154.8	172	65.6	153.5	-155.7	0	0	112.4	K31 M42 T43 Q54	E28-K31 IonicContact OE1-NZ 2.87Å; E28-K31 PolarHBondContact OE1-NZ 3.34Å; E28-K31 IonicContact OE2-NZ 3.83Å; E28-K31 PolarHBondContact OE2-NZ 3.29Å; E28-M42 WeakPolarHBondContact O-CA 3.3Å; E28-T43 HydrophobicContact CG-CG2 4.3Å; E28-T43 PolarHBondContact N-O 2.92Å; E28-T43 WeakPolarHBondContact O-CG2 3.2Å; E28-T43 PolarHBondContact O-N 3.33Å; E28-Q54 PolarHBondContact OE1-NE2 2.9Å
29	P	86.9	Confident	68.3	Low	56 Å²	56	77.6 Å²	77.6	36%	0.364	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	148.4	-179	28.2	-35.8	0	0	0	112.7	N41 M42 Q54 P147	P29-N41 WeakPolarHBondContact CA-O 3.42Å; P29-M42 HydrophobicContact CB-SD 3.99Å; P29-Q54 PolarHBondContact O-NE2 3.42Å; P29-P147 HydrophobicContact CG-CB 4.39Å
30	I	89.2	Confident	71	Confident	20 Å²	20	73 Å²	73	10%	0.103	41%	0.413	C	S	.	.			trans	-69.3	133	177.3	-59.9	171.9	0	0	0	110.9	C35 L36 Y40 N41 T43 I85	I30-C35 HydrophobicContact CG2-CB 4.47Å; I30-L36 HydrophobicContact CB-CD2 4.5Å; I30-L36 HydrophobicContact CG2-CD2 4.08Å; I30-Y40 HydrophobicContact CD1-CD2 3.68Å; I30-Y40 HydrophobicContact CD1-CE2 3.64Å; I30-Y40 WeakPolarHBondContact CD1-O 3.25Å; I30-N41 PolarHBondContact N-O 3.35Å; I30-T43 HydrophobicContact CG1-CG2 3.99Å; I30-I85 HydrophobicContact CD1-CG2 4.42Å; I30-I85 HydrophobicContact CG1-CG2 4.15Å; I30-I85 HydrophobicContact CG2-CG2 4.46Å
31	K	86.8	Confident	73.5	Confident	112 Å²	112	74.3 Å²	74.3	49%	0.487	41%	0.41	S	S	.	.			trans	-115.8	-25.7	179.6	-57.5	156.8	-163.6	150.3	0	112	E28 H33	E28-K31 IonicContact OE1-NZ 2.87Å; E28-K31 PolarHBondContact OE1-NZ 3.34Å; E28-K31 IonicContact OE2-NZ 3.83Å; E28-K31 PolarHBondContact OE2-NZ 3.29Å; K31-H33 PolarHBondContact O-N 3.32Å
32	V	88.3	Confident	76.3	Confident	16 Å²	16	71.6 Å²	71.6	10%	0.097	39%	0.385	C	S	.	.			trans	-71.2	113.3	-173.8	-178.5	0	0	0	0	110.6	R34 C35 L36 Q54 A58 M61 I85	V32-R34 HydrophobicContact CG1-CB 4.35Å; V32-R34 PolarHBondContact O-N 2.8Å; V32-R34 VanDerWaalsContact O-N 3.11Å; V32-C35 PolarHBondContact O-N 3.49Å; V32-L36 PolarHBondContact O-N 3.24Å; V32-Q54 HydrophobicContact CG2-CB 3.82Å; V32-Q54 HydrophobicContact CG2-CG 4.4Å; V32-Q54 VanDerWaalsContact CG2-O 3.29Å; V32-Q54 WeakPolarHBondContact CG2-O 3.44Å; V32-A58 HydrophobicContact CB-CB 4.49Å; V32-A58 HydrophobicContact CG1-CB 3.7Å; V32-A58 HydrophobicContact CG2-CB 3.93Å; V32-M61 HydrophobicContact CG1-CE 4.32Å; V32-I85 HydrophobicContact CB-CD1 3.44Å; V32-I85 VanDerWaalsContact CB-CD1 3.44Å; V32-I85 HydrophobicContact CG1-CD1 3.82Å; V32-I85 HydrophobicContact CG2-CD1 3.43Å; V32-I85 VanDerWaalsContact CG2-CD1 3.43Å
33	H	86.4	Confident	79.2	Confident	158 Å²	158	63.3 Å²	63.3	73%	0.731	35%	0.346	S	S	*	.	G	3₁₀ helix	trans	-52.7	-38.4	-173.9	-172.9	67.5	0	0	0	113.9	K31 C35 L36	K31-H33 PolarHBondContact O-N 3.32Å; H33-C35 PolarHBondContact O-N 3.38Å; H33-L36 PolarHBondContact O-N 3.26Å
34	R	85.3	Confident	81.6	Confident	105 Å²	105	61.8 Å²	61.8	40%	0.396	33%	0.331	S	S	.	.	G	3₁₀ helix	trans	-62.5	-19.4	177.9	-59.2	-62.8	-159	167.7	8.1	114.3	V32 M61 E62 M65 H77	V32-R34 HydrophobicContact CG1-CB 4.35Å; V32-R34 PolarHBondContact O-N 2.8Å; V32-R34 VanDerWaalsContact O-N 3.11Å; R34-M61 HydrophobicContact CB-CE 3.94Å; R34-M61 HydrophobicContact CG-CE 4.45Å; R34-E62 IonicContact CZ-OE1 2.97Å; R34-E62 IonicContact NE-OE1 3.54Å; R34-E62 IonicContact NE-OE2 3.57Å; R34-E62 IonicContact NH2-OE1 2.66Å; R34-E62 PolarHBondContact NH2-OE1 2.66Å; R34-M65 HydrophobicContact CB-CE 4.4Å; R34-M65 HydrophobicContact CB-SD 4.31Å; R34-M65 HydrophobicContact CG-CE 4.09Å; R34-M65 HydrophobicContact CG-SD 4.08Å; R34-H77 PolarHBondContact O-NE2 3.27Å
35	C	89.5	Confident	83.4	Confident	1 Å²	1	56.3 Å²	56.3	1%	0.007	30%	0.302	C	S	.	.	G	3₁₀ helix	trans	-122.2	16.2	-178.6	-59.2	0	0	0	0	113.1	I30 V32 H33 M38 C81 I85	I30-C35 HydrophobicContact CG2-CB 4.47Å; V32-C35 PolarHBondContact O-N 3.49Å; H33-C35 PolarHBondContact O-N 3.38Å; C35-M38 HydrophobicContact CB-CG 4.15Å; C35-M38 VanDerWaalsContact O-CG 3.24Å; C35-M38 WeakPolarHBondContact O-CG 2.97Å; C35-C81 VanDerWaalsContact CA-SG 3.52Å; C35-C81 HydrophobicContact CB-CB 3.85Å; C35-C81 WeakPolarHBondContact CB-SG 3.36Å; C35-C81 VanDerWaalsContact SG-CA 3.51Å; C35-C81 WeakPolarHBondContact SG-CB 3.48Å; C35-C81 CovalentContact SG-SG 2.04Å; C35-C81 PolarHBondContact SG-SG 2.9Å; C35-I85 HydrophobicContact CB-CD1 4.06Å
36	L	86.8	Confident	84.3	Confident	94 Å²	94	53.1 Å²	53.1	49%	0.492	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.8	143.4	164.5	-63.3	177	0	0	0	109.4	I30 V32 H33 M38	I30-L36 HydrophobicContact CB-CD2 4.5Å; I30-L36 HydrophobicContact CG2-CD2 4.08Å; V32-L36 PolarHBondContact O-N 3.24Å; H33-L36 PolarHBondContact O-N 3.26Å; L36-M38 VanDerWaalsContact C-N 3.32Å
37	G	77.9	Confident	85.1	Confident	87 Å²	87	50.8 Å²	50.8	90%	0.897	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.8	3.9	-176.3	0	0	0	0	0	114.9
38	M	85.5	Confident	84.9	Confident	20 Å²	20	51.2 Å²	51.2	10%	0.099	28%	0.277	C	S	.	.	S	Bend	trans	-58.7	157	164.6	-72.3	-65.9	-70.6	0	0	111	C35 L36 Y40 H78 C81	C35-M38 HydrophobicContact CB-CG 4.15Å; C35-M38 VanDerWaalsContact O-CG 3.24Å; C35-M38 WeakPolarHBondContact O-CG 2.97Å; L36-M38 VanDerWaalsContact C-N 3.32Å; M38-Y40 HydrophobicContact CB-CD1 4.27Å; M38-Y40 HydrophobicContact CB-CE1 4.11Å; M38-Y40 HydrophobicContact CE-CD1 4.5Å; M38-Y40 HydrophobicContact CE-CE1 3.53Å; M38-Y40 PolarHBondContact O-N 3.19Å; M38-H78 HydrophobicContact CE-CB 4.45Å; M38-C81 HydrophobicContact CE-CB 3.63Å; M38-C81 HydrophobicContact CG-CB 4.08Å; M38-C81 HydrophobicContact SD-CB 3.73Å
39	P	82.6	Confident	85	Confident	76 Å²	76	50 Å²	50	49%	0.494	27%	0.272	S	S	.	.	S	Bend	trans	-57.7	-14.8	176.1	17.8	-30.4	0	0	0	115.1	L139	P39-L139 HydrophobicContact CB-CD1 4.31Å; P39-L139 HydrophobicContact CB-CD2 3.83Å; P39-L139 WeakPolarHBondContact O-CD1 3.31Å; P39-L139 WeakPolarHBondContact O-CD2 3.45Å
40	Y	84.9	Confident	84.5	Confident	23 Å²	23	52.6 Å²	52.6	9%	0.09	28%	0.282	C	S	.	.			trans	-121.9	145.8	176.5	57.8	-87	0	0	0	110.5	I30 M38 C81 Q82 I85 A87	I30-Y40 HydrophobicContact CD1-CD2 3.68Å; I30-Y40 HydrophobicContact CD1-CE2 3.64Å; I30-Y40 WeakPolarHBondContact CD1-O 3.25Å; M38-Y40 HydrophobicContact CB-CD1 4.27Å; M38-Y40 HydrophobicContact CB-CE1 4.11Å; M38-Y40 HydrophobicContact CE-CD1 4.5Å; M38-Y40 HydrophobicContact CE-CE1 3.53Å; M38-Y40 PolarHBondContact O-N 3.19Å; Y40-C81 PolarHBondContact OH-O 3.45Å; Y40-Q82 WeakPolarHBondContact OH-CA 3.28Å; Y40-Q82 PolarHBondContact OH-N 2.92Å; Y40-I85 VanDerWaalsContact CE2-O 3.25Å; Y40-I85 WeakPolarHBondContact CE2-O 3.41Å; Y40-I85 PolarHBondContact OH-O 2.89Å; Y40-A87 HydrophobicContact CD1-CB 3.62Å; Y40-A87 HydrophobicContact CD2-CB 3.46Å; Y40-A87 VanDerWaalsContact CD2-CB 3.46Å; Y40-A87 HydrophobicContact CE1-CB 3.96Å; Y40-A87 HydrophobicContact CE2-CB 3.81Å; Y40-A87 HydrophobicContact CG-CB 3.36Å
41	N	85.8	Confident	84.1	Confident	74 Å²	74	52.9 Å²	52.9	40%	0.396	28%	0.283	S	S	.	.			trans	-109.1	-10	-178.8	60.1	-7.9	0	0	0	114	P29 I30	P29-N41 WeakPolarHBondContact CA-O 3.42Å; I30-N41 PolarHBondContact N-O 3.35Å
42	M	86.4	Confident	83.4	Confident	58 Å²	58	49.6 Å²	49.6	29%	0.286	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	140.4	-178.8	-63.2	-63.5	-73.1	0	0	111.2	C27 E28 P29 C88	C27-M42 HydrophobicContact CB-CB 4.25Å; C27-M42 HydrophobicContact CB-CE 3.7Å; E28-M42 WeakPolarHBondContact O-CA 3.3Å; P29-M42 HydrophobicContact CB-SD 3.99Å; M42-C88 PolarHBondContact O-N 2.95Å
43	T	88.8	Confident	82.9	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	165.4	-178.3	-172.5	0	0	0	0	111.6	C27 E28 I30 F45 Q54 I85 P86	C27-T43 WeakPolarHBondContact CA-O 3.29Å; E28-T43 HydrophobicContact CG-CG2 4.3Å; E28-T43 PolarHBondContact N-O 2.92Å; E28-T43 WeakPolarHBondContact O-CG2 3.2Å; E28-T43 PolarHBondContact O-N 3.33Å; I30-T43 HydrophobicContact CG1-CG2 3.99Å; T43-F45 HydrophobicContact CG2-CD2 4.17Å; T43-F45 HydrophobicContact CG2-CE2 3.76Å; T43-F45 WeakPolarHBondContact OG1-CE2 3.29Å; T43-Q54 HydrophobicContact CG2-CG 4.17Å; T43-I85 HydrophobicContact CG2-CG2 3.88Å; T43-I85 WeakPolarHBondContact OG1-CG2 3.22Å; T43-P86 VanDerWaalsContact CA-O 3.26Å; T43-P86 WeakPolarHBondContact CA-O 3.42Å; T43-P86 WeakPolarHBondContact CB-O 3.3Å; T43-P86 PolarHBondContact OG1-O 2.71Å
44	F	85.1	Confident	82.9	Confident	34 Å²	34	43.8 Å²	43.8	15%	0.149	24%	0.242	C	C	.	.			trans	-127.7	141.7	179.6	-170.2	-88.5	0	0	0	110.6	F25 P86 C88 N92 V94	F25-F44 HydrophobicContact CB-CE2 4.02Å; F25-F44 HydrophobicContact CB-CZ 3.87Å; F44-P86 PolarHBondContact N-O 3.2Å; F44-C88 HydrophobicContact CB-CB 3.97Å; F44-N92 HydrophobicContact CE2-CB 4.46Å; F44-V94 HydrophobicContact CB-CG1 4.49Å; F44-V94 HydrophobicContact CB-CG2 3.6Å; F44-V94 HydrophobicContact CD1-CG2 3.65Å; F44-V94 HydrophobicContact CD2-CG2 4.36Å; F44-V94 HydrophobicContact CE1-CG2 4.41Å; F44-V94 HydrophobicContact CG-CG2 3.61Å
45	F	82.6	Confident	82.7	Confident	24 Å²	24	45.1 Å²	45.1	11%	0.105	25%	0.252	C	S	.	.	S	Bend	trans	-131.4	142.6	175.9	-79	-90	0	0	0	110.9	T43 N47 H51 Y52 D53 Q54 A57 F84 I85	T43-F45 HydrophobicContact CG2-CD2 4.17Å; T43-F45 HydrophobicContact CG2-CE2 3.76Å; T43-F45 WeakPolarHBondContact OG1-CE2 3.29Å; F45-N47 HydrophobicContact CD1-CB 4.23Å; F45-N47 HydrophobicContact CE1-CB 3.89Å; F45-H51 WeakPolarHBondContact CD1-O 3.46Å; F45-Y52 WeakPolarHBondContact CB-O 3.3Å; F45-D53 WeakPolarHBondContact CE1-O 3.34Å; F45-Q54 HydrophobicContact CD2-CG 4.06Å; F45-Q54 HydrophobicContact CE2-CB 4.44Å; F45-Q54 HydrophobicContact CE2-CG 3.36Å; F45-Q54 HydrophobicContact CZ-CG 3.81Å; F45-A57 HydrophobicContact CE1-CB 3.74Å; F45-A57 HydrophobicContact CZ-CB 3.96Å; F45-F84 WeakPolarHBondContact CZ-O 3.46Å; F45-I85 HydrophobicContact CE2-CG2 4.43Å
46	P	79	Confident	82.2	Confident	34 Å²	34	47.9 Å²	47.9	22%	0.221	27%	0.267	C	S	.	.	S	Bend	cis	-68.9	151.8	4.2	27.9	-35	0	0	0	114.5	H51 Y52	P46-H51 WeakPolarHBondContact CA-O 3.45Å; P46-H51 WeakPolarHBondContact CB-O 3.32Å; P46-Y52 HydrophobicContact CB-CD1 3.8Å; P46-Y52 HydrophobicContact CB-CE1 3.95Å; P46-Y52 HydrophobicContact CG-CD1 4.27Å; P46-Y52 HydrophobicContact CG-CE1 4.21Å
47	N	84.4	Confident	82.2	Confident	7 Å²	7	43.4 Å²	43.4	4%	0.037	24%	0.243	C	C	.	.			trans	-83.4	-174.6	176.8	76	6.9	0	0	0	111.4	F45 M49 D50 H51 F84 P86	F45-N47 HydrophobicContact CD1-CB 4.23Å; F45-N47 HydrophobicContact CE1-CB 3.89Å; N47-M49 PolarHBondContact O-N 2.83Å; N47-M49 WeakPolarHBondContact OD1-CA 3.4Å; N47-M49 PolarHBondContact OD1-N 3.04Å; N47-D50 PolarHBondContact O-N 2.95Å; N47-D50 PolarHBondContact OD1-N 2.94Å; N47-H51 PolarHBondContact N-O 3.45Å; N47-H51 PolarHBondContact ND2-ND1 3.31Å; N47-H51 PolarHBondContact OD1-N 3.49Å; N47-F84 PolarHBondContact ND2-O 2.91Å; N47-P86 HydrophobicContact CB-CG 4.1Å
48	M	79.4	Confident	82.7	Confident	29 Å²	29	40.3 Å²	40.3	14%	0.143	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.5	5.6	-178.3	69.2	165.2	-75.4	0	0	115.7	R96 P97 E123 L124 L129	M48-R96 HydrophobicContact SD-CB 4.4Å; M48-R96 HydrophobicContact SD-CG 4.4Å; M48-P97 HydrophobicContact SD-CG 4.2Å; M48-E123 WeakPolarHBondContact CE-O 3.47Å; M48-L124 HydrophobicContact CE-CD2 3.87Å; M48-L124 HydrophobicContact SD-CD2 4.14Å; M48-L129 HydrophobicContact CE-CD2 3.84Å; M48-L129 HydrophobicContact SD-CD2 4.29Å
49	M	83.7	Confident	82.8	Confident	23 Å²	23	43.4 Å²	43.4	11%	0.113	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-118	18.5	173.6	-70.6	168.7	-75.7	0	0	111.2	N47 H51 A83 F84 E123 L124	N47-M49 PolarHBondContact O-N 2.83Å; N47-M49 WeakPolarHBondContact OD1-CA 3.4Å; N47-M49 PolarHBondContact OD1-N 3.04Å; M49-H51 PolarHBondContact O-CD2 2.92Å; M49-H51 PolarHBondContact O-N 3.23Å; M49-H51 VanDerWaalsContact O-N 3.09Å; M49-A83 HydrophobicContact CE-CB 4.23Å; M49-A83 VanDerWaalsContact CE-O 3.27Å; M49-A83 WeakPolarHBondContact CE-O 3.28Å; M49-F84 HydrophobicContact CE-CB 4.29Å; M49-F84 HydrophobicContact CE-CD1 3.61Å; M49-F84 HydrophobicContact CE-CD2 3.82Å; M49-F84 HydrophobicContact CE-CE1 3.77Å; M49-F84 HydrophobicContact CE-CE2 3.97Å; M49-F84 HydrophobicContact CE-CG 3.63Å; M49-F84 HydrophobicContact CE-CZ 3.94Å; M49-F84 HydrophobicContact SD-CD1 4.4Å; M49-F84 HydrophobicContact SD-CE1 3.96Å; M49-F84 HydrophobicContact SD-CE2 4.37Å; M49-F84 HydrophobicContact SD-CZ 3.94Å; M49-E123 HydrophobicContact CG-CB 3.81Å; M49-E123 HydrophobicContact CG-CG 4.21Å; M49-L124 HydrophobicContact CE-CD1 4.49Å; M49-L124 HydrophobicContact CE-CD2 4.4Å; M49-L124 HydrophobicContact SD-CD1 3.96Å; M49-L124 HydrophobicContact SD-CD2 4.21Å; M49-L124 HydrophobicContact SD-CG 3.99Å
50	D	75.2	Confident	83.1	Confident	109 Å²	109	45.6 Å²	45.6	58%	0.583	23%	0.234	S	C	*	.			trans	51.4	30.1	-176.6	-62.6	-28.9	0	0	0	114	N47 Y52	N47-D50 PolarHBondContact O-N 2.95Å; N47-D50 PolarHBondContact OD1-N 2.94Å; D50-Y52 WeakPolarHBondContact O-CD2 3.26Å; D50-Y52 WeakPolarHBondContact O-CE2 3.48Å
51	H	82	Confident	83.4	Confident	26 Å²	26	44.5 Å²	44.5	12%	0.12	23%	0.23	C	C	.	.			trans	-75.9	134.5	162.2	-50.5	157.4	0	0	0	107.9	F45 P46 N47 M49 I56 A57 K60 F84	F45-H51 WeakPolarHBondContact CD1-O 3.46Å; P46-H51 WeakPolarHBondContact CA-O 3.45Å; P46-H51 WeakPolarHBondContact CB-O 3.32Å; N47-H51 PolarHBondContact N-O 3.45Å; N47-H51 PolarHBondContact ND2-ND1 3.31Å; N47-H51 PolarHBondContact OD1-N 3.49Å; M49-H51 PolarHBondContact O-CD2 2.92Å; M49-H51 PolarHBondContact O-N 3.23Å; M49-H51 VanDerWaalsContact O-N 3.09Å; H51-I56 HydrophobicContact CB-CG2 4.12Å; H51-A57 HydrophobicContact CB-CB 4.11Å; H51-K60 WeakPolarHBondContact CE1-CB 3.48Å; H51-F84 AromaticContact CE1-CD1 3.82Å; H51-F84 AromaticContact CE1-CE1 3.77Å; H51-F84 AromaticContact ND1-CD1 3.98Å
52	Y	71.8	Confident	83.7	Confident	44 Å²	44	45.1 Å²	45.1	17%	0.173	23%	0.231	C	C	.	.			trans	-97.2	-10.8	-172.1	-63.7	-79.3	0	0	0	114.9	F45 P46 D50 W157	F45-Y52 WeakPolarHBondContact CB-O 3.3Å; P46-Y52 HydrophobicContact CB-CD1 3.8Å; P46-Y52 HydrophobicContact CB-CE1 3.95Å; P46-Y52 HydrophobicContact CG-CD1 4.27Å; P46-Y52 HydrophobicContact CG-CE1 4.21Å; D50-Y52 WeakPolarHBondContact O-CD2 3.26Å; D50-Y52 WeakPolarHBondContact O-CE2 3.48Å; Y52-W157 HydrophobicContact CE1-CD2 4.25Å; Y52-W157 AromaticContact CE1-CE3 3.59Å; Y52-W157 HydrophobicContact CE1-CE3 3.59Å; Y52-W157 AromaticContact CE1-CZ3 3.85Å; Y52-W157 HydrophobicContact CE1-CZ3 3.85Å
53	D	78.6	Confident	83.8	Confident	49 Å²	49	46.1 Å²	46.1	26%	0.262	24%	0.241	S	C	.	.	S	Bend	trans	-149.7	169.3	174.6	69.2	65.8	0	0	0	112.2	F45 E55 I56 A57	F45-D53 WeakPolarHBondContact CE1-O 3.34Å; D53-E55 WeakPolarHBondContact OD1-CA 3.11Å; D53-E55 WeakPolarHBondContact OD1-CB 3.32Å; D53-E55 PolarHBondContact OD1-N 3.02Å; D53-I56 PolarHBondContact OD1-N 3.34Å; D53-I56 WeakPolarHBondContact OD2-CD1 3.38Å; D53-I56 WeakPolarHBondContact OD2-CG1 3.31Å; D53-A57 VanDerWaalsContact O-CB 3.3Å; D53-A57 WeakPolarHBondContact O-CB 3.45Å; D53-A57 PolarHBondContact O-N 3.48Å
54	Q	86.5	Confident	83.9	Confident	2 Å²	2	46.9 Å²	46.9	1%	0.009	24%	0.244	C	C	.	.	H	α-helix	trans	-67.9	-27.4	-178.6	-79.3	-171.7	68.5	0	0	114.9	E28 P29 V32 T43 F45 A58	E28-Q54 PolarHBondContact OE1-NE2 2.9Å; P29-Q54 PolarHBondContact O-NE2 3.42Å; V32-Q54 HydrophobicContact CG2-CB 3.82Å; V32-Q54 HydrophobicContact CG2-CG 4.4Å; V32-Q54 VanDerWaalsContact CG2-O 3.29Å; V32-Q54 WeakPolarHBondContact CG2-O 3.44Å; T43-Q54 HydrophobicContact CG2-CG 4.17Å; F45-Q54 HydrophobicContact CD2-CG 4.06Å; F45-Q54 HydrophobicContact CE2-CB 4.44Å; F45-Q54 HydrophobicContact CE2-CG 3.36Å; F45-Q54 HydrophobicContact CZ-CG 3.81Å; Q54-A58 VanDerWaalsContact O-CB 3.29Å; Q54-A58 WeakPolarHBondContact O-CB 3.4Å; Q54-A58 PolarHBondContact O-N 3.48Å
55	E	80.3	Confident	84.2	Confident	134 Å²	134	45.7 Å²	45.7	63%	0.626	24%	0.24	S	C	*	.	H	α-helix	trans	-81.3	-42.2	-176.1	-64.5	174.2	-153.4	0	0	110	D53 A58 S59	D53-E55 WeakPolarHBondContact OD1-CA 3.11Å; D53-E55 WeakPolarHBondContact OD1-CB 3.32Å; D53-E55 PolarHBondContact OD1-N 3.02Å; E55-A58 PolarHBondContact O-N 3.22Å; E55-S59 WeakPolarHBondContact O-CB 3.21Å; E55-S59 PolarHBondContact O-N 3.24Å
56	I	77.9	Confident	84.5	Confident	59 Å²	59	46.6 Å²	46.6	30%	0.303	25%	0.248	S	C	.	.	H	α-helix	trans	-59.2	-47.3	166.4	-64.7	177.2	0	0	0	109.9	H51 D53 A58 S59 K60	H51-I56 HydrophobicContact CB-CG2 4.12Å; D53-I56 PolarHBondContact OD1-N 3.34Å; D53-I56 WeakPolarHBondContact OD2-CD1 3.38Å; D53-I56 WeakPolarHBondContact OD2-CG1 3.31Å; I56-A58 PolarHBondContact O-N 3.32Å; I56-S59 PolarHBondContact O-N 2.95Å; I56-K60 HydrophobicContact CG2-CG 4.35Å; I56-K60 VanDerWaalsContact O-CG 3.32Å; I56-K60 WeakPolarHBondContact O-CG 3.18Å; I56-K60 PolarHBondContact O-N 3.46Å
57	A	88.4	Confident	84.9	Confident	0 Å²	0	45 Å²	45	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-63.5	-39.8	-179.8	0	0	0	0	0	112.9	F45 H51 D53 K60 M61 F84	F45-A57 HydrophobicContact CE1-CB 3.74Å; F45-A57 HydrophobicContact CZ-CB 3.96Å; H51-A57 HydrophobicContact CB-CB 4.11Å; D53-A57 VanDerWaalsContact O-CB 3.3Å; D53-A57 WeakPolarHBondContact O-CB 3.45Å; D53-A57 PolarHBondContact O-N 3.48Å; A57-K60 PolarHBondContact O-N 3.48Å; A57-M61 VanDerWaalsContact O-CB 3.28Å; A57-M61 WeakPolarHBondContact O-CB 3.48Å; A57-M61 PolarHBondContact O-N 3.49Å; A57-F84 WeakPolarHBondContact O-CD1 3.31Å
58	A	88.6	Confident	85.1	Confident	21 Å²	21	45.1 Å²	45.1	17%	0.174	24%	0.24	C	C	.	.	H	α-helix	trans	-62.4	-47	172.8	0	0	0	0	0	111.9	V32 Q54 E55 I56 K60 M61 E62	V32-A58 HydrophobicContact CB-CB 4.49Å; V32-A58 HydrophobicContact CG1-CB 3.7Å; V32-A58 HydrophobicContact CG2-CB 3.93Å; Q54-A58 VanDerWaalsContact O-CB 3.29Å; Q54-A58 WeakPolarHBondContact O-CB 3.4Å; Q54-A58 PolarHBondContact O-N 3.48Å; E55-A58 PolarHBondContact O-N 3.22Å; I56-A58 PolarHBondContact O-N 3.32Å; A58-K60 VanDerWaalsContact C-N 3.29Å; A58-K60 PolarHBondContact O-N 3.22Å; A58-M61 WeakPolarHBondContact O-CB 3.29Å; A58-M61 PolarHBondContact O-N 3.03Å; A58-E62 PolarHBondContact O-N 3.45Å
59	S	87.6	Confident	85.4	Confident	86 Å²	86	47.5 Å²	47.5	60%	0.601	26%	0.259	S	S	*	.	H	α-helix	trans	-58.8	-38.8	177.3	179.8	0	0	0	0	112.6	E55 I56	E55-S59 WeakPolarHBondContact O-CB 3.21Å; E55-S59 PolarHBondContact O-N 3.24Å; I56-S59 PolarHBondContact O-N 2.95Å
60	K	88.6	Confident	85.6	Confident	121 Å²	121	51 Å²	51	53%	0.526	28%	0.278	S	S	.	.	H	α-helix	trans	-77.7	-19.4	175.3	-63.7	-66.9	-176.1	-179.1	0	113.8	H51 I56 A57 A58 F84	H51-K60 WeakPolarHBondContact CE1-CB 3.48Å; I56-K60 HydrophobicContact CG2-CG 4.35Å; I56-K60 VanDerWaalsContact O-CG 3.32Å; I56-K60 WeakPolarHBondContact O-CG 3.18Å; I56-K60 PolarHBondContact O-N 3.46Å; A57-K60 PolarHBondContact O-N 3.48Å; A58-K60 VanDerWaalsContact C-N 3.29Å; A58-K60 PolarHBondContact O-N 3.22Å; K60-F84 VanDerWaalsContact C-CE1 3.48Å; K60-F84 HydrophobicContact CB-CD1 4.47Å; K60-F84 HydrophobicContact CB-CE1 4.02Å; K60-F84 WeakPolarHBondContact O-CE1 3.42Å
61	M	91.6	Very high	86.2	Confident	1 Å²	1	53.3 Å²	53.3	1%	0.005	29%	0.285	C	S	.	.	H	α-helix	trans	-84.1	-28.2	175	-170.4	175.7	66.2	0	0	112.6	V32 R34 A57 A58 P63 F64 M65 L80 F84	V32-M61 HydrophobicContact CG1-CE 4.32Å; R34-M61 HydrophobicContact CB-CE 3.94Å; R34-M61 HydrophobicContact CG-CE 4.45Å; A57-M61 VanDerWaalsContact O-CB 3.28Å; A57-M61 WeakPolarHBondContact O-CB 3.48Å; A57-M61 PolarHBondContact O-N 3.49Å; A58-M61 WeakPolarHBondContact O-CB 3.29Å; A58-M61 PolarHBondContact O-N 3.03Å; M61-P63 VanDerWaalsContact C-CD 3.41Å; M61-P63 VanDerWaalsContact C-N 3.34Å; M61-F64 WeakPolarHBondContact O-CB 3.3Å; M61-F64 PolarHBondContact O-N 3.38Å; M61-M65 HydrophobicContact CE-SD 4.15Å; M61-M65 HydrophobicContact CG-SD 4.5Å; M61-M65 PolarHBondContact O-N 3.33Å; M61-L80 HydrophobicContact SD-CB 4.34Å; M61-F84 HydrophobicContact CB-CB 4.21Å; M61-F84 HydrophobicContact CB-CD1 3.67Å; M61-F84 HydrophobicContact CB-CD2 4.07Å; M61-F84 HydrophobicContact CB-CE1 4Å; M61-F84 HydrophobicContact CB-CE2 4.39Å; M61-F84 HydrophobicContact CB-CG 3.71Å; M61-F84 HydrophobicContact CB-CZ 4.36Å; M61-F84 HydrophobicContact CG-CB 4.27Å; M61-F84 HydrophobicContact CG-CD1 4.29Å; M61-F84 HydrophobicContact CG-CD2 3.77Å; M61-F84 HydrophobicContact CG-CE2 4.16Å; M61-F84 HydrophobicContact CG-CG 3.85Å; M61-F84 HydrophobicContact SD-CB 3.87Å; M61-F84 HydrophobicContact SD-CD2 4.15Å; M61-F84 HydrophobicContact SD-CG 4.1Å
62	E	90.2	Very high	86.6	Confident	87 Å²	87	53.6 Å²	53.6	41%	0.407	29%	0.289	S	S	.	.	G	3₁₀ helix	trans	-54.2	-36.6	-175.3	-157.5	65.2	-155.4	0	0	114.6	R34 A58 F64 M65	R34-E62 IonicContact CZ-OE1 2.97Å; R34-E62 IonicContact NE-OE1 3.54Å; R34-E62 IonicContact NE-OE2 3.57Å; R34-E62 IonicContact NH2-OE1 2.66Å; R34-E62 PolarHBondContact NH2-OE1 2.66Å; A58-E62 PolarHBondContact O-N 3.45Å; E62-F64 PolarHBondContact O-N 3.02Å; E62-F64 VanDerWaalsContact O-N 3.13Å; E62-M65 VanDerWaalsContact O-CB 3.31Å; E62-M65 WeakPolarHBondContact O-CB 3.25Å; E62-M65 PolarHBondContact O-N 2.84Å
63	P	90.1	Very high	87.6	Confident	78 Å²	78	51.6 Å²	51.6	51%	0.506	28%	0.282	S	S	.	.	G	3₁₀ helix	trans	-59.7	-21.9	173.2	-25.7	36.1	0	0	0	115.2	M61 P66 I118	M61-P63 VanDerWaalsContact C-CD 3.41Å; M61-P63 VanDerWaalsContact C-N 3.34Å; P63-P66 WeakPolarHBondContact O-CD 3.2Å; P63-I118 WeakPolarHBondContact O-CD1 3.45Å
64	F	90.9	Very high	88.1	Confident	16 Å²	16	55 Å²	55	7%	0.07	31%	0.307	C	S	.	.	G	3₁₀ helix	trans	-93.1	-10.6	177.8	-57	-94.1	0	0	0	112.5	M61 E62 P66 L67 L80 F84 I118 W120 P121	M61-F64 WeakPolarHBondContact O-CB 3.3Å; M61-F64 PolarHBondContact O-N 3.38Å; E62-F64 PolarHBondContact O-N 3.02Å; E62-F64 VanDerWaalsContact O-N 3.13Å; F64-P66 VanDerWaalsContact C-N 3.35Å; F64-L67 WeakPolarHBondContact O-CB 3.42Å; F64-L67 PolarHBondContact O-N 3.38Å; F64-L67 VanDerWaalsContact O-N 3.09Å; F64-L80 HydrophobicContact CB-CD1 3.82Å; F64-L80 HydrophobicContact CB-CD2 3.63Å; F64-L80 HydrophobicContact CB-CG 4.4Å; F64-L80 HydrophobicContact CD1-CD2 4.22Å; F64-L80 HydrophobicContact CG-CD2 3.99Å; F64-F84 HydrophobicContact CD2-CE2 4.2Å; F64-F84 AromaticContact CD2-CZ 3.76Å; F64-F84 HydrophobicContact CD2-CZ 3.76Å; F64-F84 HydrophobicContact CE2-CE2 4.45Å; F64-F84 AromaticContact CE2-CZ 3.71Å; F64-F84 HydrophobicContact CE2-CZ 3.71Å; F64-F84 HydrophobicContact CZ-CZ 4.46Å; F64-I118 HydrophobicContact CD1-CG2 3.62Å; F64-I118 HydrophobicContact CE1-CG2 3.43Å; F64-I118 VanDerWaalsContact CE1-CG2 3.43Å; F64-I118 HydrophobicContact CZ-CG2 4.22Å; F64-W120 HydrophobicContact CE1-CE3 4.34Å; F64-P121 HydrophobicContact CZ-CG 4.39Å
65	M	90	Very high	88.2	Confident	10 Å²	10	56.7 Å²	56.7	5%	0.049	32%	0.316	C	S	.	.	H	α-helix	trans	-62.3	-24.3	-179.5	-69.2	-59.2	-44.3	0	0	115.8	R34 M61 E62 L67 A68 S69	R34-M65 HydrophobicContact CB-CE 4.4Å; R34-M65 HydrophobicContact CB-SD 4.31Å; R34-M65 HydrophobicContact CG-CE 4.09Å; R34-M65 HydrophobicContact CG-SD 4.08Å; M61-M65 HydrophobicContact CE-SD 4.15Å; M61-M65 HydrophobicContact CG-SD 4.5Å; M61-M65 PolarHBondContact O-N 3.33Å; E62-M65 VanDerWaalsContact O-CB 3.31Å; E62-M65 WeakPolarHBondContact O-CB 3.25Å; E62-M65 PolarHBondContact O-N 2.84Å; M65-L67 VanDerWaalsContact C-N 3.27Å; M65-L67 PolarHBondContact O-N 2.86Å; M65-A68 HydrophobicContact CE-CB 3.92Å; M65-A68 PolarHBondContact O-N 3.47Å; M65-S69 WeakPolarHBondContact O-CB 3.32Å; M65-S69 PolarHBondContact O-N 3.4Å; M65-S69 PolarHBondContact O-OG 3.27Å
66	P	89.1	Confident	88.8	Confident	42 Å²	42	50.5 Å²	50.5	27%	0.273	29%	0.287	S	S	.	.	H	α-helix	trans	-56.8	-39.9	168.8	-27.4	36.8	0	0	0	112.7	P63 F64 A68 S69 L70 F116	P63-P66 WeakPolarHBondContact O-CD 3.2Å; F64-P66 VanDerWaalsContact C-N 3.35Å; P66-A68 PolarHBondContact O-N 2.89Å; P66-S69 PolarHBondContact O-N 3.23Å; P66-L70 WeakPolarHBondContact O-CB 3.28Å; P66-L70 WeakPolarHBondContact O-CG 3.5Å; P66-L70 PolarHBondContact O-N 3.16Å; P66-F116 HydrophobicContact CB-CD1 4.27Å; P66-F116 HydrophobicContact CB-CD2 3.97Å; P66-F116 HydrophobicContact CB-CE1 4.33Å; P66-F116 HydrophobicContact CB-CE2 4.08Å; P66-F116 HydrophobicContact CB-CG 4.11Å; P66-F116 HydrophobicContact CB-CZ 4.26Å
67	L	88.7	Confident	89.4	Confident	1 Å²	1	50.9 Å²	50.9	1%	0.005	29%	0.288	C	S	.	.	H	α-helix	trans	-64.5	-43	179.4	-52.9	179.8	0	0	0	111.5	F64 M65 Q71 C72 V76 C109 N112 I113 I118	F64-L67 WeakPolarHBondContact O-CB 3.42Å; F64-L67 PolarHBondContact O-N 3.38Å; F64-L67 VanDerWaalsContact O-N 3.09Å; M65-L67 VanDerWaalsContact C-N 3.27Å; M65-L67 PolarHBondContact O-N 2.86Å; L67-Q71 PolarHBondContact O-N 2.96Å; L67-Q71 VanDerWaalsContact O-N 3.08Å; L67-C72 PolarHBondContact O-SG 2.89Å; L67-V76 HydrophobicContact CB-CG2 3.82Å; L67-C109 HydrophobicContact CD2-CB 4.36Å; L67-N112 HydrophobicContact CD2-CB 3.53Å; L67-I113 HydrophobicContact CD1-CD1 4.33Å; L67-I113 HydrophobicContact CD1-CG1 3.76Å; L67-I113 HydrophobicContact CD2-CG1 4.06Å; L67-I118 HydrophobicContact CD1-CD1 3.88Å; L67-I118 HydrophobicContact CD2-CD1 3.87Å; L67-I118 HydrophobicContact CG-CD1 3.71Å
68	A	87.2	Confident	89.4	Confident	10 Å²	10	54.8 Å²	54.8	8%	0.083	31%	0.306	C	S	.	.	H	α-helix	trans	-70.5	-30.5	175.1	0	0	0	0	0	113.5	M65 P66 H77 L80	M65-A68 HydrophobicContact CE-CB 3.92Å; M65-A68 PolarHBondContact O-N 3.47Å; P66-A68 PolarHBondContact O-N 2.89Å; A68-H77 HydrophobicContact CB-CB 4.33Å; A68-L80 HydrophobicContact CB-CD1 4.22Å
69	S	85.9	Confident	89.5	Confident	78 Å²	78	53.9 Å²	53.9	55%	0.545	30%	0.298	S	S	.	.	H	α-helix	trans	-76.2	-30.8	178.5	-55.2	0	0	0	0	112.5	M65 P66	M65-S69 WeakPolarHBondContact O-CB 3.32Å; M65-S69 PolarHBondContact O-N 3.4Å; M65-S69 PolarHBondContact O-OG 3.27Å; P66-S69 PolarHBondContact O-N 3.23Å
70	L	88.1	Confident	89.7	Confident	98 Å²	98	49.9 Å²	49.9	51%	0.513	27%	0.27	S	S	.	.	H	α-helix	trans	-88.2	-10.3	175.1	-67.9	170	0	0	0	113.7	P66 C72 F116	P66-L70 WeakPolarHBondContact O-CB 3.28Å; P66-L70 WeakPolarHBondContact O-CG 3.5Å; P66-L70 PolarHBondContact O-N 3.16Å; L70-C72 VanDerWaalsContact C-N 3.28Å; L70-C72 PolarHBondContact O-N 3.34Å; L70-F116 HydrophobicContact CD1-CE2 3.45Å; L70-F116 VanDerWaalsContact CD1-CE2 3.45Å; L70-F116 HydrophobicContact CD1-CZ 3.74Å
71	Q	87.3	Confident	89.9	Confident	157 Å²	157	44.2 Å²	44.2	73%	0.734	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.7	40.8	178.8	-57.1	-176.6	-5.7	0	0	113.5	L67 S73	L67-Q71 PolarHBondContact O-N 2.96Å; L67-Q71 VanDerWaalsContact O-N 3.08Å; Q71-S73 PolarHBondContact O-N 2.61Å; Q71-S73 VanDerWaalsContact O-N 3.14Å
72	C	91.3	Very high	89.8	Confident	31 Å²	31	45.8 Å²	45.8	21%	0.209	25%	0.252	C	S	.	.			trans	-59.7	-26	-175.5	47	0	0	0	0	114.3	L67 L70 C109 N112	L67-C72 PolarHBondContact O-SG 2.89Å; L70-C72 VanDerWaalsContact C-N 3.28Å; L70-C72 PolarHBondContact O-N 3.34Å; C72-C109 HydrophobicContact CB-CB 3.95Å; C72-C109 WeakPolarHBondContact CB-SG 3.32Å; C72-C109 WeakPolarHBondContact SG-CB 3.19Å; C72-C109 CovalentContact SG-SG 2.04Å; C72-C109 PolarHBondContact SG-SG 3.41Å; C72-N112 WeakPolarHBondContact CB-ND2 3.33Å
73	S	93.3	Very high	89.8	Confident	3 Å²	3	41.7 Å²	41.7	2%	0.021	23%	0.233	C	C	.	.	S	Bend	trans	-130.6	145.1	170	-176	0	0	0	0	109.3	Q71 D75 V76 D108	Q71-S73 PolarHBondContact O-N 2.61Å; Q71-S73 VanDerWaalsContact O-N 3.14Å; S73-D75 PolarHBondContact O-N 2.84Å; S73-D75 VanDerWaalsContact O-N 3.16Å; S73-D75 PolarHBondContact OG-N 3.27Å; S73-V76 VanDerWaalsContact O-CG1 3.25Å; S73-V76 WeakPolarHBondContact O-CG1 3.44Å; S73-V76 PolarHBondContact O-N 3.46Å; S73-D108 WeakPolarHBondContact CB-OD2 3.23Å; S73-D108 PolarHBondContact OG-OD2 3.42Å
74	P	88.4	Confident	89.9	Confident	121 Å²	121	38.1 Å²	38.1	79%	0.786	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-24.2	172.5	25.6	-35.5	0	0	0	113.2
75	D	89.3	Confident	89.9	Confident	37 Å²	37	37.3 Å²	37.3	20%	0.198	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.6	-8.1	-177.9	-104.3	-44.8	0	0	0	114.5	S73 H77 H78 F79 K101 V105	S73-D75 PolarHBondContact O-N 2.84Å; S73-D75 VanDerWaalsContact O-N 3.16Å; S73-D75 PolarHBondContact OG-N 3.27Å; D75-H77 PolarHBondContact O-N 3.46Å; D75-H78 PolarHBondContact O-N 2.94Å; D75-F79 WeakPolarHBondContact O-CB 3.41Å; D75-F79 PolarHBondContact O-N 3.34Å; D75-K101 IonicContact OD1-NZ 2.74Å; D75-K101 PolarHBondContact OD1-NZ 3.48Å; D75-K101 IonicContact OD2-NZ 3.81Å; D75-K101 PolarHBondContact OD2-NZ 3.4Å; D75-V105 HydrophobicContact CB-CG2 3.77Å
76	V	92.2	Very high	89.9	Confident	3 Å²	3	36.9 Å²	36.9	2%	0.018	20%	0.204	C	C	.	.	H	α-helix	trans	-57.6	-43.7	-168.3	67.6	0	0	0	0	113.6	L67 S73 L80 V105	L67-V76 HydrophobicContact CB-CG2 3.82Å; S73-V76 VanDerWaalsContact O-CG1 3.25Å; S73-V76 WeakPolarHBondContact O-CG1 3.44Å; S73-V76 PolarHBondContact O-N 3.46Å; V76-L80 HydrophobicContact CG2-CD1 4.1Å; V76-L80 WeakPolarHBondContact O-CB 3.33Å; V76-L80 VanDerWaalsContact O-CG 3.31Å; V76-L80 WeakPolarHBondContact O-CG 3.29Å; V76-L80 PolarHBondContact O-N 3.14Å; V76-V105 HydrophobicContact CB-CG1 4.08Å; V76-V105 HydrophobicContact CB-CG2 4.44Å; V76-V105 HydrophobicContact CG2-CG1 3.87Å
77	H	90.4	Very high	89.8	Confident	68 Å²	68	35.2 Å²	35.2	32%	0.315	19%	0.194	S	C	.	.	H	α-helix	trans	-71.3	-42.4	-177.6	174.4	-110.4	0	0	0	111.5	R34 A68 D75 L80 C81	R34-H77 PolarHBondContact O-NE2 3.27Å; A68-H77 HydrophobicContact CB-CB 4.33Å; D75-H77 PolarHBondContact O-N 3.46Å; H77-L80 PolarHBondContact O-N 3.42Å; H77-C81 WeakPolarHBondContact O-CB 3.25Å; H77-C81 PolarHBondContact O-N 2.76Å
78	H	89.2	Confident	89.6	Confident	82 Å²	82	35.8 Å²	35.8	38%	0.38	20%	0.198	S	C	.	.	H	α-helix	trans	-63.5	-43.3	174.8	-77.2	90.7	0	0	0	111.7	M38 D75 Q82	M38-H78 HydrophobicContact CE-CB 4.45Å; D75-H78 PolarHBondContact O-N 2.94Å; H78-Q82 VanDerWaalsContact O-CB 3.27Å; H78-Q82 WeakPolarHBondContact O-CB 3.37Å; H78-Q82 PolarHBondContact O-N 3.4Å
79	F	90.9	Very high	89	Confident	1 Å²	1	37.5 Å²	37.5	0%	0.004	21%	0.209	C	C	.	.	H	α-helix	trans	-61.2	-48.3	177	174.3	-98.2	0	0	0	111.9	D75 Q82 A83 P97 C102 V105 W120 L124 L129	D75-F79 WeakPolarHBondContact O-CB 3.41Å; D75-F79 PolarHBondContact O-N 3.34Å; F79-Q82 PolarHBondContact O-N 3.04Å; F79-A83 VanDerWaalsContact O-CB 3.29Å; F79-A83 WeakPolarHBondContact O-CB 3.44Å; F79-A83 PolarHBondContact O-N 3.42Å; F79-P97 HydrophobicContact CD2-CB 3.72Å; F79-P97 HydrophobicContact CD2-CG 4.42Å; F79-P97 HydrophobicContact CE2-CB 3.69Å; F79-P97 HydrophobicContact CE2-CG 4.01Å; F79-C102 HydrophobicContact CD2-CB 4.37Å; F79-C102 HydrophobicContact CE2-CB 3.58Å; F79-C102 HydrophobicContact CZ-CB 4Å; F79-V105 HydrophobicContact CB-CG2 4.07Å; F79-V105 HydrophobicContact CD1-CG1 4.19Å; F79-V105 HydrophobicContact CG-CG2 4.41Å; F79-W120 HydrophobicContact CD1-CH2 4.42Å; F79-W120 AromaticContact CE1-CH2 3.65Å; F79-W120 HydrophobicContact CE1-CH2 3.65Å; F79-W120 AromaticContact CE1-CZ2 3.62Å; F79-W120 HydrophobicContact CE1-CZ2 3.62Å; F79-W120 HydrophobicContact CZ-CH2 4.36Å; F79-W120 AromaticContact CZ-CZ2 3.89Å; F79-W120 HydrophobicContact CZ-CZ2 3.89Å; F79-L124 HydrophobicContact CE1-CD1 4.49Å; F79-L129 HydrophobicContact CE2-CD1 4.26Å
80	L	91.9	Very high	87.9	Confident	3 Å²	3	42.3 Å²	42.3	2%	0.016	22%	0.223	C	C	.	.	H	α-helix	trans	-63.6	-47.7	178.7	-71.3	171.9	0	0	0	111.6	M61 F64 A68 V76 H77 Q82 A83 F84	M61-L80 HydrophobicContact SD-CB 4.34Å; F64-L80 HydrophobicContact CB-CD1 3.82Å; F64-L80 HydrophobicContact CB-CD2 3.63Å; F64-L80 HydrophobicContact CB-CG 4.4Å; F64-L80 HydrophobicContact CD1-CD2 4.22Å; F64-L80 HydrophobicContact CG-CD2 3.99Å; A68-L80 HydrophobicContact CB-CD1 4.22Å; V76-L80 HydrophobicContact CG2-CD1 4.1Å; V76-L80 WeakPolarHBondContact O-CB 3.33Å; V76-L80 VanDerWaalsContact O-CG 3.31Å; V76-L80 WeakPolarHBondContact O-CG 3.29Å; V76-L80 PolarHBondContact O-N 3.14Å; H77-L80 PolarHBondContact O-N 3.42Å; L80-Q82 VanDerWaalsContact C-N 3.31Å; L80-Q82 PolarHBondContact O-N 3.34Å; L80-A83 PolarHBondContact O-N 3.36Å; L80-F84 HydrophobicContact CD2-CD2 4.38Å; L80-F84 HydrophobicContact CD2-CE2 3.94Å; L80-F84 WeakPolarHBondContact O-CD2 3.39Å; L80-F84 PolarHBondContact O-N 3.12Å
81	C	91.9	Very high	86.6	Confident	1 Å²	1	45.1 Å²	45.1	1%	0.007	23%	0.234	C	C	.	.	H	α-helix	trans	-60.4	-40.2	175.7	-74.5	0	0	0	0	112	C35 M38 Y40 H77 I85	C35-C81 VanDerWaalsContact CA-SG 3.52Å; C35-C81 HydrophobicContact CB-CB 3.85Å; C35-C81 WeakPolarHBondContact CB-SG 3.36Å; C35-C81 VanDerWaalsContact SG-CA 3.51Å; C35-C81 WeakPolarHBondContact SG-CB 3.48Å; C35-C81 CovalentContact SG-SG 2.04Å; C35-C81 PolarHBondContact SG-SG 2.9Å; M38-C81 HydrophobicContact CE-CB 3.63Å; M38-C81 HydrophobicContact CG-CB 4.08Å; M38-C81 HydrophobicContact SD-CB 3.73Å; Y40-C81 PolarHBondContact OH-O 3.45Å; H77-C81 WeakPolarHBondContact O-CB 3.25Å; H77-C81 PolarHBondContact O-N 2.76Å; C81-I85 CarbonylContact O-C 3.58Å; C81-I85 VanDerWaalsContact O-CA 3.25Å; C81-I85 WeakPolarHBondContact O-CA 3.22Å; C81-I85 WeakPolarHBondContact O-CB 3.32Å; C81-I85 PolarHBondContact O-N 3.02Å
82	Q	90.2	Very high	85.5	Confident	35 Å²	35	40.7 Å²	40.7	16%	0.164	22%	0.215	C	C	.	.	H	α-helix	trans	-71.6	-29.7	177.8	-162.6	-178.5	9.1	0	0	113.5	Y40 H78 F79 L80 P86 I95 R96 P97	Y40-Q82 WeakPolarHBondContact OH-CA 3.28Å; Y40-Q82 PolarHBondContact OH-N 2.92Å; H78-Q82 VanDerWaalsContact O-CB 3.27Å; H78-Q82 WeakPolarHBondContact O-CB 3.37Å; H78-Q82 PolarHBondContact O-N 3.4Å; F79-Q82 PolarHBondContact O-N 3.04Å; L80-Q82 VanDerWaalsContact C-N 3.31Å; L80-Q82 PolarHBondContact O-N 3.34Å; Q82-P86 WeakPolarHBondContact O-CA 3.46Å; Q82-P86 WeakPolarHBondContact O-CB 3.37Å; Q82-I95 WeakPolarHBondContact CG-O 3.34Å; Q82-I95 PolarHBondContact NE2-O 3.42Å; Q82-R96 VanDerWaalsContact NE2-C 3.34Å; Q82-R96 PolarHBondContact NE2-O 3.29Å; Q82-R96 VanDerWaalsContact NE2-O 3.11Å; Q82-P97 HydrophobicContact CG-CB 4.49Å
83	A	90.2	Very high	84.4	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-72.8	-50.6	175.9	0	0	0	0	0	112.2	M49 F79 L80 P97 L124	M49-A83 HydrophobicContact CE-CB 4.23Å; M49-A83 VanDerWaalsContact CE-O 3.27Å; M49-A83 WeakPolarHBondContact CE-O 3.28Å; F79-A83 VanDerWaalsContact O-CB 3.29Å; F79-A83 WeakPolarHBondContact O-CB 3.44Å; F79-A83 PolarHBondContact O-N 3.42Å; L80-A83 PolarHBondContact O-N 3.36Å; A83-P97 HydrophobicContact CB-CG 4.26Å; A83-L124 HydrophobicContact CB-CD1 4.19Å; A83-L124 HydrophobicContact CB-CD2 3.78Å
84	F	91.3	Very high	83.7	Confident	3 Å²	3	46.8 Å²	46.8	1%	0.013	24%	0.238	C	C	.	.	H	α-helix	trans	-85.7	-30.2	-174.3	-73.1	-96.3	0	0	0	113.1	F45 N47 M49 H51 A57 K60 M61 F64 L80 L124	F45-F84 WeakPolarHBondContact CZ-O 3.46Å; N47-F84 PolarHBondContact ND2-O 2.91Å; M49-F84 HydrophobicContact CE-CB 4.29Å; M49-F84 HydrophobicContact CE-CD1 3.61Å; M49-F84 HydrophobicContact CE-CD2 3.82Å; M49-F84 HydrophobicContact CE-CE1 3.77Å; M49-F84 HydrophobicContact CE-CE2 3.97Å; M49-F84 HydrophobicContact CE-CG 3.63Å; M49-F84 HydrophobicContact CE-CZ 3.94Å; M49-F84 HydrophobicContact SD-CD1 4.4Å; M49-F84 HydrophobicContact SD-CE1 3.96Å; M49-F84 HydrophobicContact SD-CE2 4.37Å; M49-F84 HydrophobicContact SD-CZ 3.94Å; H51-F84 AromaticContact CE1-CD1 3.82Å; H51-F84 AromaticContact CE1-CE1 3.77Å; H51-F84 AromaticContact ND1-CD1 3.98Å; A57-F84 WeakPolarHBondContact O-CD1 3.31Å; K60-F84 VanDerWaalsContact C-CE1 3.48Å; K60-F84 HydrophobicContact CB-CD1 4.47Å; K60-F84 HydrophobicContact CB-CE1 4.02Å; K60-F84 WeakPolarHBondContact O-CE1 3.42Å; M61-F84 HydrophobicContact CB-CB 4.21Å; M61-F84 HydrophobicContact CB-CD1 3.67Å; M61-F84 HydrophobicContact CB-CD2 4.07Å; M61-F84 HydrophobicContact CB-CE1 4Å; M61-F84 HydrophobicContact CB-CE2 4.39Å; M61-F84 HydrophobicContact CB-CG 3.71Å; M61-F84 HydrophobicContact CB-CZ 4.36Å; M61-F84 HydrophobicContact CG-CB 4.27Å; M61-F84 HydrophobicContact CG-CD1 4.29Å; M61-F84 HydrophobicContact CG-CD2 3.77Å; M61-F84 HydrophobicContact CG-CE2 4.16Å; M61-F84 HydrophobicContact CG-CG 3.85Å; M61-F84 HydrophobicContact SD-CB 3.87Å; M61-F84 HydrophobicContact SD-CD2 4.15Å; M61-F84 HydrophobicContact SD-CG 4.1Å; F64-F84 HydrophobicContact CD2-CE2 4.2Å; F64-F84 AromaticContact CD2-CZ 3.76Å; F64-F84 HydrophobicContact CD2-CZ 3.76Å; F64-F84 HydrophobicContact CE2-CE2 4.45Å; F64-F84 AromaticContact CE2-CZ 3.71Å; F64-F84 HydrophobicContact CE2-CZ 3.71Å; F64-F84 HydrophobicContact CZ-CZ 4.46Å; L80-F84 HydrophobicContact CD2-CD2 4.38Å; L80-F84 HydrophobicContact CD2-CE2 3.94Å; L80-F84 WeakPolarHBondContact O-CD2 3.39Å; L80-F84 PolarHBondContact O-N 3.12Å; F84-L124 HydrophobicContact CE2-CD1 4.26Å
85	I	91.8	Very high	83.3	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	21%	0.214	C	C	.	.	S	Bend	trans	-134.9	68.8	-174.2	-48.1	-175.9	0	0	0	108.7	I30 V32 C35 Y40 T43 F45 C81	I30-I85 HydrophobicContact CD1-CG2 4.42Å; I30-I85 HydrophobicContact CG1-CG2 4.15Å; I30-I85 HydrophobicContact CG2-CG2 4.46Å; V32-I85 HydrophobicContact CB-CD1 3.44Å; V32-I85 VanDerWaalsContact CB-CD1 3.44Å; V32-I85 HydrophobicContact CG1-CD1 3.82Å; V32-I85 HydrophobicContact CG2-CD1 3.43Å; V32-I85 VanDerWaalsContact CG2-CD1 3.43Å; C35-I85 HydrophobicContact CB-CD1 4.06Å; Y40-I85 VanDerWaalsContact CE2-O 3.25Å; Y40-I85 WeakPolarHBondContact CE2-O 3.41Å; Y40-I85 PolarHBondContact OH-O 2.89Å; T43-I85 HydrophobicContact CG2-CG2 3.88Å; T43-I85 WeakPolarHBondContact OG1-CG2 3.22Å; F45-I85 HydrophobicContact CE2-CG2 4.43Å; C81-I85 CarbonylContact O-C 3.58Å; C81-I85 VanDerWaalsContact O-CA 3.25Å; C81-I85 WeakPolarHBondContact O-CA 3.22Å; C81-I85 WeakPolarHBondContact O-CB 3.32Å; C81-I85 PolarHBondContact O-N 3.02Å
86	P	89.9	Confident	82.9	Confident	1 Å²	1	49.3 Å²	49.3	1%	0.006	23%	0.233	C	C	.	.			trans	-69.7	144.6	-168.8	29.5	-36.4	0	0	0	111.9	T43 F44 N47 Q82 V94	T43-P86 VanDerWaalsContact CA-O 3.26Å; T43-P86 WeakPolarHBondContact CA-O 3.42Å; T43-P86 WeakPolarHBondContact CB-O 3.3Å; T43-P86 PolarHBondContact OG1-O 2.71Å; F44-P86 PolarHBondContact N-O 3.2Å; N47-P86 HydrophobicContact CB-CG 4.1Å; Q82-P86 WeakPolarHBondContact O-CA 3.46Å; Q82-P86 WeakPolarHBondContact O-CB 3.37Å; P86-V94 HydrophobicContact CB-CG1 3.61Å; P86-V94 HydrophobicContact CG-CG1 3.67Å
87	A	86.4	Confident	82.7	Confident	6 Å²	6	49.3 Å²	49.3	5%	0.05	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.4	140.2	-180	0	0	0	0	0	112.1	Y40 V94 I95	Y40-A87 HydrophobicContact CD1-CB 3.62Å; Y40-A87 HydrophobicContact CD2-CB 3.46Å; Y40-A87 VanDerWaalsContact CD2-CB 3.46Å; Y40-A87 HydrophobicContact CE1-CB 3.96Å; Y40-A87 HydrophobicContact CE2-CB 3.81Å; Y40-A87 HydrophobicContact CG-CB 3.36Å; A87-V94 CarbonylContact O-C 3.56Å; A87-V94 WeakPolarHBondContact O-CA 3.38Å; A87-I95 HydrophobicContact CB-CB 4.22Å; A87-I95 HydrophobicContact CB-CD1 4.34Å; A87-I95 HydrophobicContact CB-CG1 4.37Å; A87-I95 PolarHBondContact O-N 3.08Å
88	C	84.1	Confident	82.6	Confident	14 Å²	14	47 Å²	47	10%	0.095	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	120	177.4	-166.6	0	0	0	0	110.5	C27 M42 F44	C27-C88 VanDerWaalsContact CA-SG 3.59Å; C27-C88 HydrophobicContact CB-CB 3.67Å; C27-C88 WeakPolarHBondContact CB-SG 3.23Å; C27-C88 WeakPolarHBondContact SG-CB 3.49Å; C27-C88 CovalentContact SG-SG 2.03Å; C27-C88 PolarHBondContact SG-SG 3.39Å; M42-C88 PolarHBondContact O-N 2.95Å; F44-C88 HydrophobicContact CB-CB 3.97Å
89	S	74.8	Confident	82.7	Confident	45 Å²	45	47 Å²	47	32%	0.315	22%	0.22	S	C	.	.			trans	-83.1	160.9	169.9	-170.3	0	0	0	0	111	C27 E91 N92 R93	C27-S89 PolarHBondContact SG-O 3.46Å; S89-E91 PolarHBondContact O-N 2.83Å; S89-N92 WeakPolarHBondContact O-CA 3.32Å; S89-N92 PolarHBondContact O-N 3.06Å; S89-R93 PolarHBondContact N-O 3.11Å
90	E	63.2	Low	82.6	Confident	180 Å²	180	51 Å²	51	84%	0.841	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-24.4	-175.7	-59.8	-167.8	160.9	0	0	113.8	N92	E90-N92 PolarHBondContact O-N 3.02Å; E90-N92 VanDerWaalsContact O-N 3.14Å
91	E	60.6	Low	82.5	Confident	157 Å²	157	54.4 Å²	54.4	73%	0.734	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.2	15.3	171.4	-57.1	-176.3	144.2	0	0	114	S89 R93	S89-E91 PolarHBondContact O-N 2.83Å; E91-R93 HydrophobicContact CB-CB 4.45Å; E91-R93 PolarHBondContact O-N 3.05Å; E91-R93 VanDerWaalsContact O-N 3.15Å
92	N	64.8	Low	82.6	Confident	63 Å²	63	54.3 Å²	54.3	34%	0.337	25%	0.254	S	S	.	.	S	Bend	trans	55.4	19.4	-165.6	-79.8	-26.7	0	0	0	114.2	F25 T26 C27 F44 S89 E90 V94	F25-N92 PolarHBondContact O-ND2 3.5Å; T26-N92 WeakPolarHBondContact CA-OD1 3.41Å; C27-N92 PolarHBondContact N-OD1 3.31Å; F44-N92 HydrophobicContact CE2-CB 4.46Å; S89-N92 WeakPolarHBondContact O-CA 3.32Å; S89-N92 PolarHBondContact O-N 3.06Å; E90-N92 PolarHBondContact O-N 3.02Å; E90-N92 VanDerWaalsContact O-N 3.14Å; N92-V94 PolarHBondContact O-N 3.41Å
93	R	68.2	Low	82.7	Confident	115 Å²	115	57.1 Å²	57.1	43%	0.434	27%	0.267	S	S	.	.			trans	-78.3	117.7	-177.5	-177.5	178.7	177.3	141.5	10.1	110.8	S89 E91 D135	S89-R93 PolarHBondContact N-O 3.11Å; E91-R93 HydrophobicContact CB-CB 4.45Å; E91-R93 PolarHBondContact O-N 3.05Å; E91-R93 VanDerWaalsContact O-N 3.15Å; R93-D135 IonicContact CZ-OD2 3.48Å; R93-D135 IonicContact NH1-OD2 2.74Å; R93-D135 VanDerWaalsContact NH2-CB 3.26Å; R93-D135 IonicContact NH2-OD2 3.14Å; R93-D135 PolarHBondContact NH2-OD2 3.02Å
94	V	78.8	Confident	82.8	Confident	47 Å²	47	58.9 Å²	58.9	29%	0.285	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	122.6	-177.4	-170.8	0	0	0	0	111.6	F44 P86 A87 N92	F44-V94 HydrophobicContact CB-CG1 4.49Å; F44-V94 HydrophobicContact CB-CG2 3.6Å; F44-V94 HydrophobicContact CD1-CG2 3.65Å; F44-V94 HydrophobicContact CD2-CG2 4.36Å; F44-V94 HydrophobicContact CE1-CG2 4.41Å; F44-V94 HydrophobicContact CG-CG2 3.61Å; P86-V94 HydrophobicContact CB-CG1 3.61Å; P86-V94 HydrophobicContact CG-CG1 3.67Å; A87-V94 CarbonylContact O-C 3.56Å; A87-V94 WeakPolarHBondContact O-CA 3.38Å; N92-V94 PolarHBondContact O-N 3.41Å
95	I	79.7	Confident	82.9	Confident	54 Å²	54	58.8 Å²	58.8	28%	0.277	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	99.3	-176	-43.8	-179.5	0	0	0	110.7	Q82 A87	Q82-I95 WeakPolarHBondContact CG-O 3.34Å; Q82-I95 PolarHBondContact NE2-O 3.42Å; A87-I95 HydrophobicContact CB-CB 4.22Å; A87-I95 HydrophobicContact CB-CD1 4.34Å; A87-I95 HydrophobicContact CB-CG1 4.37Å; A87-I95 PolarHBondContact O-N 3.08Å
96	R	80.8	Confident	83	Confident	158 Å²	158	61.9 Å²	61.9	60%	0.596	30%	0.297	S	S	*	.	P	Polyproline II helix	trans	-77.8	155.4	179.1	-61.1	-176.3	-173.4	-164.5	-2.2	112.5	M48 Q82	M48-R96 HydrophobicContact SD-CB 4.4Å; M48-R96 HydrophobicContact SD-CG 4.4Å; Q82-R96 VanDerWaalsContact NE2-C 3.34Å; Q82-R96 PolarHBondContact NE2-O 3.29Å; Q82-R96 VanDerWaalsContact NE2-O 3.11Å
97	P	87.3	Confident	83.1	Confident	3 Å²	3	66 Å²	66	2%	0.019	33%	0.326	C	S	.	.	P	Polyproline II helix	trans	-61.5	149	171.5	28	-36.1	0	0	0	111.7	M48 F79 Q82 A83 L129	M48-P97 HydrophobicContact SD-CG 4.2Å; F79-P97 HydrophobicContact CD2-CB 3.72Å; F79-P97 HydrophobicContact CD2-CG 4.42Å; F79-P97 HydrophobicContact CE2-CB 3.69Å; F79-P97 HydrophobicContact CE2-CG 4.01Å; Q82-P97 HydrophobicContact CG-CB 4.49Å; A83-P97 HydrophobicContact CB-CG 4.26Å; P97-L129 HydrophobicContact CG-CD1 4.45Å; P97-L129 HydrophobicContact CG-CD2 4.45Å
98	C	88.3	Confident	83.5	Confident	20 Å²	20	69.4 Å²	69.4	14%	0.135	34%	0.344	C	S	.	.	P	Polyproline II helix	trans	-98.4	159.8	177.3	53.7	0	0	0	0	113	E100 K101 C102 K130 C132	C98-E100 PolarHBondContact O-N 2.86Å; C98-K101 PolarHBondContact O-N 2.87Å; C98-C102 PolarHBondContact O-N 2.89Å; C98-K130 CarbonylContact C-O 3.55Å; C98-K130 VanDerWaalsContact CA-O 3.27Å; C98-K130 WeakPolarHBondContact CA-O 3.35Å; C98-K130 VanDerWaalsContact CB-O 3.3Å; C98-K130 WeakPolarHBondContact CB-O 3.48Å; C98-C132 HydrophobicContact CB-CB 3.79Å; C98-C132 WeakPolarHBondContact CB-SG 3.44Å; C98-C132 VanDerWaalsContact SG-CA 3.57Å; C98-C132 WeakPolarHBondContact SG-CB 3.18Å; C98-C132 CovalentContact SG-SG 2.04Å; C98-C132 PolarHBondContact SG-SG 2.65Å
99	R	90.9	Very high	83.9	Confident	80 Å²	80	68.8 Å²	68.8	30%	0.302	34%	0.339	S	S	.	.	H	α-helix	trans	-57.4	-47.1	-170.1	175.7	175.4	-55.4	172.5	7.4	113.4	K101 C102 E103 C126 S127 L129 K130	R99-K101 VanDerWaalsContact C-N 3.32Å; R99-K101 PolarHBondContact O-N 2.9Å; R99-C102 CarbonylContact O-C 3.58Å; R99-C102 WeakPolarHBondContact O-CA 3.32Å; R99-C102 VanDerWaalsContact O-CB 3.27Å; R99-C102 WeakPolarHBondContact O-CB 3.34Å; R99-C102 PolarHBondContact O-N 3.48Å; R99-E103 VanDerWaalsContact CD-OE1 3.29Å; R99-E103 WeakPolarHBondContact CD-OE1 3.5Å; R99-E103 VanDerWaalsContact CG-CD 3.41Å; R99-E103 HydrophobicContact CG-CG 4.23Å; R99-E103 WeakPolarHBondContact CG-OE1 3.41Å; R99-E103 WeakPolarHBondContact O-CG 3.49Å; R99-E103 PolarHBondContact O-N 3.45Å; R99-C126 HydrophobicContact CG-CB 4.36Å; R99-C126 WeakPolarHBondContact CG-O 3.46Å; R99-C126 PolarHBondContact NE-O 3.43Å; R99-S127 PolarHBondContact NH2-O 3.34Å; R99-L129 HydrophobicContact CB-CB 4.17Å; R99-L129 PolarHBondContact NE-O 3.21Å; R99-L129 PolarHBondContact NH2-O 3.09Å; R99-K130 PolarHBondContact N-O 3.4Å
100	E	90.4	Very high	84.8	Confident	86 Å²	86	73.3 Å²	73.3	40%	0.402	36%	0.355	S	S	.	.	H	α-helix	trans	-68.5	-34.6	-171.4	-60.7	80.9	170.8	0	0	110.9	C98 A104 P131 C132	C98-E100 PolarHBondContact O-N 2.86Å; E100-A104 WeakPolarHBondContact O-CB 3.35Å; E100-A104 PolarHBondContact O-N 3.45Å; E100-P131 WeakPolarHBondContact OE1-CA 3.07Å; E100-P131 WeakPolarHBondContact OE1-CB 3.42Å; E100-P131 WeakPolarHBondContact OE2-CA 3.22Å; E100-C132 PolarHBondContact OE1-N 3.43Å; E100-C132 PolarHBondContact OE2-N 2.78Å; E100-C132 PolarHBondContact OE2-SG 2.93Å
101	K	89.5	Confident	86.1	Confident	74 Å²	74	69 Å²	69	32%	0.322	34%	0.335	S	S	.	.	H	α-helix	trans	-68.6	-36.7	170.1	-75.6	-173.9	175.5	-75.8	0	112.5	D75 C98 R99 V105	D75-K101 IonicContact OD1-NZ 2.74Å; D75-K101 PolarHBondContact OD1-NZ 3.48Å; D75-K101 IonicContact OD2-NZ 3.81Å; D75-K101 PolarHBondContact OD2-NZ 3.4Å; C98-K101 PolarHBondContact O-N 2.87Å; R99-K101 VanDerWaalsContact C-N 3.32Å; R99-K101 PolarHBondContact O-N 2.9Å; K101-V105 WeakPolarHBondContact O-CB 3.49Å; K101-V105 VanDerWaalsContact O-CG2 3.28Å; K101-V105 WeakPolarHBondContact O-CG2 3.46Å; K101-V105 PolarHBondContact O-N 2.9Å
102	C	92.8	Very high	87.6	Confident	0 Å²	0	63.3 Å²	63.3	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-65.9	-44.4	174.8	-179.8	0	0	0	0	111.6	F79 C98 R99 V105 L106 L124 C126 L129	F79-C102 HydrophobicContact CD2-CB 4.37Å; F79-C102 HydrophobicContact CE2-CB 3.58Å; F79-C102 HydrophobicContact CZ-CB 4Å; C98-C102 PolarHBondContact O-N 2.89Å; R99-C102 CarbonylContact O-C 3.58Å; R99-C102 WeakPolarHBondContact O-CA 3.32Å; R99-C102 VanDerWaalsContact O-CB 3.27Å; R99-C102 WeakPolarHBondContact O-CB 3.34Å; R99-C102 PolarHBondContact O-N 3.48Å; C102-V105 PolarHBondContact O-N 3.44Å; C102-L106 WeakPolarHBondContact O-CB 3.44Å; C102-L106 PolarHBondContact O-N 2.76Å; C102-L124 PolarHBondContact SG-O 3.37Å; C102-C126 HydrophobicContact CB-CB 3.63Å; C102-C126 WeakPolarHBondContact CB-SG 3.26Å; C102-C126 WeakPolarHBondContact SG-CA 3.36Å; C102-C126 WeakPolarHBondContact SG-CB 3.49Å; C102-C126 CovalentContact SG-SG 2.04Å; C102-C126 PolarHBondContact SG-SG 3.12Å; C102-L129 HydrophobicContact CB-CD1 3.45Å; C102-L129 VanDerWaalsContact CB-CD1 3.45Å
103	E	93.1	Very high	88.8	Confident	93 Å²	93	61.4 Å²	61.4	44%	0.435	30%	0.299	S	S	.	.	H	α-helix	trans	-66.6	-40.2	179.8	-72.4	167.3	177.9	0	0	111.5	R99 S107 C126	R99-E103 VanDerWaalsContact CD-OE1 3.29Å; R99-E103 WeakPolarHBondContact CD-OE1 3.5Å; R99-E103 VanDerWaalsContact CG-CD 3.41Å; R99-E103 HydrophobicContact CG-CG 4.23Å; R99-E103 WeakPolarHBondContact CG-OE1 3.41Å; R99-E103 WeakPolarHBondContact O-CG 3.49Å; R99-E103 PolarHBondContact O-N 3.45Å; E103-S107 WeakPolarHBondContact O-CB 3.43Å; E103-S107 PolarHBondContact O-N 3.12Å; E103-C126 HydrophobicContact CG-CB 3.6Å
104	A	92.3	Very high	89.9	Confident	38 Å²	38	64.4 Å²	64.4	31%	0.314	31%	0.311	S	S	.	.	H	α-helix	trans	-60	-55.7	171.3	0	0	0	0	0	112	E100 L106 S107 D108	E100-A104 WeakPolarHBondContact O-CB 3.35Å; E100-A104 PolarHBondContact O-N 3.45Å; A104-L106 VanDerWaalsContact C-N 3.28Å; A104-L106 PolarHBondContact O-N 2.89Å; A104-S107 PolarHBondContact O-N 3.43Å; A104-S107 VanDerWaalsContact O-N 3.17Å; A104-D108 WeakPolarHBondContact O-CB 3.33Å; A104-D108 PolarHBondContact O-N 3.39Å
105	V	93.8	Very high	90.4	Very high	1 Å²	1	67.3 Å²	67.3	1%	0.006	32%	0.323	C	S	.	.	H	α-helix	trans	-60.3	-37.4	-179.5	170.6	0	0	0	0	112.1	D75 V76 F79 K101 C102 C109	D75-V105 HydrophobicContact CB-CG2 3.77Å; V76-V105 HydrophobicContact CB-CG1 4.08Å; V76-V105 HydrophobicContact CB-CG2 4.44Å; V76-V105 HydrophobicContact CG2-CG1 3.87Å; F79-V105 HydrophobicContact CB-CG2 4.07Å; F79-V105 HydrophobicContact CD1-CG1 4.19Å; F79-V105 HydrophobicContact CG-CG2 4.41Å; K101-V105 WeakPolarHBondContact O-CB 3.49Å; K101-V105 VanDerWaalsContact O-CG2 3.28Å; K101-V105 WeakPolarHBondContact O-CG2 3.46Å; K101-V105 PolarHBondContact O-N 2.9Å; C102-V105 PolarHBondContact O-N 3.44Å; V105-C109 WeakPolarHBondContact O-CB 3.38Å; V105-C109 PolarHBondContact O-N 3.03Å; V105-C109 VanDerWaalsContact O-N 3.1Å; V105-C109 PolarHBondContact O-SG 2.96Å
106	L	92.8	Very high	90.9	Very high	64 Å²	64	69.4 Å²	69.4	34%	0.335	33%	0.331	S	S	.	.	H	α-helix	trans	-68.7	-38.9	178.3	-172.8	64.4	0	0	0	112.1	C102 A104 E110 I113 W120	C102-L106 WeakPolarHBondContact O-CB 3.44Å; C102-L106 PolarHBondContact O-N 2.76Å; A104-L106 VanDerWaalsContact C-N 3.28Å; A104-L106 PolarHBondContact O-N 2.89Å; L106-E110 PolarHBondContact O-N 3.1Å; L106-I113 HydrophobicContact CD1-CD1 3.88Å; L106-W120 HydrophobicContact CD1-CD2 3.99Å; L106-W120 HydrophobicContact CD1-CE3 4.07Å; L106-W120 HydrophobicContact CD1-CG 4.43Å; L106-W120 HydrophobicContact CD1-CZ2 4.47Å; L106-W120 HydrophobicContact CD1-CZ3 4.34Å
107	S	93.4	Very high	91.3	Very high	87 Å²	87	64.7 Å²	64.7	61%	0.608	33%	0.332	S	S	*	.	H	α-helix	trans	-72.5	-46.8	177.1	-170.4	0	0	0	0	112.3	E103 A104 C109	E103-S107 WeakPolarHBondContact O-CB 3.43Å; E103-S107 PolarHBondContact O-N 3.12Å; A104-S107 PolarHBondContact O-N 3.43Å; A104-S107 VanDerWaalsContact O-N 3.17Å; S107-C109 VanDerWaalsContact C-N 3.31Å; S107-C109 PolarHBondContact O-N 3.22Å
108	D	93.3	Very high	91.4	Very high	79 Å²	79	65.4 Å²	65.4	42%	0.422	34%	0.335	S	S	.	.	H	α-helix	trans	-64.2	-36.4	-178.9	-72.2	-13.8	0	0	0	112	S73 A104	S73-D108 WeakPolarHBondContact CB-OD2 3.23Å; S73-D108 PolarHBondContact OG-OD2 3.42Å; A104-D108 WeakPolarHBondContact O-CB 3.33Å; A104-D108 PolarHBondContact O-N 3.39Å
109	C	93.7	Very high	91.5	Very high	0 Å²	0	70.5 Å²	70.5	0%	0	37%	0.366	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.2	5.3	-175.9	-61.8	0	0	0	0	114.4	L67 C72 V105 S107 E111 N112 I113	L67-C109 HydrophobicContact CD2-CB 4.36Å; C72-C109 HydrophobicContact CB-CB 3.95Å; C72-C109 WeakPolarHBondContact CB-SG 3.32Å; C72-C109 WeakPolarHBondContact SG-CB 3.19Å; C72-C109 CovalentContact SG-SG 2.04Å; C72-C109 PolarHBondContact SG-SG 3.41Å; V105-C109 WeakPolarHBondContact O-CB 3.38Å; V105-C109 PolarHBondContact O-N 3.03Å; V105-C109 VanDerWaalsContact O-N 3.1Å; V105-C109 PolarHBondContact O-SG 2.96Å; S107-C109 VanDerWaalsContact C-N 3.31Å; S107-C109 PolarHBondContact O-N 3.22Å; C109-E111 PolarHBondContact O-N 2.87Å; C109-N112 WeakPolarHBondContact O-CB 3.33Å; C109-N112 PolarHBondContact O-N 3.4Å; C109-I113 HydrophobicContact CB-CD1 4.12Å; C109-I113 HydrophobicContact CB-CG1 4.36Å; C109-I113 WeakPolarHBondContact O-CG1 3.37Å; C109-I113 PolarHBondContact O-N 3Å
110	E	92.9	Very high	91.4	Very high	140 Å²	140	68.7 Å²	68.7	65%	0.654	36%	0.359	S	S	*	.	H	α-helix	trans	-51.1	-50.4	-172.8	-174.6	179.1	-164.9	0	0	113.2	L106 N112 I113 R114	L106-E110 PolarHBondContact O-N 3.1Å; E110-N112 VanDerWaalsContact C-N 3.32Å; E110-N112 PolarHBondContact O-N 3.34Å; E110-I113 PolarHBondContact O-N 3.38Å; E110-R114 PolarHBondContact O-N 3.06Å
111	E	91.4	Very high	91.2	Very high	89 Å²	89	65.7 Å²	65.7	42%	0.416	35%	0.347	S	S	.	.	H	α-helix	trans	-62.9	-38.2	179.5	-175.2	58.7	-135.9	0	0	112	C109 R114 I115	C109-E111 PolarHBondContact O-N 2.87Å; E111-R114 WeakPolarHBondContact O-CB 3.4Å; E111-R114 PolarHBondContact O-N 2.96Å; E111-R114 IonicContact OE1-CZ 3.28Å; E111-R114 VanDerWaalsContact OE1-CZ 3.28Å; E111-R114 IonicContact OE1-NE 3.25Å; E111-R114 PolarHBondContact OE1-NE 2.92Å; E111-R114 IonicContact OE1-NH2 2.69Å; E111-R114 PolarHBondContact OE1-NH2 3.16Å; E111-R114 IonicContact OE2-CZ 3.08Å; E111-R114 IonicContact OE2-NE 3.54Å; E111-R114 IonicContact OE2-NH1 3.67Å; E111-R114 IonicContact OE2-NH2 2.72Å; E111-R114 PolarHBondContact OE2-NH2 2.87Å; E111-I115 HydrophobicContact CG-CD1 3.89Å; E111-I115 WeakPolarHBondContact O-CB 3.15Å; E111-I115 VanDerWaalsContact O-CG1 3.27Å; E111-I115 WeakPolarHBondContact O-CG1 3.4Å; E111-I115 PolarHBondContact O-N 2.97Å
112	N	90.5	Very high	90.9	Very high	39 Å²	39	65.2 Å²	65.2	21%	0.209	35%	0.351	C	S	.	.	H	α-helix	trans	-69.9	-41.8	177.8	-67.2	-80.3	0	0	0	111.1	L67 C72 C109 E110 R114 I115 F116	L67-N112 HydrophobicContact CD2-CB 3.53Å; C72-N112 WeakPolarHBondContact CB-ND2 3.33Å; C109-N112 WeakPolarHBondContact O-CB 3.33Å; C109-N112 PolarHBondContact O-N 3.4Å; E110-N112 VanDerWaalsContact C-N 3.32Å; E110-N112 PolarHBondContact O-N 3.34Å; N112-R114 PolarHBondContact O-N 3.2Å; N112-I115 PolarHBondContact O-N 3.3Å; N112-F116 HydrophobicContact CB-CD2 4.35Å; N112-F116 HydrophobicContact CB-CE2 4.4Å; N112-F116 WeakPolarHBondContact O-CD2 3.34Å; N112-F116 PolarHBondContact O-N 3.15Å
113	I	90.5	Very high	90.5	Very high	23 Å²	23	69.1 Å²	69.1	12%	0.118	37%	0.37	C	S	.	.	H	α-helix	trans	-56.8	-41.9	174	-71.6	167.5	0	0	0	110.2	L67 L106 C109 E110 G117 I118 W120	L67-I113 HydrophobicContact CD1-CD1 4.33Å; L67-I113 HydrophobicContact CD1-CG1 3.76Å; L67-I113 HydrophobicContact CD2-CG1 4.06Å; L106-I113 HydrophobicContact CD1-CD1 3.88Å; C109-I113 HydrophobicContact CB-CD1 4.12Å; C109-I113 HydrophobicContact CB-CG1 4.36Å; C109-I113 WeakPolarHBondContact O-CG1 3.37Å; C109-I113 PolarHBondContact O-N 3Å; E110-I113 PolarHBondContact O-N 3.38Å; I113-G117 PolarHBondContact O-N 3.22Å; I113-G117 VanDerWaalsContact O-N 3.13Å; I113-I118 HydrophobicContact CG2-CB 4.23Å; I113-I118 WeakPolarHBondContact CG2-O 3.5Å; I113-I118 PolarHBondContact O-N 3.44Å; I113-W120 HydrophobicContact CD1-CE3 4.07Å; I113-W120 HydrophobicContact CD1-CZ3 3.93Å
114	R	90.8	Very high	90.2	Very high	178 Å²	178	64.7 Å²	64.7	67%	0.672	35%	0.349	S	S	*	.	H	α-helix	trans	-65.3	-48.2	174.5	-171	177.3	75.7	-179.5	8.1	112.8	E110 E111 N112 F116 G117	E110-R114 PolarHBondContact O-N 3.06Å; E111-R114 WeakPolarHBondContact O-CB 3.4Å; E111-R114 PolarHBondContact O-N 2.96Å; E111-R114 IonicContact OE1-CZ 3.28Å; E111-R114 VanDerWaalsContact OE1-CZ 3.28Å; E111-R114 IonicContact OE1-NE 3.25Å; E111-R114 PolarHBondContact OE1-NE 2.92Å; E111-R114 IonicContact OE1-NH2 2.69Å; E111-R114 PolarHBondContact OE1-NH2 3.16Å; E111-R114 IonicContact OE2-CZ 3.08Å; E111-R114 IonicContact OE2-NE 3.54Å; E111-R114 IonicContact OE2-NH1 3.67Å; E111-R114 IonicContact OE2-NH2 2.72Å; E111-R114 PolarHBondContact OE2-NH2 2.87Å; N112-R114 PolarHBondContact O-N 3.2Å; R114-F116 PolarHBondContact O-N 3.32Å; R114-G117 PolarHBondContact O-N 3.08Å
115	I	90.5	Very high	90	Very high	107 Å²	107	66.9 Å²	66.9	55%	0.549	35%	0.353	S	S	.	.	H	α-helix	trans	-62.4	-42.2	-179	-73.6	167.3	0	0	0	111.9	E111 N112	E111-I115 HydrophobicContact CG-CD1 3.89Å; E111-I115 WeakPolarHBondContact O-CB 3.15Å; E111-I115 VanDerWaalsContact O-CG1 3.27Å; E111-I115 WeakPolarHBondContact O-CG1 3.4Å; E111-I115 PolarHBondContact O-N 2.97Å; N112-I115 PolarHBondContact O-N 3.3Å
116	F	90.1	Very high	89.8	Confident	98 Å²	98	67.3 Å²	67.3	43%	0.43	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88	0.3	-179.5	-64.6	-66	0	0	0	114	P66 L70 N112 R114 I118	P66-F116 HydrophobicContact CB-CD1 4.27Å; P66-F116 HydrophobicContact CB-CD2 3.97Å; P66-F116 HydrophobicContact CB-CE1 4.33Å; P66-F116 HydrophobicContact CB-CE2 4.08Å; P66-F116 HydrophobicContact CB-CG 4.11Å; P66-F116 HydrophobicContact CB-CZ 4.26Å; L70-F116 HydrophobicContact CD1-CE2 3.45Å; L70-F116 VanDerWaalsContact CD1-CE2 3.45Å; L70-F116 HydrophobicContact CD1-CZ 3.74Å; N112-F116 HydrophobicContact CB-CD2 4.35Å; N112-F116 HydrophobicContact CB-CE2 4.4Å; N112-F116 WeakPolarHBondContact O-CD2 3.34Å; N112-F116 PolarHBondContact O-N 3.15Å; R114-F116 PolarHBondContact O-N 3.32Å; F116-I118 VanDerWaalsContact C-N 3.29Å; F116-I118 HydrophobicContact CB-CD1 3.79Å; F116-I118 HydrophobicContact CB-CG1 3.83Å; F116-I118 PolarHBondContact O-N 3.24Å
117	G	88.8	Confident	89.5	Confident	60 Å²	60	68.3 Å²	68.3	62%	0.619	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.4	31.5	179.3	0	0	0	0	0	113.9	I113 R114 T119	I113-G117 PolarHBondContact O-N 3.22Å; I113-G117 VanDerWaalsContact O-N 3.13Å; R114-G117 PolarHBondContact O-N 3.08Å; G117-T119 PolarHBondContact O-N 3.34Å
118	I	90.3	Very high	89	Confident	18 Å²	18	70.2 Å²	70.2	9%	0.092	37%	0.365	C	S	.	.			trans	-77.6	109.3	-172.2	-66.3	170.5	0	0	0	110.1	P63 F64 L67 I113 F116 W120	P63-I118 WeakPolarHBondContact O-CD1 3.45Å; F64-I118 HydrophobicContact CD1-CG2 3.62Å; F64-I118 HydrophobicContact CE1-CG2 3.43Å; F64-I118 VanDerWaalsContact CE1-CG2 3.43Å; F64-I118 HydrophobicContact CZ-CG2 4.22Å; L67-I118 HydrophobicContact CD1-CD1 3.88Å; L67-I118 HydrophobicContact CD2-CD1 3.87Å; L67-I118 HydrophobicContact CG-CD1 3.71Å; I113-I118 HydrophobicContact CG2-CB 4.23Å; I113-I118 WeakPolarHBondContact CG2-O 3.5Å; I113-I118 PolarHBondContact O-N 3.44Å; F116-I118 VanDerWaalsContact C-N 3.29Å; F116-I118 HydrophobicContact CB-CD1 3.79Å; F116-I118 HydrophobicContact CB-CG1 3.83Å; F116-I118 PolarHBondContact O-N 3.24Å; I118-W120 PolarHBondContact O-N 2.78Å
119	T	89.3	Confident	88.6	Confident	126 Å²	126	66.9 Å²	66.9	77%	0.773	35%	0.348	S	S	*	.			trans	-72.5	114.4	172.7	-57.4	0	0	0	0	110.4	G117	G117-T119 PolarHBondContact O-N 3.34Å
120	W	88.3	Confident	88.2	Confident	42 Å²	42	73.6 Å²	73.6	16%	0.159	38%	0.377	C	S	.	.			trans	-71.4	124	176.6	-158.1	-97.6	0	0	0	111.2	F64 F79 L106 I113 I118 L124	F64-W120 HydrophobicContact CE1-CE3 4.34Å; F79-W120 HydrophobicContact CD1-CH2 4.42Å; F79-W120 AromaticContact CE1-CH2 3.65Å; F79-W120 HydrophobicContact CE1-CH2 3.65Å; F79-W120 AromaticContact CE1-CZ2 3.62Å; F79-W120 HydrophobicContact CE1-CZ2 3.62Å; F79-W120 HydrophobicContact CZ-CH2 4.36Å; F79-W120 AromaticContact CZ-CZ2 3.89Å; F79-W120 HydrophobicContact CZ-CZ2 3.89Å; L106-W120 HydrophobicContact CD1-CD2 3.99Å; L106-W120 HydrophobicContact CD1-CE3 4.07Å; L106-W120 HydrophobicContact CD1-CG 4.43Å; L106-W120 HydrophobicContact CD1-CZ2 4.47Å; L106-W120 HydrophobicContact CD1-CZ3 4.34Å; I113-W120 HydrophobicContact CD1-CE3 4.07Å; I113-W120 HydrophobicContact CD1-CZ3 3.93Å; I118-W120 PolarHBondContact O-N 2.78Å; W120-L124 HydrophobicContact CZ2-CB 4.36Å; W120-L124 PolarHBondContact NE1-O 2.9Å
121	P	86.6	Confident	87.8	Confident	23 Å²	23	69.7 Å²	69.7	15%	0.149	36%	0.363	C	S	.	.			trans	-74.3	147	-172.3	29.4	-34	0	0	0	111.6	F64 E123 L124	F64-P121 HydrophobicContact CZ-CG 4.39Å; P121-E123 PolarHBondContact O-N 2.9Å; P121-E123 VanDerWaalsContact O-N 3.1Å; P121-L124 HydrophobicContact CG-CB 3.99Å; P121-L124 HydrophobicContact CG-CD1 3.72Å; P121-L124 HydrophobicContact CG-CG 3.79Å; P121-L124 PolarHBondContact O-N 3.01Å; P121-L124 VanDerWaalsContact O-N 3.08Å
122	P	84.8	Confident	87.2	Confident	64 Å²	64	68 Å²	68	42%	0.416	36%	0.361	S	S	.	.	G	3₁₀ helix	trans	-61.3	-22.7	-176.3	18	-24.9	0	0	0	113.7	Q125 K128	P122-Q125 WeakPolarHBondContact O-CG 3.43Å; P122-Q125 PolarHBondContact O-OE1 2.77Å; P122-K128 WeakPolarHBondContact O-CD 3.45Å; P122-K128 WeakPolarHBondContact O-CE 3.26Å; P122-K128 PolarHBondContact O-NZ 3.41Å
123	E	83.1	Confident	86	Confident	83 Å²	83	69.1 Å²	69.1	39%	0.388	38%	0.381	S	S	.	.	G	3₁₀ helix	trans	-72.6	-31.1	178.3	-65.3	60.5	-127.1	0	0	112.1	M48 M49 P121	M48-E123 WeakPolarHBondContact CE-O 3.47Å; M49-E123 HydrophobicContact CG-CB 3.81Å; M49-E123 HydrophobicContact CG-CG 4.21Å; P121-E123 PolarHBondContact O-N 2.9Å; P121-E123 VanDerWaalsContact O-N 3.1Å
124	L	86.2	Confident	84.4	Confident	0 Å²	0	70.8 Å²	70.8	0%	0	40%	0.395	C	S	.	.	G	3₁₀ helix	trans	-94.7	10.5	179.2	-58.4	-177.2	0	0	0	113.1	M48 M49 F79 A83 F84 C102 W120 P121 C126	M48-L124 HydrophobicContact CE-CD2 3.87Å; M48-L124 HydrophobicContact SD-CD2 4.14Å; M49-L124 HydrophobicContact CE-CD1 4.49Å; M49-L124 HydrophobicContact CE-CD2 4.4Å; M49-L124 HydrophobicContact SD-CD1 3.96Å; M49-L124 HydrophobicContact SD-CD2 4.21Å; M49-L124 HydrophobicContact SD-CG 3.99Å; F79-L124 HydrophobicContact CE1-CD1 4.49Å; A83-L124 HydrophobicContact CB-CD1 4.19Å; A83-L124 HydrophobicContact CB-CD2 3.78Å; F84-L124 HydrophobicContact CE2-CD1 4.26Å; C102-L124 PolarHBondContact SG-O 3.37Å; W120-L124 HydrophobicContact CZ2-CB 4.36Å; W120-L124 PolarHBondContact NE1-O 2.9Å; P121-L124 HydrophobicContact CG-CB 3.99Å; P121-L124 HydrophobicContact CG-CD1 3.72Å; P121-L124 HydrophobicContact CG-CG 3.79Å; P121-L124 PolarHBondContact O-N 3.01Å; P121-L124 VanDerWaalsContact O-N 3.08Å; L124-C126 PolarHBondContact O-N 2.89Å; L124-C126 VanDerWaalsContact O-N 3.11Å
125	Q	89.1	Confident	82.2	Confident	84 Å²	84	66.8 Å²	66.8	39%	0.393	39%	0.387	S	S	.	.			trans	-59.7	114.9	171.1	-73	172.3	-12.7	0	0	109.7	P122 S127 K128	P122-Q125 WeakPolarHBondContact O-CG 3.43Å; P122-Q125 PolarHBondContact O-OE1 2.77Å; Q125-S127 PolarHBondContact O-N 3.19Å; Q125-K128 HydrophobicContact CB-CD 4.28Å; Q125-K128 HydrophobicContact CB-CG 4.39Å; Q125-K128 WeakPolarHBondContact O-CB 3.2Å; Q125-K128 PolarHBondContact O-N 3.27Å
126	C	89.6	Confident	80.3	Confident	9 Å²	9	64.7 Å²	64.7	6%	0.061	39%	0.392	C	S	.	.	G	3₁₀ helix	trans	-58.5	-29.1	-167.6	-46.5	0	0	0	0	114	R99 C102 E103 L124 K128 L129	R99-C126 HydrophobicContact CG-CB 4.36Å; R99-C126 WeakPolarHBondContact CG-O 3.46Å; R99-C126 PolarHBondContact NE-O 3.43Å; C102-C126 HydrophobicContact CB-CB 3.63Å; C102-C126 WeakPolarHBondContact CB-SG 3.26Å; C102-C126 WeakPolarHBondContact SG-CA 3.36Å; C102-C126 WeakPolarHBondContact SG-CB 3.49Å; C102-C126 CovalentContact SG-SG 2.04Å; C102-C126 PolarHBondContact SG-SG 3.12Å; E103-C126 HydrophobicContact CG-CB 3.6Å; L124-C126 PolarHBondContact O-N 2.89Å; L124-C126 VanDerWaalsContact O-N 3.11Å; C126-K128 PolarHBondContact O-N 3.44Å; C126-L129 WeakPolarHBondContact O-CB 3.42Å; C126-L129 PolarHBondContact O-N 3Å
127	S	86.7	Confident	78.2	Confident	86 Å²	86	64 Å²	64	60%	0.601	40%	0.399	S	S	*	.	G	3₁₀ helix	trans	-58.9	-25	172.5	56.7	0	0	0	0	114.4	R99 Q125	R99-S127 PolarHBondContact NH2-O 3.34Å; Q125-S127 PolarHBondContact O-N 3.19Å
128	K	83.6	Confident	75.9	Confident	126 Å²	126	65 Å²	65	55%	0.548	40%	0.402	S	S	.	.	G	3₁₀ helix	trans	-86.2	-16.4	174.6	-60.7	179.2	-175.9	166.1	0	113.4	P122 Q125 C126	P122-K128 WeakPolarHBondContact O-CD 3.45Å; P122-K128 WeakPolarHBondContact O-CE 3.26Å; P122-K128 PolarHBondContact O-NZ 3.41Å; Q125-K128 HydrophobicContact CB-CD 4.28Å; Q125-K128 HydrophobicContact CB-CG 4.39Å; Q125-K128 WeakPolarHBondContact O-CB 3.2Å; Q125-K128 PolarHBondContact O-N 3.27Å; C126-K128 PolarHBondContact O-N 3.44Å
129	L	84.7	Confident	73.8	Confident	10 Å²	10	68.3 Å²	68.3	5%	0.052	42%	0.419	C	S	.	.	S	Bend	trans	-77.6	156.4	176.9	-58.2	-179.3	0	0	0	111	M48 F79 P97 R99 C102 C126	M48-L129 HydrophobicContact CE-CD2 3.84Å; M48-L129 HydrophobicContact SD-CD2 4.29Å; F79-L129 HydrophobicContact CE2-CD1 4.26Å; P97-L129 HydrophobicContact CG-CD1 4.45Å; P97-L129 HydrophobicContact CG-CD2 4.45Å; R99-L129 HydrophobicContact CB-CB 4.17Å; R99-L129 PolarHBondContact NE-O 3.21Å; R99-L129 PolarHBondContact NH2-O 3.09Å; C102-L129 HydrophobicContact CB-CD1 3.45Å; C102-L129 VanDerWaalsContact CB-CD1 3.45Å; C126-L129 WeakPolarHBondContact O-CB 3.42Å; C126-L129 PolarHBondContact O-N 3Å
130	K	85	Confident	71.5	Confident	141 Å²	141	66.8 Å²	66.8	61%	0.613	41%	0.412	S	S	*	.	P	Polyproline II helix	trans	-77.6	149	173.9	-74.7	-168.4	172.7	-167.6	0	111.1	C98 R99	C98-K130 CarbonylContact C-O 3.55Å; C98-K130 VanDerWaalsContact CA-O 3.27Å; C98-K130 WeakPolarHBondContact CA-O 3.35Å; C98-K130 VanDerWaalsContact CB-O 3.3Å; C98-K130 WeakPolarHBondContact CB-O 3.48Å; R99-K130 PolarHBondContact N-O 3.4Å
131	P	84.3	Confident	69	Low	58 Å²	58	70.3 Å²	70.3	38%	0.377	44%	0.442	S	S	.	.	P	Polyproline II helix	trans	-58.2	142.1	166.9	-24.6	35.6	0	0	0	112.5	E100 S134	E100-P131 WeakPolarHBondContact OE1-CA 3.07Å; E100-P131 WeakPolarHBondContact OE1-CB 3.42Å; E100-P131 WeakPolarHBondContact OE2-CA 3.22Å; P131-S134 WeakPolarHBondContact O-CB 3.38Å; P131-S134 PolarHBondContact O-N 3Å; P131-S134 PolarHBondContact O-OG 3.02Å
132	C	77.8	Confident	66.7	Low	53 Å²	53	73.1 Å²	73.1	36%	0.358	46%	0.459	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	141.1	175.2	-58.8	0	0	0	0	110.3	C98 E100 S134	C98-C132 HydrophobicContact CB-CB 3.79Å; C98-C132 WeakPolarHBondContact CB-SG 3.44Å; C98-C132 VanDerWaalsContact SG-CA 3.57Å; C98-C132 WeakPolarHBondContact SG-CB 3.18Å; C98-C132 CovalentContact SG-SG 2.04Å; C98-C132 PolarHBondContact SG-SG 2.65Å; E100-C132 PolarHBondContact OE1-N 3.43Å; E100-C132 PolarHBondContact OE2-N 2.78Å; E100-C132 PolarHBondContact OE2-SG 2.93Å; C132-S134 VanDerWaalsContact C-N 3.29Å; C132-S134 PolarHBondContact O-N 3.18Å
133	G	65.9	Low	64.3	Low	62 Å²	62	75.5 Å²	75.5	64%	0.639	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.6	-4.4	-179.1	0	0	0	0	0	115.9	D135	G133-D135 PolarHBondContact O-N 3.05Å; G133-D135 VanDerWaalsContact O-N 3.07Å
134	S	56.1	Low	62	Low	58 Å²	58	77.2 Å²	77.2	41%	0.406	49%	0.491	S	S	.	.	S	Bend	trans	-72.1	5.2	177.9	61.8	0	0	0	0	115.6	P131 C132	P131-S134 WeakPolarHBondContact O-CB 3.38Å; P131-S134 PolarHBondContact O-N 3Å; P131-S134 PolarHBondContact O-OG 3.02Å; C132-S134 VanDerWaalsContact C-N 3.29Å; C132-S134 PolarHBondContact O-N 3.18Å
135	D	45.8	Very low	59.6	Low	94 Å²	94	83.5 Å²	83.5	50%	0.503	53%	0.529	S	S	.	.	S	Bend	trans	-177.7	122.6	154.7	-117.2	-3.8	0	0	0	110	R93 G133 S137	R93-D135 IonicContact CZ-OD2 3.48Å; R93-D135 IonicContact NH1-OD2 2.74Å; R93-D135 VanDerWaalsContact NH2-CB 3.26Å; R93-D135 IonicContact NH2-OD2 3.14Å; R93-D135 PolarHBondContact NH2-OD2 3.02Å; G133-D135 PolarHBondContact O-N 3.05Å; G133-D135 VanDerWaalsContact O-N 3.07Å; D135-S137 VanDerWaalsContact C-N 3.34Å; D135-S137 PolarHBondContact O-N 3.44Å; D135-S137 PolarHBondContact O-OG 3.09Å
136	G	49.8	Very low	56.8	Low	63 Å²	63	85.7 Å²	85.7	65%	0.649	55%	0.549	S	S	*	.			trans	48.7	34.7	151.5	0	0	0	0	0	119.2	A138	G136-A138 PolarHBondContact O-N 3.1Å
137	S	45.7	Very low	54.3	Low	83 Å²	83	90 Å²	90	58%	0.58	58%	0.576	S	S	*	*			trans	-75.3	29.7	-178.9	-49.7	0	0	0	0	114.3	D135	D135-S137 VanDerWaalsContact C-N 3.34Å; D135-S137 PolarHBondContact O-N 3.44Å; D135-S137 PolarHBondContact O-OG 3.09Å
138	A	41.3	Very low	51.7	Low	82 Å²	82	90.9 Å²	90.9	68%	0.678	58%	0.583	S	S	*	*	P	Polyproline II helix	trans	-98.2	118.9	176.4	0	0	0	0	0	109.6	G136 P140	G136-A138 PolarHBondContact O-N 3.1Å; A138-P140 WeakPolarHBondContact O-CD 3.24Å
139	L	46.1	Very low	49.4	Very low	87 Å²	87	90.8 Å²	90.8	46%	0.455	60%	0.598	S	S	.	*	P	Polyproline II helix	trans	-74.4	123.4	179	179.4	94.8	0	0	0	111.2	P39	P39-L139 HydrophobicContact CB-CD1 4.31Å; P39-L139 HydrophobicContact CB-CD2 3.83Å; P39-L139 WeakPolarHBondContact O-CD1 3.31Å; P39-L139 WeakPolarHBondContact O-CD2 3.45Å
140	P	41.3	Very low	47.2	Very low	95 Å²	95	97.6 Å²	97.6	62%	0.617	63%	0.634	S	S	*	*	P	Polyproline II helix	trans	-77.7	131.8	161	-6.3	25.1	0	0	0	109.8	A138 T142	A138-P140 WeakPolarHBondContact O-CD 3.24Å; P140-T142 PolarHBondContact O-N 2.93Å
141	S	36.3	Very low	45.1	Very low	115 Å²	115	98.6 Å²	98.6	80%	0.804	64%	0.638	S	S	*	*			trans	-73.3	114.1	178.7	-54.7	0	0	0	0	111.8
142	T	38.3	Very low	43.1	Very low	82 Å²	82	103.1 Å²	103.1	50%	0.503	65%	0.647	S	S	.	*	P	Polyproline II helix	trans	-87.2	128.5	-175.8	-33.2	0	0	0	0	113.5	P140	P140-T142 PolarHBondContact O-N 2.93Å
143	T	33.6	Very low	41.6	Very low	114 Å²	114	105.5 Å²	105.5	70%	0.699	66%	0.656	S	S	*	*	P	Polyproline II helix	trans	-63.4	141.9	171.1	-40.4	0	0	0	0	111.3	V145	T143-V145 PolarHBondContact O-N 3.35Å
144	P	35	Very low	41.1	Very low	119 Å²	119	107.5 Å²	107.5	77%	0.773	65%	0.652	S	S	*	*	P	Polyproline II helix	trans	-73.6	126.3	-178.4	28.1	-35	0	0	0	112.8
145	V	36.2	Very low	41.4	Very low	133 Å²	133	107 Å²	107	81%	0.806	66%	0.656	S	S	*	*			trans	-118.9	136.8	168.7	-177.3	0	0	0	0	109.2	T143	T143-V145 PolarHBondContact O-N 3.35Å
146	T	28.9	Very low	42.8	Very low	130 Å²	130	104 Å²	104	80%	0.798	64%	0.638	S	S	*	*			trans	-69	132.4	-170.7	-46	0	0	0	0	112.6	S148	T146-S148 PolarHBondContact O-N 3.4Å
147	P	38.4	Very low	44	Very low	98 Å²	98	106.2 Å²	106.2	64%	0.636	63%	0.627	S	S	*	*			trans	-78.4	107.7	-178.1	30.5	-34.5	0	0	0	112.4	P29 S149	P29-P147 HydrophobicContact CG-CB 4.39Å; P147-S149 PolarHBondContact O-N 3.32Å
148	S	30.7	Very low	45.8	Very low	106 Å²	106	103.1 Å²	103.1	74%	0.741	61%	0.605	S	S	*	*			trans	-79.3	112.5	167.4	53.5	0	0	0	0	110.5	T146 L150	T146-S148 PolarHBondContact O-N 3.4Å; S148-L150 PolarHBondContact O-N 2.82Å
149	S	36.5	Very low	48	Very low	124 Å²	124	99.5 Å²	99.5	87%	0.867	58%	0.575	S	S	*	*			trans	-79.2	72.4	-171.3	62.2	0	0	0	0	113.8	P147	P147-S149 PolarHBondContact O-N 3.32Å
150	L	37.5	Very low	49.6	Very low	153 Å²	153	100.8 Å²	100.8	80%	0.801	58%	0.582	S	S	*	*			trans	-89.6	104.3	164	-79.6	167	0	0	0	109.9	S148 R152	S148-L150 PolarHBondContact O-N 2.82Å; L150-R152 PolarHBondContact O-N 3.24Å
151	K	41.5	Very low	51.7	Low	161 Å²	161	98.8 Å²	98.8	70%	0.7	56%	0.564	S	S	*	*			trans	-60.6	108.3	166.9	-79	-161.3	173.8	-162.1	0	108.4	H459	K151-H459 PolarHBondContact NZ-CD2 2.94Å; K151-H459 VanDerWaalsContact NZ-CD2 3.26Å; K151-H459 PolarHBondContact NZ-NE2 3.45Å
152	R	41.8	Very low	54.2	Low	154 Å²	154	93.3 Å²	93.3	58%	0.581	53%	0.526	S	S	*	.			trans	-72.5	136.7	173	-64.1	172.4	177.5	156.2	-8.8	108.9	T26 L150 L154	T26-R152 VanDerWaalsContact OG1-CZ 3.28Å; T26-R152 PolarHBondContact OG1-NH1 3.36Å; T26-R152 PolarHBondContact OG1-NH2 2.94Å; L150-R152 PolarHBondContact O-N 3.24Å; R152-L154 PolarHBondContact O-N 2.9Å
153	D	46.8	Very low	56.5	Low	102 Å²	102	95.1 Å²	95.1	55%	0.545	53%	0.527	S	S	.	.			trans	-73.7	116	163.8	-99.5	-57.9	0	0	0	107.6	G155 K460	D153-G155 PolarHBondContact O-N 3.31Å; D153-K460 IonicContact OD2-NZ 2.64Å; D153-K460 PolarHBondContact OD2-NZ 3.5Å
154	L	55.3	Low	59	Low	104 Å²	104	91.1 Å²	91.1	55%	0.545	50%	0.503	S	S	.	.			trans	-74.4	-10.1	-178.6	-74.5	95.9	0	0	0	113.4	R152 P456	R152-L154 PolarHBondContact O-N 2.9Å; L154-P456 HydrophobicContact CB-CB 4.32Å; L154-P456 HydrophobicContact CB-CG 4.19Å
155	G	62.3	Low	61.1	Low	48 Å²	48	90.4 Å²	90.4	50%	0.495	49%	0.487	S	S	.	.			trans	73.7	-176.6	-176	0	0	0	0	0	113.1	D153	D153-G155 PolarHBondContact O-N 3.31Å
156	F	75.5	Confident	63.1	Low	30 Å²	30	89.1 Å²	89.1	13%	0.132	48%	0.482	C	S	.	.			trans	-80.4	133.4	172.9	-179.8	-96	0	0	0	110.5	F172 L173 A175 W445 I446 I455	F156-F172 HydrophobicContact CE1-CD1 4.04Å; F156-F172 HydrophobicContact CE1-CE1 4.49Å; F156-F172 HydrophobicContact CE2-CE1 4.43Å; F156-F172 AromaticContact CZ-CD1 3.82Å; F156-F172 HydrophobicContact CZ-CD1 3.82Å; F156-F172 AromaticContact CZ-CE1 3.89Å; F156-F172 HydrophobicContact CZ-CE1 3.89Å; F156-L173 HydrophobicContact CB-CB 4.06Å; F156-L173 HydrophobicContact CD1-CB 3.54Å; F156-L173 HydrophobicContact CD1-CD1 4.28Å; F156-L173 HydrophobicContact CD2-CB 4.29Å; F156-L173 HydrophobicContact CD2-CD1 3.65Å; F156-L173 HydrophobicContact CE1-CB 4Å; F156-L173 HydrophobicContact CE1-CD1 4.3Å; F156-L173 HydrophobicContact CE2-CD1 3.68Å; F156-L173 HydrophobicContact CG-CB 3.69Å; F156-L173 HydrophobicContact CG-CD1 3.96Å; F156-L173 HydrophobicContact CG-CG 4.49Å; F156-L173 HydrophobicContact CZ-CD1 4.02Å; F156-A175 HydrophobicContact CD1-CB 3.8Å; F156-A175 HydrophobicContact CE1-CB 3.87Å; F156-W445 HydrophobicContact CE2-CZ3 4.32Å; F156-I446 HydrophobicContact CD2-CD1 4.09Å; F156-I446 HydrophobicContact CD2-CG1 4.2Å; F156-I455 HydrophobicContact CD2-CG2 4.22Å; F156-I455 HydrophobicContact CE2-CD1 3.92Å; F156-I455 HydrophobicContact CE2-CG2 4.5Å
157	W	75.4	Confident	65	Low	110 Å²	110	86.1 Å²	86.1	42%	0.417	48%	0.477	S	S	.	.			trans	-122.6	142.8	171.2	-123.5	71.9	0	0	0	109.1	F25 Y52 P159	F25-W157 AromaticContact CZ-NE1 3.84Å; Y52-W157 HydrophobicContact CE1-CD2 4.25Å; Y52-W157 AromaticContact CE1-CE3 3.59Å; Y52-W157 HydrophobicContact CE1-CE3 3.59Å; Y52-W157 AromaticContact CE1-CZ3 3.85Å; Y52-W157 HydrophobicContact CE1-CZ3 3.85Å; W157-P159 VanDerWaalsContact O-CD 3.29Å; W157-P159 WeakPolarHBondContact O-CD 3.38Å
158	C	84.1	Confident	66.6	Low	18 Å²	18	84.9 Å²	84.9	12%	0.122	46%	0.462	C	S	.	.			trans	-74.6	117.8	-177.4	-166.5	0	0	0	0	110.9	A175 C178	C158-A175 HydrophobicContact CB-CB 3.98Å; C158-C178 HydrophobicContact CB-CB 3.62Å; C158-C178 WeakPolarHBondContact CB-SG 3.19Å; C158-C178 VanDerWaalsContact SG-CA 3.55Å; C158-C178 WeakPolarHBondContact SG-CB 3.12Å; C158-C178 CovalentContact SG-SG 2.03Å; C158-C178 PolarHBondContact SG-SG 3.47Å
159	P	85.9	Confident	68.8	Low	7 Å²	7	82.2 Å²	82.2	5%	0.045	45%	0.451	C	S	.	.			trans	-74.3	151.7	175.6	35.3	-37.9	0	0	0	110.2	W157 Q161 L162 K163 Y453 I455	W157-P159 VanDerWaalsContact O-CD 3.29Å; W157-P159 WeakPolarHBondContact O-CD 3.38Å; P159-Q161 PolarHBondContact O-N 3.39Å; P159-Q161 VanDerWaalsContact O-N 3.12Å; P159-L162 HydrophobicContact CG-CB 3.96Å; P159-L162 HydrophobicContact CG-CD1 3.68Å; P159-L162 HydrophobicContact CG-CG 3.84Å; P159-L162 PolarHBondContact O-N 3.28Å; P159-K163 PolarHBondContact O-N 3.19Å; P159-Y453 WeakPolarHBondContact CB-O 3.22Å; P159-Y453 HydrophobicContact CG-CD1 4.3Å; P159-Y453 HydrophobicContact CG-CG 4.41Å; P159-I455 HydrophobicContact CB-CG1 4.31Å; P159-I455 HydrophobicContact CG-CD1 4.27Å; P159-I455 HydrophobicContact CG-CG1 4.18Å
160	L	81.3	Confident	71	Confident	113 Å²	113	76.5 Å²	76.5	59%	0.592	41%	0.411	S	S	*	.	G	3₁₀ helix	trans	-54.5	-37.7	-174.8	-177.6	62	0	0	0	112.5	L162 K163	L160-L162 PolarHBondContact O-N 3.09Å; L160-K163 HydrophobicContact CD1-CD 4.3Å; L160-K163 VanDerWaalsContact O-CB 3.26Å; L160-K163 WeakPolarHBondContact O-CB 3.43Å; L160-K163 PolarHBondContact O-N 3.17Å; L160-K163 VanDerWaalsContact O-N 3.11Å
161	Q	85.1	Confident	73.4	Confident	54 Å²	54	71.9 Å²	71.9	25%	0.252	39%	0.392	S	S	.	.	G	3₁₀ helix	trans	-63.1	-24.6	-179	-56.7	90.5	-38.4	0	0	113.7	P159 G264 V266 Y453	P159-Q161 PolarHBondContact O-N 3.39Å; P159-Q161 VanDerWaalsContact O-N 3.12Å; Q161-G264 VanDerWaalsContact CG-O 3.25Å; Q161-G264 WeakPolarHBondContact CG-O 3.27Å; Q161-V266 WeakPolarHBondContact O-CG2 3.26Å; Q161-V266 PolarHBondContact O-N 3.32Å; Q161-V266 VanDerWaalsContact O-N 3.15Å; Q161-Y453 HydrophobicContact CB-CD1 4.24Å; Q161-Y453 HydrophobicContact CB-CE1 4.36Å
162	L	88	Confident	75.6	Confident	0 Å²	0	64.5 Å²	64.5	0%	0	36%	0.36	C	S	.	.	G	3₁₀ helix	trans	-105.5	3.6	178.7	-62.8	179.7	0	0	0	112.9	P159 L160 A179 P181 V266 T268 W445 Y453	P159-L162 HydrophobicContact CG-CB 3.96Å; P159-L162 HydrophobicContact CG-CD1 3.68Å; P159-L162 HydrophobicContact CG-CG 3.84Å; P159-L162 PolarHBondContact O-N 3.28Å; L160-L162 PolarHBondContact O-N 3.09Å; L162-A179 PolarHBondContact O-N 3Å; L162-P181 HydrophobicContact CD2-CB 4.05Å; L162-P181 HydrophobicContact CD2-CG 4.44Å; L162-V266 HydrophobicContact CD2-CG2 3.55Å; L162-T268 HydrophobicContact CD2-CG2 4.24Å; L162-W445 HydrophobicContact CD1-CH2 3.94Å; L162-Y453 HydrophobicContact CD1-CD1 4.46Å; L162-Y453 HydrophobicContact CD1-CE1 4.46Å; L162-Y453 HydrophobicContact CD2-CE1 4.26Å; L162-Y453 HydrophobicContact CG-CD1 4.38Å; L162-Y453 HydrophobicContact CG-CE1 4.22Å
163	K	86.2	Confident	77.7	Confident	119 Å²	119	59.8 Å²	59.8	52%	0.517	35%	0.346	S	S	.	.	B	Isolated β-bridge	trans	-77	125.8	-176.6	-164.8	168.7	-173.7	169.1	0	110.7	P159 L160	P159-K163 PolarHBondContact O-N 3.19Å; L160-K163 HydrophobicContact CD1-CD 4.3Å; L160-K163 VanDerWaalsContact O-CB 3.26Å; L160-K163 WeakPolarHBondContact O-CB 3.43Å; L160-K163 PolarHBondContact O-N 3.17Å; L160-K163 VanDerWaalsContact O-N 3.11Å
164	T	86.2	Confident	79.2	Confident	31 Å²	31	57.7 Å²	57.7	19%	0.19	35%	0.349	C	S	.	.			trans	-96.3	177.4	-179.3	64.9	0	0	0	0	111.6	S170 D177 A179	T164-S170 PolarHBondContact OG1-OG 2.93Å; T164-D177 PolarHBondContact N-O 3.17Å; T164-D177 PolarHBondContact OG1-O 3Å; T164-A179 HydrophobicContact CG2-CB 3.49Å; T164-A179 VanDerWaalsContact CG2-CB 3.49Å
165	K	80.1	Confident	80.5	Confident	103 Å²	103	53.5 Å²	53.5	45%	0.448	33%	0.329	S	S	.	.			trans	-71.3	125.8	-178.1	-66.3	-172	-179.8	-168	0	110.2	H168 D261	K165-H168 PolarHBondContact O-N 3.42Å; K165-H168 PolarHBondContact O-ND1 3.41Å; K165-D261 WeakPolarHBondContact CE-OD1 3.45Å; K165-D261 WeakPolarHBondContact CE-OD2 3.43Å; K165-D261 IonicContact NZ-OD1 2.69Å; K165-D261 PolarHBondContact NZ-OD1 3.03Å; K165-D261 IonicContact NZ-OD2 2.67Å; K165-D261 PolarHBondContact NZ-OD2 2.94Å
166	P	76.9	Confident	81.7	Confident	107 Å²	107	57.5 Å²	57.5	70%	0.695	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	143.3	-171.2	22.4	-33.2	0	0	0	112.6	D177	P166-D177 WeakPolarHBondContact CA-OD1 3.5Å
167	G	69.9	Low	82.2	Confident	67 Å²	67	58 Å²	58	69%	0.691	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.5	7.6	177.5	0	0	0	0	0	115.2	G169 D177	G167-G169 VanDerWaalsContact C-N 3.25Å; G167-D177 PolarHBondContact N-OD1 3.49Å
168	H	72.3	Confident	82.8	Confident	72 Å²	72	52.8 Å²	52.8	33%	0.333	32%	0.319	S	S	.	.	S	Bend	trans	-77.8	-10.9	172.2	-75.3	65	0	0	0	113.1	K165 S170 H274 N342	K165-H168 PolarHBondContact O-N 3.42Å; K165-H168 PolarHBondContact O-ND1 3.41Å; H168-S170 VanDerWaalsContact C-N 3.31Å; H168-H274 WeakPolarHBondContact CA-NE2 3.25Å; H168-H274 AromaticContact CD2-CD2 3.64Å; H168-H274 AromaticContact CD2-CG 3.8Å; H168-H274 PolarHBondContact O-NE2 3.49Å; H168-N342 PolarHBondContact O-ND2 3.41Å; H168-N342 VanDerWaalsContact O-ND2 3.1Å
169	G	75.9	Confident	83.1	Confident	49 Å²	49	52 Å²	52	51%	0.505	31%	0.314	S	S	.	.			trans	76.7	17.7	179.6	0	0	0	0	0	113.8	G167	G167-G169 VanDerWaalsContact C-N 3.25Å
170	S	84.1	Confident	83.5	Confident	5 Å²	5	51.6 Å²	51.6	4%	0.035	31%	0.311	C	S	.	.			trans	-66.3	131.7	171.5	21.4	0	0	0	0	110.3	T164 H168 Q176 D177	T164-S170 PolarHBondContact OG1-OG 2.93Å; H168-S170 VanDerWaalsContact C-N 3.31Å; S170-Q176 CarbonylContact O-C 3.12Å; S170-D177 WeakPolarHBondContact O-CA 3.35Å; S170-D177 PolarHBondContact O-N 3.06Å
171	S	86	Confident	84	Confident	56 Å²	56	46.3 Å²	46.3	39%	0.392	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	130.2	176.3	174.3	0	0	0	0	109.5	A175	S171-A175 WeakPolarHBondContact CA-O 3.49Å
172	F	88.6	Confident	84.4	Confident	5 Å²	5	44 Å²	44	2%	0.022	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	126.9	-179.7	176.5	-124.5	0	0	0	109.3	F156 G174 A175 C178 P180 M185 Y358 W445	F156-F172 HydrophobicContact CE1-CD1 4.04Å; F156-F172 HydrophobicContact CE1-CE1 4.49Å; F156-F172 HydrophobicContact CE2-CE1 4.43Å; F156-F172 AromaticContact CZ-CD1 3.82Å; F156-F172 HydrophobicContact CZ-CD1 3.82Å; F156-F172 AromaticContact CZ-CE1 3.89Å; F156-F172 HydrophobicContact CZ-CE1 3.89Å; F172-G174 PolarHBondContact O-N 3.35Å; F172-A175 PolarHBondContact N-O 3.45Å; F172-A175 PolarHBondContact O-N 3.03Å; F172-C178 HydrophobicContact CB-CB 4.08Å; F172-P180 HydrophobicContact CD2-CB 4.33Å; F172-P180 HydrophobicContact CD2-CG 3.58Å; F172-P180 HydrophobicContact CE2-CB 4.02Å; F172-P180 HydrophobicContact CE2-CG 3.67Å; F172-P180 HydrophobicContact CG-CG 4.15Å; F172-P180 HydrophobicContact CZ-CB 4.17Å; F172-P180 HydrophobicContact CZ-CG 4.28Å; F172-M185 HydrophobicContact CE2-CE 4.2Å; F172-M185 HydrophobicContact CE2-SD 4.14Å; F172-M185 HydrophobicContact CZ-CE 3.77Å; F172-M185 HydrophobicContact CZ-SD 3.9Å; F172-Y358 HydrophobicContact CE2-CD1 4.39Å; F172-W445 HydrophobicContact CE1-CH2 4.25Å; F172-W445 HydrophobicContact CE1-CZ3 4.05Å; F172-W445 HydrophobicContact CZ-CZ3 4.17Å
173	L	85.1	Confident	84.5	Confident	55 Å²	55	47.4 Å²	47.4	29%	0.288	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.8	29.9	-176.6	-60.6	168.1	0	0	0	113.8	F156 E442 W445 I446	F156-L173 HydrophobicContact CB-CB 4.06Å; F156-L173 HydrophobicContact CD1-CB 3.54Å; F156-L173 HydrophobicContact CD1-CD1 4.28Å; F156-L173 HydrophobicContact CD2-CB 4.29Å; F156-L173 HydrophobicContact CD2-CD1 3.65Å; F156-L173 HydrophobicContact CE1-CB 4Å; F156-L173 HydrophobicContact CE1-CD1 4.3Å; F156-L173 HydrophobicContact CE2-CD1 3.68Å; F156-L173 HydrophobicContact CG-CB 3.69Å; F156-L173 HydrophobicContact CG-CD1 3.96Å; F156-L173 HydrophobicContact CG-CG 4.49Å; F156-L173 HydrophobicContact CZ-CD1 4.02Å; L173-E442 HydrophobicContact CD2-CB 3.9Å; L173-E442 HydrophobicContact CD2-CG 3.95Å; L173-W445 HydrophobicContact CD1-CZ3 4.45Å; L173-I446 HydrophobicContact CD1-CD1 4.09Å; L173-I446 HydrophobicContact CD1-CG1 4.28Å
174	G	79.3	Confident	84.8	Confident	59 Å²	59	43 Å²	43	61%	0.608	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	88	-12.9	-177.8	0	0	0	0	0	115.4	F172	F172-G174 PolarHBondContact O-N 3.35Å
175	A	83.3	Confident	85	Confident	16 Å²	16	42.3 Å²	42.3	13%	0.132	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	130.2	176	0	0	0	0	0	111.5	F156 C158 S171 F172 C178	F156-A175 HydrophobicContact CD1-CB 3.8Å; F156-A175 HydrophobicContact CE1-CB 3.87Å; C158-A175 HydrophobicContact CB-CB 3.98Å; S171-A175 WeakPolarHBondContact CA-O 3.49Å; F172-A175 PolarHBondContact N-O 3.45Å; F172-A175 PolarHBondContact O-N 3.03Å; A175-C178 HydrophobicContact CB-CB 4.18Å; A175-C178 WeakPolarHBondContact O-CB 3.32Å
176	Q	85.7	Confident	85.5	Confident	131 Å²	131	39.2 Å²	39.2	61%	0.612	26%	0.26	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.1	157.3	178.9	-62.8	-64.9	-27.8	0	0	112.4	S170 C178	S170-Q176 CarbonylContact O-C 3.12Å; Q176-C178 PolarHBondContact O-N 3.41Å; Q176-C178 VanDerWaalsContact O-N 3.15Å
177	D	86.9	Confident	86.3	Confident	41 Å²	41	35.1 Å²	35.1	22%	0.219	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	51	30.1	-174.4	-63.4	-43.5	0	0	0	113.2	T164 P166 G167 S170	T164-D177 PolarHBondContact N-O 3.17Å; T164-D177 PolarHBondContact OG1-O 3Å; P166-D177 WeakPolarHBondContact CA-OD1 3.5Å; G167-D177 PolarHBondContact N-OD1 3.49Å; S170-D177 WeakPolarHBondContact O-CA 3.35Å; S170-D177 PolarHBondContact O-N 3.06Å
178	C	87.3	Confident	87.4	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	23%	0.23	C	C	.	.	B	Isolated β-bridge	trans	-119.9	147.8	-174.8	-154	0	0	0	0	112.2	C158 F172 A175 Q176 L271	C158-C178 HydrophobicContact CB-CB 3.62Å; C158-C178 WeakPolarHBondContact CB-SG 3.19Å; C158-C178 VanDerWaalsContact SG-CA 3.55Å; C158-C178 WeakPolarHBondContact SG-CB 3.12Å; C158-C178 CovalentContact SG-SG 2.03Å; C158-C178 PolarHBondContact SG-SG 3.47Å; F172-C178 HydrophobicContact CB-CB 4.08Å; A175-C178 HydrophobicContact CB-CB 4.18Å; A175-C178 WeakPolarHBondContact O-CB 3.32Å; Q176-C178 PolarHBondContact O-N 3.41Å; Q176-C178 VanDerWaalsContact O-N 3.15Å; C178-L271 WeakPolarHBondContact O-CD1 3.28Å
179	A	92	Very high	88.4	Confident	1 Å²	1	41.8 Å²	41.8	1%	0.008	25%	0.246	C	C	.	.			trans	-139.7	151.4	176.2	0	0	0	0	0	113.4	L162 T164 T268 L271	L162-A179 PolarHBondContact O-N 3Å; T164-A179 HydrophobicContact CG2-CB 3.49Å; T164-A179 VanDerWaalsContact CG2-CB 3.49Å; A179-T268 HydrophobicContact CB-CG2 4.19Å; A179-L271 HydrophobicContact CB-CD1 3.77Å; A179-L271 HydrophobicContact CB-CG 4.13Å
180	P	92.8	Very high	89.3	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	25%	0.246	C	C	.	.			trans	-59.9	151.7	170.2	-11.9	18.8	0	0	0	112.6	F172 M185 T268 V269 Y358	F172-P180 HydrophobicContact CD2-CB 4.33Å; F172-P180 HydrophobicContact CD2-CG 3.58Å; F172-P180 HydrophobicContact CE2-CB 4.02Å; F172-P180 HydrophobicContact CE2-CG 3.67Å; F172-P180 HydrophobicContact CG-CG 4.15Å; F172-P180 HydrophobicContact CZ-CB 4.17Å; F172-P180 HydrophobicContact CZ-CG 4.28Å; P180-M185 HydrophobicContact CB-SD 4Å; P180-T268 CarbonylContact O-C 3.57Å; P180-T268 VanDerWaalsContact O-CA 3.3Å; P180-T268 WeakPolarHBondContact O-CA 3.23Å; P180-T268 WeakPolarHBondContact O-CB 3.16Å; P180-V269 HydrophobicContact CB-CG2 3.82Å; P180-V269 HydrophobicContact CG-CG2 3.57Å; P180-V269 PolarHBondContact O-N 3.19Å; P180-Y358 HydrophobicContact CB-CD1 4.09Å; P180-Y358 HydrophobicContact CB-CE1 3.74Å; P180-Y358 HydrophobicContact CG-CD1 3.44Å; P180-Y358 VanDerWaalsContact CG-CD1 3.44Å; P180-Y358 HydrophobicContact CG-CD2 3.92Å; P180-Y358 HydrophobicContact CG-CE1 3.53Å; P180-Y358 HydrophobicContact CG-CE2 4.02Å; P180-Y358 HydrophobicContact CG-CG 3.66Å
181	P	92.9	Very high	89.8	Confident	1 Å²	1	46.3 Å²	46.3	1%	0.006	25%	0.254	C	S	.	.	B	Isolated β-bridge	trans	-63.3	147.6	170.9	27.3	-34.2	0	0	0	112.2	L162 S183 M185 V266 W445	L162-P181 HydrophobicContact CD2-CB 4.05Å; L162-P181 HydrophobicContact CD2-CG 4.44Å; P181-S183 VanDerWaalsContact C-N 3.34Å; P181-S183 CarbonylContact C-O 3.6Å; P181-M185 HydrophobicContact CG-CG 4.1Å; P181-V266 HydrophobicContact CB-CG2 4.43Å; P181-W445 HydrophobicContact CG-CZ2 4.03Å
182	C	93.3	Very high	90.2	Very high	6 Å²	6	44.3 Å²	44.3	4%	0.041	24%	0.239	C	C	.	.	S	Bend	trans	-69.4	-33.7	173.7	179.6	0	0	0	0	111.8	N184 N253 C257 E267 N348	C182-N184 PolarHBondContact O-N 3.14Å; C182-N253 PolarHBondContact SG-ND2 3.27Å; C182-C257 HydrophobicContact CB-CB 3.69Å; C182-C257 WeakPolarHBondContact CB-SG 3.39Å; C182-C257 WeakPolarHBondContact SG-CB 2.91Å; C182-C257 CovalentContact SG-SG 2.03Å; C182-C257 PolarHBondContact SG-SG 3.11Å; C182-E267 HydrophobicContact CB-CB 3.67Å; C182-E267 WeakPolarHBondContact CB-O 3.43Å; C182-E267 PolarHBondContact N-O 2.94Å; C182-N348 WeakPolarHBondContact O-CB 3.39Å; C182-N348 PolarHBondContact O-ND2 2.82Å
183	S	90.3	Very high	90.5	Very high	72 Å²	72	50.2 Å²	50.2	50%	0.503	27%	0.267	S	S	.	.	S	Bend	trans	-62	123.9	162.7	41.7	0	0	0	0	108.6	P181 M185	P181-S183 VanDerWaalsContact C-N 3.34Å; P181-S183 CarbonylContact C-O 3.6Å; S183-M185 PolarHBondContact O-N 3.21Å
184	N	91.9	Very high	91	Very high	25 Å²	25	53.2 Å²	53.2	13%	0.134	28%	0.278	C	S	.	.			trans	-62	135.5	-169.6	-174.5	-85.2	0	0	0	111.4	C182 Y186 F187 I192 N348	C182-N184 PolarHBondContact O-N 3.14Å; N184-Y186 VanDerWaalsContact C-N 3.27Å; N184-Y186 PolarHBondContact O-N 3.07Å; N184-Y186 PolarHBondContact OD1-N 2.96Å; N184-F187 WeakPolarHBondContact OD1-CD2 3.44Å; N184-F187 PolarHBondContact OD1-N 2.9Å; N184-I192 HydrophobicContact CB-CD1 3.77Å; N184-I192 HydrophobicContact CB-CG1 3.92Å; N184-N348 PolarHBondContact ND2-OD1 2.97Å
185	M	91.1	Very high	91.8	Very high	17 Å²	17	50.4 Å²	50.4	8%	0.084	25%	0.249	C	C	.	.	S	Bend	trans	-64.1	-30.2	-177	-67.8	167	62	0	0	113.1	F172 P180 P181 S183 Y358 W445	F172-M185 HydrophobicContact CE2-CE 4.2Å; F172-M185 HydrophobicContact CE2-SD 4.14Å; F172-M185 HydrophobicContact CZ-CE 3.77Å; F172-M185 HydrophobicContact CZ-SD 3.9Å; P180-M185 HydrophobicContact CB-SD 4Å; P181-M185 HydrophobicContact CG-CG 4.1Å; S183-M185 PolarHBondContact O-N 3.21Å; M185-Y358 HydrophobicContact SD-CD1 4.34Å; M185-Y358 HydrophobicContact SD-CE1 4.01Å; M185-W445 HydrophobicContact CB-CG 4.09Å; M185-W445 HydrophobicContact CE-CB 4.27Å; M185-W445 HydrophobicContact CE-CD2 3.72Å; M185-W445 HydrophobicContact CE-CE3 3.8Å; M185-W445 HydrophobicContact CE-CG 3.92Å; M185-W445 HydrophobicContact CE-CZ3 4.46Å; M185-W445 HydrophobicContact CG-CD2 4.3Å; M185-W445 HydrophobicContact CG-CG 4.39Å
186	Y	90.8	Very high	92.4	Very high	39 Å²	39	51.6 Å²	51.6	15%	0.153	25%	0.251	C	S	.	.	S	Bend	trans	-110.8	-27.9	-165.7	-48.4	-57.5	0	0	0	114.1	N184 W441 P467	N184-Y186 VanDerWaalsContact C-N 3.27Å; N184-Y186 PolarHBondContact O-N 3.07Å; N184-Y186 PolarHBondContact OD1-N 2.96Å; Y186-W441 HydrophobicContact CD1-CB 4.16Å; Y186-W441 HydrophobicContact CE1-CB 3.66Å; Y186-P467 HydrophobicContact CD1-CG 4.17Å; Y186-P467 HydrophobicContact CD2-CG 4.31Å; Y186-P467 HydrophobicContact CG-CG 3.76Å
187	F	93.4	Very high	92.9	Very high	21 Å²	21	48.3 Å²	48.3	9%	0.092	24%	0.243	C	C	.	.	S	Bend	trans	-123.6	148.9	-168.6	-56.7	-59.3	0	0	0	112.3	N184 D191 I192 I349 P467 L469 F472	N184-F187 WeakPolarHBondContact OD1-CD2 3.44Å; N184-F187 PolarHBondContact OD1-N 2.9Å; F187-D191 HydrophobicContact CB-CB 3.94Å; F187-I192 HydrophobicContact CB-CD1 3.92Å; F187-I192 HydrophobicContact CB-CG1 4.16Å; F187-I192 HydrophobicContact CD2-CD1 4.19Å; F187-I349 HydrophobicContact CD2-CD1 4.3Å; F187-I349 HydrophobicContact CE2-CD1 4.16Å; F187-P467 HydrophobicContact CE1-CB 4.46Å; F187-P467 HydrophobicContact CE1-CG 4.09Å; F187-P467 WeakPolarHBondContact CE1-O 3.36Å; F187-P467 HydrophobicContact CZ-CB 4.08Å; F187-P467 HydrophobicContact CZ-CG 3.83Å; F187-L469 HydrophobicContact CD1-CB 4.21Å; F187-L469 HydrophobicContact CD1-CD1 4.03Å; F187-L469 HydrophobicContact CD2-CD1 4.14Å; F187-L469 HydrophobicContact CE1-CB 3.9Å; F187-L469 HydrophobicContact CE1-CD1 4.16Å; F187-L469 HydrophobicContact CE2-CD1 4.26Å; F187-L469 HydrophobicContact CG-CD1 4.03Å; F187-L469 HydrophobicContact CZ-CB 4.44Å; F187-L469 HydrophobicContact CZ-CD1 4.26Å; F187-F472 HydrophobicContact CE2-CD1 4.35Å; F187-F472 AromaticContact CE2-CD2 3.96Å; F187-F472 HydrophobicContact CE2-CD2 3.96Å; F187-F472 HydrophobicContact CE2-CE1 4.47Å; F187-F472 HydrophobicContact CE2-CE2 4.13Å; F187-F472 HydrophobicContact CE2-CG 4.1Å; F187-F472 HydrophobicContact CE2-CZ 4.37Å; F187-F472 AromaticContact CZ-CD2 3.68Å; F187-F472 HydrophobicContact CZ-CD2 3.68Å; F187-F472 AromaticContact CZ-CE2 3.85Å; F187-F472 HydrophobicContact CZ-CE2 3.85Å; F187-F472 HydrophobicContact CZ-CG 4.24Å; F187-F472 HydrophobicContact CZ-CZ 4.5Å
188	R	93.1	Very high	93.4	Very high	176 Å²	176	49 Å²	49	66%	0.664	24%	0.244	S	C	*	.			trans	-76.2	159.9	179.7	-58.3	171.7	173	174.6	-2.5	110.4	H190 D191 I192	R188-H190 VanDerWaalsContact C-N 3.27Å; R188-H190 PolarHBondContact O-N 3.35Å; R188-H190 VanDerWaalsContact O-N 3.14Å; R188-D191 WeakPolarHBondContact CA-OD2 3.15Å; R188-D191 VanDerWaalsContact CB-OD2 3.26Å; R188-D191 WeakPolarHBondContact CB-OD2 3.29Å; R188-D191 PolarHBondContact N-OD2 2.96Å; R188-D191 WeakPolarHBondContact O-CB 3.41Å; R188-D191 PolarHBondContact O-N 3.26Å; R188-I192 PolarHBondContact O-N 2.94Å
189	P	93.3	Very high	93.9	Very high	102 Å²	102	49.1 Å²	49.1	66%	0.662	24%	0.244	S	C	*	.	H	α-helix	trans	-50.8	-41.8	179.6	-30	36.7	0	0	0	114.4	D191 I192 E193	P189-D191 VanDerWaalsContact C-N 3.28Å; P189-D191 PolarHBondContact O-N 3.2Å; P189-I192 PolarHBondContact O-N 3.47Å; P189-E193 WeakPolarHBondContact O-CG 3.31Å; P189-E193 PolarHBondContact O-N 2.91Å
190	H	94.2	Very high	94.1	Very high	110 Å²	110	49.1 Å²	49.1	51%	0.509	24%	0.244	S	C	.	.	H	α-helix	trans	-64.2	-29.3	178.7	70.3	9.6	0	0	0	114.1	R188 F194	R188-H190 VanDerWaalsContact C-N 3.27Å; R188-H190 PolarHBondContact O-N 3.35Å; R188-H190 VanDerWaalsContact O-N 3.14Å; H190-F194 WeakPolarHBondContact O-CB 3.49Å; H190-F194 PolarHBondContact O-N 3.47Å
191	D	94.9	Very high	94.4	Very high	39 Å²	39	53.2 Å²	53.2	21%	0.209	27%	0.269	C	S	.	.	H	α-helix	trans	-73.1	-38.8	179.9	-60.9	-46.6	0	0	0	109.4	F187 R188 P189 A195 L469	F187-D191 HydrophobicContact CB-CB 3.94Å; R188-D191 WeakPolarHBondContact CA-OD2 3.15Å; R188-D191 VanDerWaalsContact CB-OD2 3.26Å; R188-D191 WeakPolarHBondContact CB-OD2 3.29Å; R188-D191 PolarHBondContact N-OD2 2.96Å; R188-D191 WeakPolarHBondContact O-CB 3.41Å; R188-D191 PolarHBondContact O-N 3.26Å; P189-D191 VanDerWaalsContact C-N 3.28Å; P189-D191 PolarHBondContact O-N 3.2Å; D191-A195 VanDerWaalsContact O-CB 3.26Å; D191-A195 WeakPolarHBondContact O-CB 3.45Å; D191-A195 PolarHBondContact O-N 3.45Å; D191-L469 HydrophobicContact CB-CD1 4.17Å; D191-L469 HydrophobicContact CB-CD2 3.85Å
192	I	94.5	Very high	94.6	Very high	14 Å²	14	53.9 Å²	53.9	7%	0.072	27%	0.274	C	S	.	.	H	α-helix	trans	-70.6	-40.5	177.4	-62.6	-60.9	0	0	0	111.1	N184 F187 R188 P189 A195 K196 I349	N184-I192 HydrophobicContact CB-CD1 3.77Å; N184-I192 HydrophobicContact CB-CG1 3.92Å; F187-I192 HydrophobicContact CB-CD1 3.92Å; F187-I192 HydrophobicContact CB-CG1 4.16Å; F187-I192 HydrophobicContact CD2-CD1 4.19Å; R188-I192 PolarHBondContact O-N 2.94Å; P189-I192 PolarHBondContact O-N 3.47Å; I192-A195 PolarHBondContact O-N 2.84Å; I192-K196 HydrophobicContact CG2-CD 3.97Å; I192-K196 WeakPolarHBondContact O-CB 3.47Å; I192-K196 VanDerWaalsContact O-CG 3.23Å; I192-K196 WeakPolarHBondContact O-CG 3.15Å; I192-K196 PolarHBondContact O-N 2.84Å; I192-I349 HydrophobicContact CD1-CB 4.3Å; I192-I349 HydrophobicContact CD1-CG1 3.87Å; I192-I349 HydrophobicContact CD1-CG2 4.18Å
193	E	93.9	Very high	94.8	Very high	129 Å²	129	53.6 Å²	53.6	60%	0.603	27%	0.272	S	S	*	.	H	α-helix	trans	-64.5	-41.4	174.2	-73.2	175.3	179.7	0	0	112.1	P189 S197	P189-E193 WeakPolarHBondContact O-CG 3.31Å; P189-E193 PolarHBondContact O-N 2.91Å; E193-S197 WeakPolarHBondContact O-CB 3.36Å; E193-S197 PolarHBondContact O-N 2.94Å; E193-S197 VanDerWaalsContact O-N 3.08Å; E193-S197 PolarHBondContact O-OG 3.43Å
194	F	95.8	Very high	95.2	Very high	118 Å²	118	54.2 Å²	54.2	52%	0.518	27%	0.269	S	S	.	.	H	α-helix	trans	-62.6	-48.1	171.8	177.1	-108.1	0	0	0	111.7	H190 K196 S197 F198 L469 L473	H190-F194 WeakPolarHBondContact O-CB 3.49Å; H190-F194 PolarHBondContact O-N 3.47Å; F194-K196 PolarHBondContact O-N 3.38Å; F194-S197 PolarHBondContact O-N 3.42Å; F194-F198 WeakPolarHBondContact O-CB 3.46Å; F194-F198 PolarHBondContact O-N 3.12Å; F194-L469 HydrophobicContact CD1-CD2 4.33Å; F194-L473 HydrophobicContact CD1-CD1 4.32Å; F194-L473 HydrophobicContact CE1-CD1 3.78Å
195	A	96.6	Very high	95.4	Very high	1 Å²	1	57.6 Å²	57.6	1%	0.008	29%	0.285	C	S	.	.	H	α-helix	trans	-60.5	-44	178.7	0	0	0	0	0	112.4	D191 I192 S197 F198 I199 I349 L469 L473	D191-A195 VanDerWaalsContact O-CB 3.26Å; D191-A195 WeakPolarHBondContact O-CB 3.45Å; D191-A195 PolarHBondContact O-N 3.45Å; I192-A195 PolarHBondContact O-N 2.84Å; A195-S197 VanDerWaalsContact C-N 3.35Å; A195-S197 PolarHBondContact O-N 3.45Å; A195-F198 PolarHBondContact O-N 3.39Å; A195-I199 WeakPolarHBondContact O-CB 3.33Å; A195-I199 WeakPolarHBondContact O-CD1 3.45Å; A195-I199 WeakPolarHBondContact O-CG1 3.21Å; A195-I199 PolarHBondContact O-N 2.61Å; A195-I349 HydrophobicContact CB-CG2 3.78Å; A195-L469 HydrophobicContact CB-CD1 4.44Å; A195-L473 HydrophobicContact CB-CD2 3.87Å
196	K	95.3	Very high	95.7	Very high	41 Å²	41	56.8 Å²	56.8	18%	0.178	28%	0.281	C	S	.	.	H	α-helix	trans	-57.6	-47.4	174.3	-76.9	168.4	176.4	160.5	0	111.8	I192 F194 I199 G200 F249 N253 N348 I349	I192-K196 HydrophobicContact CG2-CD 3.97Å; I192-K196 WeakPolarHBondContact O-CB 3.47Å; I192-K196 VanDerWaalsContact O-CG 3.23Å; I192-K196 WeakPolarHBondContact O-CG 3.15Å; I192-K196 PolarHBondContact O-N 2.84Å; F194-K196 PolarHBondContact O-N 3.38Å; K196-I199 PolarHBondContact O-N 3.06Å; K196-G200 PolarHBondContact O-N 3.08Å; K196-F249 WeakPolarHBondContact O-CD2 3.46Å; K196-N253 WeakPolarHBondContact CE-OD1 3.49Å; K196-N253 PolarHBondContact NZ-OD1 3.24Å; K196-N348 WeakPolarHBondContact CE-O 3.48Å; K196-N348 PolarHBondContact NZ-O 3.26Å; K196-I349 WeakPolarHBondContact CE-O 3.42Å; K196-I349 WeakPolarHBondContact CG-O 3.48Å
197	S	96.1	Very high	96	Very high	62 Å²	62	56.8 Å²	56.8	43%	0.434	28%	0.284	S	S	.	.	H	α-helix	trans	-63	-43.2	178.8	-57	0	0	0	0	111.7	E193 F194 A195 G200 V201	E193-S197 WeakPolarHBondContact O-CB 3.36Å; E193-S197 PolarHBondContact O-N 2.94Å; E193-S197 VanDerWaalsContact O-N 3.08Å; E193-S197 PolarHBondContact O-OG 3.43Å; F194-S197 PolarHBondContact O-N 3.42Å; A195-S197 VanDerWaalsContact C-N 3.35Å; A195-S197 PolarHBondContact O-N 3.45Å; S197-G200 PolarHBondContact O-N 3.32Å; S197-V201 WeakPolarHBondContact O-CG2 3.48Å; S197-V201 PolarHBondContact O-N 3.45Å
198	F	97.6	Very high	96.1	Very high	55 Å²	55	57.8 Å²	57.8	24%	0.241	30%	0.3	C	S	.	.	H	α-helix	trans	-63.1	-47.9	176.4	175.9	-95.4	0	0	0	112.5	F194 A195 V201 C202 L473 L477	F194-F198 WeakPolarHBondContact O-CB 3.46Å; F194-F198 PolarHBondContact O-N 3.12Å; A195-F198 PolarHBondContact O-N 3.39Å; F198-V201 PolarHBondContact O-N 3.25Å; F198-C202 WeakPolarHBondContact O-CB 3.44Å; F198-C202 PolarHBondContact O-N 2.83Å; F198-C202 PolarHBondContact O-SG 3.05Å; F198-L473 HydrophobicContact CB-CD2 4.27Å; F198-L473 HydrophobicContact CD1-CB 4.39Å; F198-L473 HydrophobicContact CD1-CD2 3.63Å; F198-L473 HydrophobicContact CE1-CB 4.07Å; F198-L473 HydrophobicContact CE1-CD2 4.19Å; F198-L473 HydrophobicContact CG-CD2 4.07Å; F198-L477 HydrophobicContact CE1-CB 4.07Å; F198-L477 HydrophobicContact CZ-CB 4.04Å; F198-L477 HydrophobicContact CZ-CD1 4.01Å; F198-L477 HydrophobicContact CZ-CD2 4.31Å; F198-L477 HydrophobicContact CZ-CG 4.34Å
199	I	97.7	Very high	96.1	Very high	3 Å²	3	50.1 Å²	50.1	2%	0.015	27%	0.274	C	S	.	.	H	α-helix	trans	-62.5	-44.1	176.9	-65.3	164.2	0	0	0	110	A195 K196 C202 S203 Y245 I349 Y476	A195-I199 WeakPolarHBondContact O-CB 3.33Å; A195-I199 WeakPolarHBondContact O-CD1 3.45Å; A195-I199 WeakPolarHBondContact O-CG1 3.21Å; A195-I199 PolarHBondContact O-N 2.61Å; K196-I199 PolarHBondContact O-N 3.06Å; I199-C202 PolarHBondContact O-N 3.26Å; I199-S203 VanDerWaalsContact O-CB 3.27Å; I199-S203 WeakPolarHBondContact O-CB 3.41Å; I199-S203 PolarHBondContact O-N 3.37Å; I199-S203 PolarHBondContact O-OG 3.36Å; I199-Y245 HydrophobicContact CG2-CD1 4.02Å; I199-Y245 HydrophobicContact CG2-CG 4.26Å; I199-I349 HydrophobicContact CD1-CG2 4.42Å; I199-Y476 HydrophobicContact CD1-CD1 4.05Å; I199-Y476 HydrophobicContact CD1-CD2 3.5Å; I199-Y476 HydrophobicContact CD1-CE1 4.31Å; I199-Y476 HydrophobicContact CD1-CE2 3.84Å; I199-Y476 HydrophobicContact CD1-CG 3.65Å; I199-Y476 HydrophobicContact CG1-CD1 4.47Å; I199-Y476 HydrophobicContact CG1-CD2 4.02Å; I199-Y476 HydrophobicContact CG1-CG 3.86Å
200	G	97.3	Very high	96.2	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-54.9	-54.7	174.6	0	0	0	0	0	112.3	K196 S197 C202 S203 I204	K196-G200 PolarHBondContact O-N 3.08Å; S197-G200 PolarHBondContact O-N 3.32Å; G200-C202 PolarHBondContact O-N 3.11Å; G200-S203 PolarHBondContact O-N 3.18Å; G200-S203 PolarHBondContact O-OG 2.64Å; G200-I204 WeakPolarHBondContact O-CG1 3.21Å; G200-I204 PolarHBondContact O-N 2.69Å
201	V	97.7	Very high	96.1	Very high	86 Å²	86	43.8 Å²	43.8	52%	0.521	24%	0.238	S	C	.	.	H	α-helix	trans	-60.4	-45.7	178	171.2	0	0	0	0	112	S197 F198 S203 I204 I205	S197-V201 WeakPolarHBondContact O-CG2 3.48Å; S197-V201 PolarHBondContact O-N 3.45Å; F198-V201 PolarHBondContact O-N 3.25Å; V201-S203 VanDerWaalsContact C-N 3.28Å; V201-S203 PolarHBondContact O-N 3.36Å; V201-I204 PolarHBondContact O-N 2.89Å; V201-I205 HydrophobicContact CG1-CD1 3.98Å; V201-I205 WeakPolarHBondContact O-CG1 3.44Å; V201-I205 PolarHBondContact O-N 3.48Å; V201-I205 VanDerWaalsContact O-N 3.17Å
202	C	97.8	Very high	96	Very high	16 Å²	16	45.3 Å²	45.3	11%	0.108	24%	0.243	C	C	.	.	H	α-helix	trans	-61.7	-37.2	177	-67.7	0	0	0	0	112.1	F198 I199 G200 I205 C206 L480	F198-C202 WeakPolarHBondContact O-CB 3.44Å; F198-C202 PolarHBondContact O-N 2.83Å; F198-C202 PolarHBondContact O-SG 3.05Å; I199-C202 PolarHBondContact O-N 3.26Å; G200-C202 PolarHBondContact O-N 3.11Å; C202-I205 PolarHBondContact O-N 3.17Å; C202-C206 WeakPolarHBondContact O-CB 3.32Å; C202-C206 PolarHBondContact O-N 3.12Å; C202-L480 HydrophobicContact CB-CB 4.42Å; C202-L480 HydrophobicContact CB-CD1 3.61Å
203	S	97.9	Very high	95.8	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-67.8	-40.8	179.3	76.9	0	0	0	0	111.9	I199 G200 V201 I205 C206 L207 S242 F246	I199-S203 VanDerWaalsContact O-CB 3.27Å; I199-S203 WeakPolarHBondContact O-CB 3.41Å; I199-S203 PolarHBondContact O-N 3.37Å; I199-S203 PolarHBondContact O-OG 3.36Å; G200-S203 PolarHBondContact O-N 3.18Å; G200-S203 PolarHBondContact O-OG 2.64Å; V201-S203 VanDerWaalsContact C-N 3.28Å; V201-S203 PolarHBondContact O-N 3.36Å; S203-I205 PolarHBondContact O-N 3.06Å; S203-C206 PolarHBondContact O-N 2.84Å; S203-L207 VanDerWaalsContact O-CB 3.25Å; S203-L207 WeakPolarHBondContact O-CB 3.35Å; S203-L207 PolarHBondContact O-N 3.34Å; S203-S242 WeakPolarHBondContact CB-O 3.16Å; S203-F246 WeakPolarHBondContact OG-CA 3.36Å; S203-F246 WeakPolarHBondContact OG-CB 3.32Å; S203-F246 PolarHBondContact OG-N 2.94Å
204	I	97.6	Very high	95.6	Very high	85 Å²	85	41.7 Å²	41.7	44%	0.436	23%	0.225	S	C	.	.	H	α-helix	trans	-62.1	-44.1	175.7	-65.7	163.1	0	0	0	110.8	G200 V201 L207 G208 F246	G200-I204 WeakPolarHBondContact O-CG1 3.21Å; G200-I204 PolarHBondContact O-N 2.69Å; V201-I204 PolarHBondContact O-N 2.89Å; I204-L207 PolarHBondContact O-N 2.69Å; I204-G208 PolarHBondContact O-N 2.88Å; I204-F246 HydrophobicContact CD1-CD2 4.06Å; I204-F246 HydrophobicContact CD1-CE2 3.81Å; I204-F246 HydrophobicContact CG1-CD2 3.59Å; I204-F246 HydrophobicContact CG1-CE2 3.72Å; I204-F246 HydrophobicContact CG1-CG 4.47Å
205	I	97	Very high	95.2	Very high	95 Å²	95	39.2 Å²	39.2	49%	0.487	22%	0.217	S	C	.	.	H	α-helix	trans	-64.1	-45.9	178.1	-63.9	166.8	0	0	0	110.5	V201 C202 S203 G208 A209 I484	V201-I205 HydrophobicContact CG1-CD1 3.98Å; V201-I205 WeakPolarHBondContact O-CG1 3.44Å; V201-I205 PolarHBondContact O-N 3.48Å; V201-I205 VanDerWaalsContact O-N 3.17Å; C202-I205 PolarHBondContact O-N 3.17Å; S203-I205 PolarHBondContact O-N 3.06Å; I205-G208 PolarHBondContact O-N 3.45Å; I205-A209 VanDerWaalsContact O-CB 3.25Å; I205-A209 WeakPolarHBondContact O-CB 3.27Å; I205-A209 PolarHBondContact O-N 3.17Å; I205-I484 HydrophobicContact CG2-CD1 3.77Å; I205-I484 HydrophobicContact CG2-CG1 4.46Å
206	C	96.9	Very high	94.8	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-62.5	-41.1	175.9	179.2	0	0	0	0	112.4	C202 S203 A209 T210 S242 L480 I484	C202-C206 WeakPolarHBondContact O-CB 3.32Å; C202-C206 PolarHBondContact O-N 3.12Å; S203-C206 PolarHBondContact O-N 2.84Å; C206-A209 PolarHBondContact O-N 3.35Å; C206-T210 WeakPolarHBondContact O-CB 3.36Å; C206-T210 WeakPolarHBondContact O-CG2 3.14Å; C206-T210 PolarHBondContact O-N 3.37Å; C206-T210 PolarHBondContact O-OG1 2.98Å; C206-S242 VanDerWaalsContact SG-CB 3.59Å; C206-L480 HydrophobicContact CB-CB 4.23Å; C206-L480 HydrophobicContact CB-CD2 4.09Å; C206-L480 PolarHBondContact SG-O 2.04Å; C206-L480 VanDerWaalsContact SG-O 3.34Å; C206-I484 HydrophobicContact CB-CG1 4.39Å
207	L	96.8	Very high	94.4	Very high	39 Å²	39	38.9 Å²	38.9	20%	0.204	22%	0.216	C	C	.	.	H	α-helix	trans	-65.1	-45.5	179.2	-177.5	58.6	0	0	0	111.1	S203 I204 A209 T210 L211 S239 S242 L243	S203-L207 VanDerWaalsContact O-CB 3.25Å; S203-L207 WeakPolarHBondContact O-CB 3.35Å; S203-L207 PolarHBondContact O-N 3.34Å; I204-L207 PolarHBondContact O-N 2.69Å; L207-A209 PolarHBondContact O-N 2.88Å; L207-T210 PolarHBondContact O-OG1 3.37Å; L207-L211 WeakPolarHBondContact O-CB 3.45Å; L207-L211 PolarHBondContact O-N 2.64Å; L207-S239 WeakPolarHBondContact CD1-O 3.32Å; L207-S242 WeakPolarHBondContact CA-OG 3.38Å; L207-S242 PolarHBondContact N-OG 2.91Å; L207-L243 HydrophobicContact CD1-CB 4.26Å; L207-L243 HydrophobicContact CD2-CD1 4.31Å
208	G	95.7	Very high	93.9	Very high	42 Å²	42	40.3 Å²	40.3	43%	0.433	22%	0.218	S	C	.	.	H	α-helix	trans	-61.1	-43.3	174	0	0	0	0	0	113	I204 I205 F212	I204-G208 PolarHBondContact O-N 2.88Å; I205-G208 PolarHBondContact O-N 3.45Å; G208-F212 VanDerWaalsContact O-CB 3.32Å; G208-F212 WeakPolarHBondContact O-CB 3.24Å; G208-F212 PolarHBondContact O-N 2.85Å
209	A	94.6	Very high	93.3	Very high	15 Å²	15	40.1 Å²	40.1	12%	0.124	22%	0.219	C	C	.	.	H	α-helix	trans	-64	-47.8	178.9	0	0	0	0	0	113.2	I205 C206 L207 T213 I484 V487	I205-A209 VanDerWaalsContact O-CB 3.25Å; I205-A209 WeakPolarHBondContact O-CB 3.27Å; I205-A209 PolarHBondContact O-N 3.17Å; C206-A209 PolarHBondContact O-N 3.35Å; L207-A209 PolarHBondContact O-N 2.88Å; A209-T213 PolarHBondContact O-N 2.84Å; A209-T213 PolarHBondContact O-OG1 2.94Å; A209-I484 HydrophobicContact CB-CB 4.46Å; A209-I484 HydrophobicContact CB-CG1 4.28Å; A209-I484 HydrophobicContact CB-CG2 4.41Å; A209-V487 HydrophobicContact CB-CG2 3.53Å; A209-V487 VanDerWaalsContact O-CG2 3.23Å; A209-V487 WeakPolarHBondContact O-CG2 3.44Å
210	T	94.4	Very high	92.5	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-71	-40.1	179.1	52.3	0	0	0	0	111.8	C206 L207 T213 F214 S239 G483	C206-T210 WeakPolarHBondContact O-CB 3.36Å; C206-T210 WeakPolarHBondContact O-CG2 3.14Å; C206-T210 PolarHBondContact O-N 3.37Å; C206-T210 PolarHBondContact O-OG1 2.98Å; L207-T210 PolarHBondContact O-OG1 3.37Å; T210-T213 WeakPolarHBondContact O-CB 3.31Å; T210-T213 PolarHBondContact O-N 3.07Å; T210-F214 PolarHBondContact O-N 2.7Å; T210-S239 VanDerWaalsContact OG1-CA 3.32Å; T210-S239 WeakPolarHBondContact OG1-CA 3.37Å; T210-S239 WeakPolarHBondContact OG1-CB 3.25Å; T210-G483 WeakPolarHBondContact CG2-O 3.31Å
211	L	92.6	Very high	91.8	Very high	79 Å²	79	44.9 Å²	44.9	41%	0.414	25%	0.247	S	C	.	.	H	α-helix	trans	-64.4	-42.6	175.4	-176.7	61.5	0	0	0	112	L207 T213 F214 L215	L207-L211 WeakPolarHBondContact O-CB 3.45Å; L207-L211 PolarHBondContact O-N 2.64Å; L211-T213 VanDerWaalsContact C-N 3.28Å; L211-T213 PolarHBondContact O-N 3.47Å; L211-F214 PolarHBondContact O-N 2.93Å; L211-L215 HydrophobicContact CD1-CD1 4.16Å; L211-L215 HydrophobicContact CD1-CG 4.03Å; L211-L215 HydrophobicContact CG-CD1 3.89Å; L211-L215 HydrophobicContact CG-CG 4.22Å; L211-L215 WeakPolarHBondContact O-CB 3.4Å; L211-L215 VanDerWaalsContact O-CG 3.27Å; L211-L215 WeakPolarHBondContact O-CG 3.27Å; L211-L215 PolarHBondContact O-N 3Å
212	F	91.8	Very high	90.9	Very high	71 Å²	71	49.7 Å²	49.7	31%	0.311	26%	0.261	S	S	.	.	H	α-helix	trans	-59.1	-40.7	173.5	172.1	-103.5	0	0	0	112.2	G208 T216 V487 V490 T495 W499	G208-F212 VanDerWaalsContact O-CB 3.32Å; G208-F212 WeakPolarHBondContact O-CB 3.24Å; G208-F212 PolarHBondContact O-N 2.85Å; F212-T216 WeakPolarHBondContact O-CB 3.41Å; F212-T216 PolarHBondContact O-N 3.02Å; F212-T216 PolarHBondContact O-OG1 3.47Å; F212-V487 HydrophobicContact CD1-CG1 4.5Å; F212-V490 HydrophobicContact CE1-CG1 4.43Å; F212-T495 HydrophobicContact CZ-CG2 3.93Å; F212-W499 AromaticContact CD2-CZ2 3.81Å; F212-W499 HydrophobicContact CD2-CZ2 3.81Å; F212-W499 HydrophobicContact CE2-CD2 4.37Å; F212-W499 AromaticContact CE2-CE2 3.62Å; F212-W499 AromaticContact CE2-CZ2 3.86Å; F212-W499 HydrophobicContact CE2-CZ2 3.86Å; F212-W499 AromaticContact CE2-NE1 3.42Å; F212-W499 AromaticContact CZ-NE1 3.87Å
213	T	90.1	Very high	89.9	Confident	2 Å²	2	51.7 Å²	51.7	1%	0.012	27%	0.266	C	S	.	.	H	α-helix	trans	-61.7	-49.4	175.7	-58.4	0	0	0	0	110.8	A209 T210 L211 T216 F217 A235 A486 V490	A209-T213 PolarHBondContact O-N 2.84Å; A209-T213 PolarHBondContact O-OG1 2.94Å; T210-T213 WeakPolarHBondContact O-CB 3.31Å; T210-T213 PolarHBondContact O-N 3.07Å; L211-T213 VanDerWaalsContact C-N 3.28Å; L211-T213 PolarHBondContact O-N 3.47Å; T213-T216 PolarHBondContact O-N 3.28Å; T213-F217 PolarHBondContact O-N 3.45Å; T213-A235 HydrophobicContact CG2-CB 3.83Å; T213-A486 HydrophobicContact CG2-CB 3.7Å; T213-V490 HydrophobicContact CG2-CB 4.47Å; T213-V490 HydrophobicContact CG2-CG2 3.57Å
214	F	89.7	Confident	88.9	Confident	65 Å²	65	52 Å²	52	29%	0.285	27%	0.268	S	S	.	.	H	α-helix	trans	-65.3	-45.3	179.2	178	-116.5	0	0	0	113	T210 L211 T216 F217 L218 I232 V236	T210-F214 PolarHBondContact O-N 2.7Å; L211-F214 PolarHBondContact O-N 2.93Å; F214-T216 VanDerWaalsContact C-N 3.29Å; F214-T216 PolarHBondContact O-N 3.11Å; F214-F217 HydrophobicContact CD2-CD1 4.46Å; F214-F217 HydrophobicContact CE2-CD1 4.45Å; F214-F217 WeakPolarHBondContact O-CB 3.21Å; F214-F217 PolarHBondContact O-N 2.86Å; F214-F217 VanDerWaalsContact O-N 3.08Å; F214-L218 HydrophobicContact CD1-CD1 4.3Å; F214-L218 HydrophobicContact CE1-CD1 3.75Å; F214-L218 HydrophobicContact CE1-CG 4.33Å; F214-L218 HydrophobicContact CE2-CD2 4.27Å; F214-L218 HydrophobicContact CE2-CG 4.42Å; F214-L218 HydrophobicContact CZ-CD1 3.95Å; F214-L218 HydrophobicContact CZ-CD2 4.12Å; F214-L218 HydrophobicContact CZ-CG 4.19Å; F214-L218 PolarHBondContact O-N 3.31Å; F214-I232 HydrophobicContact CD2-CG2 4.5Å; F214-V236 HydrophobicContact CD2-CG2 3.43Å; F214-V236 VanDerWaalsContact CD2-CG2 3.43Å; F214-V236 HydrophobicContact CE2-CG2 3.67Å; F214-V236 HydrophobicContact CG-CG2 4.14Å
215	L	88.6	Confident	88.2	Confident	67 Å²	67	55 Å²	55	35%	0.351	27%	0.274	S	S	.	.	H	α-helix	trans	-61.5	-37	176	-70.1	174.4	0	0	0	112	L211 F217 L218 I219 W499	L211-L215 HydrophobicContact CD1-CD1 4.16Å; L211-L215 HydrophobicContact CD1-CG 4.03Å; L211-L215 HydrophobicContact CG-CD1 3.89Å; L211-L215 HydrophobicContact CG-CG 4.22Å; L211-L215 WeakPolarHBondContact O-CB 3.4Å; L211-L215 VanDerWaalsContact O-CG 3.27Å; L211-L215 WeakPolarHBondContact O-CG 3.27Å; L211-L215 PolarHBondContact O-N 3Å; L215-F217 VanDerWaalsContact C-N 3.31Å; L215-F217 PolarHBondContact O-N 3.31Å; L215-L218 HydrophobicContact CD2-CD1 4.43Å; L215-L218 PolarHBondContact O-N 3.46Å; L215-I219 WeakPolarHBondContact O-CG1 3.25Å; L215-I219 PolarHBondContact O-N 3.05Å; L215-I219 VanDerWaalsContact O-N 3.07Å; L215-W499 HydrophobicContact CB-CH2 3.79Å; L215-W499 HydrophobicContact CB-CZ2 3.82Å; L215-W499 HydrophobicContact CD1-CH2 4.19Å
216	T	88.7	Confident	87.5	Confident	4 Å²	4	50.5 Å²	50.5	3%	0.025	25%	0.251	C	S	.	.	H	α-helix	trans	-64	-36.4	174.4	-55.1	0	0	0	0	112.1	F212 T213 F214 I219 D220 V490 T495 W499	F212-T216 WeakPolarHBondContact O-CB 3.41Å; F212-T216 PolarHBondContact O-N 3.02Å; F212-T216 PolarHBondContact O-OG1 3.47Å; T213-T216 PolarHBondContact O-N 3.28Å; F214-T216 VanDerWaalsContact C-N 3.29Å; F214-T216 PolarHBondContact O-N 3.11Å; T216-I219 PolarHBondContact O-N 3.16Å; T216-D220 PolarHBondContact O-N 2.61Å; T216-V490 HydrophobicContact CG2-CG1 3.44Å; T216-V490 VanDerWaalsContact CG2-CG1 3.44Å; T216-T495 HydrophobicContact CG2-CG2 3.74Å; T216-W499 PolarHBondContact OG1-NE1 3.5Å
217	F	85.3	Confident	86.8	Confident	30 Å²	30	50.9 Å²	50.9	13%	0.132	25%	0.253	C	S	.	.	H	α-helix	trans	-64.3	-42.7	172	163.4	-107.4	0	0	0	111.8	T213 F214 L215 I219 D220 V221 F224 I232	T213-F217 PolarHBondContact O-N 3.45Å; F214-F217 HydrophobicContact CD2-CD1 4.46Å; F214-F217 HydrophobicContact CE2-CD1 4.45Å; F214-F217 WeakPolarHBondContact O-CB 3.21Å; F214-F217 PolarHBondContact O-N 2.86Å; F214-F217 VanDerWaalsContact O-N 3.08Å; L215-F217 VanDerWaalsContact C-N 3.31Å; L215-F217 PolarHBondContact O-N 3.31Å; F217-I219 VanDerWaalsContact C-N 3.26Å; F217-I219 PolarHBondContact O-N 3.42Å; F217-D220 CarbonylContact O-C 3.52Å; F217-D220 PolarHBondContact O-N 3Å; F217-V221 HydrophobicContact CE1-CG2 4.49Å; F217-V221 HydrophobicContact CE2-CB 4.17Å; F217-V221 HydrophobicContact CE2-CG1 3.85Å; F217-V221 HydrophobicContact CE2-CG2 4.29Å; F217-V221 HydrophobicContact CZ-CB 4.41Å; F217-V221 HydrophobicContact CZ-CG1 3.86Å; F217-V221 HydrophobicContact CZ-CG2 4.22Å; F217-V221 VanDerWaalsContact O-CA 3.27Å; F217-V221 WeakPolarHBondContact O-CA 3.36Å; F217-V221 VanDerWaalsContact O-CG2 3.24Å; F217-V221 WeakPolarHBondContact O-CG2 3.13Å; F217-V221 PolarHBondContact O-N 3.2Å; F217-F224 HydrophobicContact CB-CD2 4.42Å; F217-F224 HydrophobicContact CB-CE2 4.46Å; F217-F224 HydrophobicContact CD2-CB 4.23Å; F217-F224 AromaticContact CD2-CD2 3.86Å; F217-F224 HydrophobicContact CD2-CD2 3.86Å; F217-F224 HydrophobicContact CD2-CG 4.37Å; F217-I232 HydrophobicContact CB-CD1 4.15Å; F217-I232 HydrophobicContact CB-CG1 4.11Å; F217-I232 HydrophobicContact CB-CG2 4.24Å; F217-I232 HydrophobicContact CD1-CD1 4.47Å; F217-I232 HydrophobicContact CD1-CG2 3.64Å; F217-I232 HydrophobicContact CD2-CD1 3.24Å; F217-I232 HydrophobicContact CD2-CG1 4.09Å; F217-I232 HydrophobicContact CD2-CG2 4.4Å; F217-I232 HydrophobicContact CE1-CG2 4.04Å; F217-I232 HydrophobicContact CE2-CD1 3.65Å; F217-I232 HydrophobicContact CG-CD1 3.7Å; F217-I232 HydrophobicContact CG-CG1 4.04Å; F217-I232 HydrophobicContact CG-CG2 3.82Å; F217-I232 HydrophobicContact CZ-CD1 4.41Å
218	L	85.3	Confident	86.2	Confident	92 Å²	92	50.5 Å²	50.5	48%	0.482	25%	0.25	S	S	.	.	H	α-helix	trans	-63.2	-30.4	177.4	-63.6	-176.7	0	0	0	113.1	F214 L215	F214-L218 HydrophobicContact CD1-CD1 4.3Å; F214-L218 HydrophobicContact CE1-CD1 3.75Å; F214-L218 HydrophobicContact CE1-CG 4.33Å; F214-L218 HydrophobicContact CE2-CD2 4.27Å; F214-L218 HydrophobicContact CE2-CG 4.42Å; F214-L218 HydrophobicContact CZ-CD1 3.95Å; F214-L218 HydrophobicContact CZ-CD2 4.12Å; F214-L218 HydrophobicContact CZ-CG 4.19Å; F214-L218 PolarHBondContact O-N 3.31Å; L215-L218 HydrophobicContact CD2-CD1 4.43Å; L215-L218 PolarHBondContact O-N 3.46Å
219	I	85.8	Confident	85.8	Confident	51 Å²	51	52.3 Å²	52.3	26%	0.262	24%	0.244	S	C	.	.	H	α-helix	trans	-70.8	-39.1	175.5	-68.3	166.7	0	0	0	111.9	L215 T216 F217 E498 W499 F502	L215-I219 WeakPolarHBondContact O-CG1 3.25Å; L215-I219 PolarHBondContact O-N 3.05Å; L215-I219 VanDerWaalsContact O-N 3.07Å; T216-I219 PolarHBondContact O-N 3.16Å; F217-I219 VanDerWaalsContact C-N 3.26Å; F217-I219 PolarHBondContact O-N 3.42Å; I219-E498 HydrophobicContact CG2-CB 4.17Å; I219-W499 HydrophobicContact CD1-CD2 3.68Å; I219-W499 HydrophobicContact CD1-CE3 3.79Å; I219-W499 HydrophobicContact CD1-CG 4.37Å; I219-W499 HydrophobicContact CD1-CH2 3.93Å; I219-W499 HydrophobicContact CD1-CZ2 3.78Å; I219-W499 HydrophobicContact CD1-CZ3 3.92Å; I219-F502 HydrophobicContact CD1-CD1 4.35Å; I219-F502 HydrophobicContact CD1-CG 4.25Å; I219-F502 HydrophobicContact CG1-CD2 4.38Å
220	D	81.3	Confident	85.7	Confident	26 Å²	26	51.6 Å²	51.6	14%	0.139	24%	0.238	C	C	.	.			trans	-134.2	65	-178.4	-171.3	5.4	0	0	0	112.1	T216 F217 K222 R223 K494	T216-D220 PolarHBondContact O-N 2.61Å; F217-D220 CarbonylContact O-C 3.52Å; F217-D220 PolarHBondContact O-N 3Å; D220-K222 PolarHBondContact O-N 2.89Å; D220-K222 VanDerWaalsContact O-N 3.09Å; D220-R223 HydrophobicContact CB-CB 4.29Å; D220-R223 VanDerWaalsContact CG-CB 3.5Å; D220-R223 VanDerWaalsContact O-CB 3.32Å; D220-R223 WeakPolarHBondContact O-CB 3.42Å; D220-R223 PolarHBondContact O-N 3.04Å; D220-R223 VanDerWaalsContact O-N 3.12Å; D220-R223 PolarHBondContact OD1-N 3.33Å; D220-R223 WeakPolarHBondContact OD2-CB 3.33Å; D220-R223 WeakPolarHBondContact OD2-CD 3.27Å; D220-K494 WeakPolarHBondContact OD2-CE 3.49Å; D220-K494 IonicContact OD2-NZ 2.85Å; D220-K494 PolarHBondContact OD2-NZ 2.88Å
221	V	81.6	Confident	85.5	Confident	77 Å²	77	51.7 Å²	51.7	47%	0.467	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-29.5	-178.8	174.9	0	0	0	0	112.3	F217 R223	F217-V221 HydrophobicContact CE1-CG2 4.49Å; F217-V221 HydrophobicContact CE2-CB 4.17Å; F217-V221 HydrophobicContact CE2-CG1 3.85Å; F217-V221 HydrophobicContact CE2-CG2 4.29Å; F217-V221 HydrophobicContact CZ-CB 4.41Å; F217-V221 HydrophobicContact CZ-CG1 3.86Å; F217-V221 HydrophobicContact CZ-CG2 4.22Å; F217-V221 VanDerWaalsContact O-CA 3.27Å; F217-V221 WeakPolarHBondContact O-CA 3.36Å; F217-V221 VanDerWaalsContact O-CG2 3.24Å; F217-V221 WeakPolarHBondContact O-CG2 3.13Å; F217-V221 PolarHBondContact O-N 3.2Å; V221-R223 VanDerWaalsContact C-N 3.31Å; V221-R223 PolarHBondContact O-N 3.23Å
222	K	78.6	Confident	85.4	Confident	187 Å²	187	48.3 Å²	48.3	81%	0.813	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.7	-16.6	-176.1	-67.2	-176.8	179.5	179.5	0	113.7	D220	D220-K222 PolarHBondContact O-N 2.89Å; D220-K222 VanDerWaalsContact O-N 3.09Å
223	R	77.7	Confident	85.5	Confident	58 Å²	58	46.8 Å²	46.8	22%	0.219	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-36.4	-179.2	173.6	177.6	174.8	179.8	-1.2	113.7	D220 V221 R225 S492 T495	D220-R223 HydrophobicContact CB-CB 4.29Å; D220-R223 VanDerWaalsContact CG-CB 3.5Å; D220-R223 VanDerWaalsContact O-CB 3.32Å; D220-R223 WeakPolarHBondContact O-CB 3.42Å; D220-R223 PolarHBondContact O-N 3.04Å; D220-R223 VanDerWaalsContact O-N 3.12Å; D220-R223 PolarHBondContact OD1-N 3.33Å; D220-R223 WeakPolarHBondContact OD2-CB 3.33Å; D220-R223 WeakPolarHBondContact OD2-CD 3.27Å; V221-R223 VanDerWaalsContact C-N 3.31Å; V221-R223 PolarHBondContact O-N 3.23Å; R223-R225 PolarHBondContact O-N 3.41Å; R223-S492 PolarHBondContact NH2-OG 3.01Å; R223-T495 PolarHBondContact NH1-OG1 3.4Å; R223-T495 PolarHBondContact NH2-OG1 3.38Å
224	F	77.9	Confident	85.5	Confident	7 Å²	7	47 Å²	47	3%	0.031	22%	0.215	C	C	.	.			trans	-103.6	76.2	-166.1	-59.9	-85.5	0	0	0	112.1	F217 E228 I232 V490	F217-F224 HydrophobicContact CB-CD2 4.42Å; F217-F224 HydrophobicContact CB-CE2 4.46Å; F217-F224 HydrophobicContact CD2-CB 4.23Å; F217-F224 AromaticContact CD2-CD2 3.86Å; F217-F224 HydrophobicContact CD2-CD2 3.86Å; F217-F224 HydrophobicContact CD2-CG 4.37Å; F224-E228 HydrophobicContact CD1-CB 4.46Å; F224-E228 WeakPolarHBondContact CD1-OE2 3.49Å; F224-I232 HydrophobicContact CB-CD1 3.39Å; F224-I232 HydrophobicContact CD1-CD1 4.35Å; F224-I232 HydrophobicContact CD2-CD1 4.32Å; F224-I232 HydrophobicContact CG-CD1 3.8Å; F224-V490 HydrophobicContact CE1-CG2 4.36Å; F224-V490 HydrophobicContact CZ-CG2 4.29Å
225	R	81.4	Confident	85.7	Confident	147 Å²	147	43.9 Å²	43.9	56%	0.555	20%	0.201	S	C	*	.			trans	-80.1	171.7	171.2	-65.3	-172.2	-179.2	-174.1	-2.8	111.2	R223 E228 R229	R223-R225 PolarHBondContact O-N 3.41Å; R225-E228 WeakPolarHBondContact O-CA 3.5Å; R225-E228 WeakPolarHBondContact O-CB 3.01Å; R225-E228 PolarHBondContact O-N 2.93Å; R225-R229 PolarHBondContact O-N 3.46Å; R225-R229 VanDerWaalsContact O-N 3.07Å
226	Y	83.1	Confident	86	Confident	2 Å²	2	42.1 Å²	42.1	1%	0.008	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.1	140.3	161.7	-75.5	-80.7	0	0	0	109.7	R229 P230 T302 C313 I316 E317 A320 F323	Y226-R229 HydrophobicContact CD1-CB 4.22Å; Y226-R229 HydrophobicContact CD2-CB 4.31Å; Y226-R229 HydrophobicContact CE1-CB 4.26Å; Y226-R229 HydrophobicContact CE2-CB 4.35Å; Y226-R229 HydrophobicContact CG-CB 4.24Å; Y226-P230 HydrophobicContact CD1-CG 4.4Å; Y226-P230 HydrophobicContact CE1-CG 4.12Å; Y226-T302 HydrophobicContact CD1-CG2 4.41Å; Y226-C313 WeakPolarHBondContact O-CB 3.41Å; Y226-C313 PolarHBondContact O-SG 3.38Å; Y226-C313 VanDerWaalsContact O-SG 3.4Å; Y226-I316 HydrophobicContact CD1-CG2 3.89Å; Y226-I316 HydrophobicContact CG-CG2 4.03Å; Y226-E317 HydrophobicContact CD2-CB 3.9Å; Y226-E317 HydrophobicContact CD2-CG 3.95Å; Y226-E317 HydrophobicContact CE2-CG 4.4Å; Y226-A320 HydrophobicContact CD2-CB 4.47Å; Y226-A320 HydrophobicContact CE2-CB 3.51Å; Y226-F323 HydrophobicContact CE1-CD2 4.03Å
227	P	82.2	Confident	86.4	Confident	7 Å²	7	41.9 Å²	41.9	5%	0.045	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	cis	-87.8	3.4	6.1	35.7	-37.3	0	0	0	116.3	P230 I316 F409 I413	P227-P230 WeakPolarHBondContact O-CD 3.4Å; P227-I316 HydrophobicContact CB-CD1 4.47Å; P227-F409 HydrophobicContact CG-CE1 4.11Å; P227-F409 HydrophobicContact CG-CZ 4.38Å; P227-I413 HydrophobicContact CB-CD1 4.45Å; P227-I413 HydrophobicContact CG-CD1 3.77Å
228	E	83.4	Confident	86.9	Confident	32 Å²	32	40.7 Å²	40.7	15%	0.15	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-31.2	178.5	-55.2	-170.4	-140.9	0	0	113.3	F224 R225 P230 I231 F409 W489	F224-E228 HydrophobicContact CD1-CB 4.46Å; F224-E228 WeakPolarHBondContact CD1-OE2 3.49Å; R225-E228 WeakPolarHBondContact O-CA 3.5Å; R225-E228 WeakPolarHBondContact O-CB 3.01Å; R225-E228 PolarHBondContact O-N 2.93Å; E228-P230 VanDerWaalsContact C-N 3.35Å; E228-P230 WeakPolarHBondContact O-CD 3.29Å; E228-P230 VanDerWaalsContact O-N 3.12Å; E228-I231 VanDerWaalsContact O-CB 3.31Å; E228-I231 WeakPolarHBondContact O-CB 3.34Å; E228-I231 WeakPolarHBondContact O-CG1 3.18Å; E228-I231 PolarHBondContact O-N 3.28Å; E228-F409 HydrophobicContact CG-CE2 3.82Å; E228-F409 HydrophobicContact CG-CZ 3.68Å; E228-F409 WeakPolarHBondContact OE1-CE2 3.46Å; E228-W489 HydrophobicContact CG-CZ2 3.83Å; E228-W489 WeakPolarHBondContact OE2-CZ2 3.44Å; E228-W489 PolarHBondContact OE2-NE1 3.02Å
229	R	88.2	Confident	87.4	Confident	79 Å²	79	37.2 Å²	37.2	30%	0.298	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.6	-36.4	-168.1	-156.4	175.3	174.6	172.1	-4.2	116.2	R225 Y226 I231 I232 F233 E317	R225-R229 PolarHBondContact O-N 3.46Å; R225-R229 VanDerWaalsContact O-N 3.07Å; Y226-R229 HydrophobicContact CD1-CB 4.22Å; Y226-R229 HydrophobicContact CD2-CB 4.31Å; Y226-R229 HydrophobicContact CE1-CB 4.26Å; Y226-R229 HydrophobicContact CE2-CB 4.35Å; Y226-R229 HydrophobicContact CG-CB 4.24Å; R229-I231 PolarHBondContact O-N 3.22Å; R229-I232 PolarHBondContact O-N 2.84Å; R229-I232 VanDerWaalsContact O-N 3.14Å; R229-F233 HydrophobicContact CG-CE2 3.84Å; R229-F233 HydrophobicContact CG-CZ 4.36Å; R229-E317 IonicContact NH1-OE1 3.19Å; R229-E317 PolarHBondContact NH1-OE1 3.43Å
230	P	92.3	Very high	88	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-52.3	-34.8	172.4	-30.2	38.7	0	0	0	114.5	Y226 P227 E228 I232 F233 Y234 W295 I298 L299	Y226-P230 HydrophobicContact CD1-CG 4.4Å; Y226-P230 HydrophobicContact CE1-CG 4.12Å; P227-P230 WeakPolarHBondContact O-CD 3.4Å; E228-P230 VanDerWaalsContact C-N 3.35Å; E228-P230 WeakPolarHBondContact O-CD 3.29Å; E228-P230 VanDerWaalsContact O-N 3.12Å; P230-I232 PolarHBondContact O-N 2.91Å; P230-I232 VanDerWaalsContact O-N 3.14Å; P230-F233 PolarHBondContact O-N 3Å; P230-Y234 WeakPolarHBondContact O-CB 3.35Å; P230-Y234 PolarHBondContact O-N 3.16Å; P230-W295 HydrophobicContact CB-CE3 3.93Å; P230-W295 HydrophobicContact CB-CZ3 4.35Å; P230-W295 HydrophobicContact CG-CE3 4.5Å; P230-W295 HydrophobicContact CG-CZ3 4.48Å; P230-I298 HydrophobicContact CB-CG2 4.43Å; P230-I298 HydrophobicContact CG-CG2 3.99Å; P230-L299 HydrophobicContact CB-CB 4.19Å; P230-L299 HydrophobicContact CB-CD1 4.28Å
231	I	90.1	Very high	88.7	Confident	2 Å²	2	37.3 Å²	37.3	1%	0.01	17%	0.167	C	C	.	.	H	α-helix	trans	-60.3	-27.1	-178.7	-58.4	173.7	0	0	0	111.6	E228 R229 Y234 A235 L299 F416 W489	E228-I231 VanDerWaalsContact O-CB 3.31Å; E228-I231 WeakPolarHBondContact O-CB 3.34Å; E228-I231 WeakPolarHBondContact O-CG1 3.18Å; E228-I231 PolarHBondContact O-N 3.28Å; R229-I231 PolarHBondContact O-N 3.22Å; I231-Y234 WeakPolarHBondContact O-CD1 3.38Å; I231-A235 WeakPolarHBondContact O-CB 3.46Å; I231-A235 PolarHBondContact O-N 3.12Å; I231-L299 HydrophobicContact CD1-CD1 4.3Å; I231-L299 HydrophobicContact CD1-CD2 4.34Å; I231-L299 HydrophobicContact CG1-CD1 3.96Å; I231-L299 HydrophobicContact CG1-CD2 3.83Å; I231-F416 HydrophobicContact CD1-CD1 4.19Å; I231-F416 HydrophobicContact CD1-CE1 4.05Å; I231-F416 HydrophobicContact CD1-CZ 4.5Å; I231-F416 HydrophobicContact CG1-CE1 4Å; I231-F416 HydrophobicContact CG1-CZ 4.48Å; I231-F416 HydrophobicContact CG2-CE1 4.35Å; I231-F416 HydrophobicContact CG2-CZ 4Å; I231-W489 HydrophobicContact CD1-CD2 3.58Å; I231-W489 HydrophobicContact CD1-CE3 4.01Å; I231-W489 HydrophobicContact CD1-CG 3.77Å; I231-W489 HydrophobicContact CD1-CZ2 4.45Å; I231-W489 HydrophobicContact CG2-CB 4.26Å; I231-W489 HydrophobicContact CG2-CG 4.21Å
232	I	90.4	Very high	89.5	Confident	8 Å²	8	33.7 Å²	33.7	4%	0.041	15%	0.145	C	C	.	.	H	α-helix	trans	-77.6	-48.3	178.2	-65.1	152.1	0	0	0	111.4	F214 F217 F224 R229 P230 Y234 A235 V236	F214-I232 HydrophobicContact CD2-CG2 4.5Å; F217-I232 HydrophobicContact CB-CD1 4.15Å; F217-I232 HydrophobicContact CB-CG1 4.11Å; F217-I232 HydrophobicContact CB-CG2 4.24Å; F217-I232 HydrophobicContact CD1-CD1 4.47Å; F217-I232 HydrophobicContact CD1-CG2 3.64Å; F217-I232 HydrophobicContact CD2-CD1 3.24Å; F217-I232 HydrophobicContact CD2-CG1 4.09Å; F217-I232 HydrophobicContact CD2-CG2 4.4Å; F217-I232 HydrophobicContact CE1-CG2 4.04Å; F217-I232 HydrophobicContact CE2-CD1 3.65Å; F217-I232 HydrophobicContact CG-CD1 3.7Å; F217-I232 HydrophobicContact CG-CG1 4.04Å; F217-I232 HydrophobicContact CG-CG2 3.82Å; F217-I232 HydrophobicContact CZ-CD1 4.41Å; F224-I232 HydrophobicContact CB-CD1 3.39Å; F224-I232 HydrophobicContact CD1-CD1 4.35Å; F224-I232 HydrophobicContact CD2-CD1 4.32Å; F224-I232 HydrophobicContact CG-CD1 3.8Å; R229-I232 PolarHBondContact O-N 2.84Å; R229-I232 VanDerWaalsContact O-N 3.14Å; P230-I232 PolarHBondContact O-N 2.91Å; P230-I232 VanDerWaalsContact O-N 3.14Å; I232-Y234 VanDerWaalsContact C-N 3.28Å; I232-Y234 PolarHBondContact O-N 3.45Å; I232-A235 PolarHBondContact O-N 2.85Å; I232-A235 VanDerWaalsContact O-N 3.13Å; I232-V236 WeakPolarHBondContact O-CG2 3.44Å; I232-V236 PolarHBondContact O-N 3.21Å
233	F	93.3	Very high	90.4	Very high	40 Å²	40	27.8 Å²	27.8	18%	0.175	12%	0.122	C	C	.	.	H	α-helix	trans	-65.1	-38.9	178.4	-57.4	-60.3	0	0	0	111	R229 P230 V236 C237 W295 H324 W328	R229-F233 HydrophobicContact CG-CE2 3.84Å; R229-F233 HydrophobicContact CG-CZ 4.36Å; P230-F233 PolarHBondContact O-N 3Å; F233-V236 PolarHBondContact O-N 3.13Å; F233-C237 PolarHBondContact O-N 2.96Å; F233-C237 PolarHBondContact O-SG 2.7Å; F233-W295 HydrophobicContact CB-CD2 3.73Å; F233-W295 HydrophobicContact CB-CE3 4.28Å; F233-W295 HydrophobicContact CB-CG 4.15Å; F233-W295 HydrophobicContact CB-CH2 4.3Å; F233-W295 HydrophobicContact CB-CZ2 3.72Å; F233-W295 HydrophobicContact CD2-CE3 4.29Å; F233-W295 AromaticContact CD2-CH2 3.54Å; F233-W295 HydrophobicContact CD2-CH2 3.54Å; F233-W295 AromaticContact CD2-CZ2 3.76Å; F233-W295 HydrophobicContact CD2-CZ2 3.76Å; F233-W295 AromaticContact CD2-CZ3 3.82Å; F233-W295 HydrophobicContact CD2-CZ3 3.82Å; F233-W295 HydrophobicContact CE2-CH2 4.14Å; F233-W295 HydrophobicContact CG-CH2 4.09Å; F233-W295 AromaticContact CG-CZ2 3.79Å; F233-W295 HydrophobicContact CG-CZ2 3.79Å; F233-H324 AromaticContact CD2-CE1 3.8Å; F233-H324 AromaticContact CE1-CE1 3.82Å; F233-H324 AromaticContact CE2-CE1 3.32Å; F233-H324 WeakPolarHBondContact CE2-CE1 3.49Å; F233-H324 AromaticContact CE2-NE2 3.61Å; F233-H324 AromaticContact CZ-CE1 3.35Å; F233-H324 WeakPolarHBondContact CZ-CE1 3.19Å; F233-H324 AromaticContact CZ-NE2 3.68Å; F233-W328 HydrophobicContact CB-CH2 4.42Å; F233-W328 HydrophobicContact CB-CZ2 4.35Å; F233-W328 HydrophobicContact CD1-CZ2 4.4Å
234	Y	91.3	Very high	91.4	Very high	6 Å²	6	25.3 Å²	25.3	2%	0.024	11%	0.113	C	C	.	.	H	α-helix	trans	-51.4	-54	165.9	162.5	-98.9	0	0	0	112.4	P230 I231 I232 V236 C237 Y238 Y420 V482 G483 A486	P230-Y234 WeakPolarHBondContact O-CB 3.35Å; P230-Y234 PolarHBondContact O-N 3.16Å; I231-Y234 WeakPolarHBondContact O-CD1 3.38Å; I232-Y234 VanDerWaalsContact C-N 3.28Å; I232-Y234 PolarHBondContact O-N 3.45Å; Y234-V236 VanDerWaalsContact C-N 3.32Å; Y234-V236 PolarHBondContact O-N 3.23Å; Y234-C237 WeakPolarHBondContact O-CB 3.35Å; Y234-C237 PolarHBondContact O-N 2.91Å; Y234-C237 VanDerWaalsContact O-N 3.12Å; Y234-Y238 AromaticContact CD2-CD2 3.92Å; Y234-Y238 HydrophobicContact CD2-CD2 3.92Å; Y234-Y238 HydrophobicContact CD2-CE2 4.01Å; Y234-Y238 AromaticContact CE2-CD2 3.14Å; Y234-Y238 HydrophobicContact CE2-CD2 3.14Å; Y234-Y238 AromaticContact CE2-CE2 3.28Å; Y234-Y238 HydrophobicContact CE2-CE2 3.28Å; Y234-Y238 HydrophobicContact CE2-CG 4.09Å; Y234-Y238 AromaticContact CZ-CD2 3.63Å; Y234-Y238 PolarHBondContact O-N 2.84Å; Y234-Y238 VanDerWaalsContact O-N 3.17Å; Y234-Y420 AromaticContact CD2-CE2 3.94Å; Y234-Y420 HydrophobicContact CD2-CE2 3.94Å; Y234-Y420 HydrophobicContact CE1-CE2 4.27Å; Y234-Y420 HydrophobicContact CE2-CD2 4.49Å; Y234-Y420 AromaticContact CE2-CE2 3.3Å; Y234-Y420 HydrophobicContact CE2-CE2 3.3Å; Y234-Y420 AromaticContact CE2-CZ 3.66Å; Y234-Y420 WeakPolarHBondContact CE2-OH 3.32Å; Y234-Y420 AromaticContact CZ-CE2 3.55Å; Y234-V482 HydrophobicContact CE2-CG1 3.95Å; Y234-V482 WeakPolarHBondContact OH-CG1 3.45Å; Y234-V482 PolarHBondContact OH-O 3.23Å; Y234-G483 WeakPolarHBondContact OH-CA 3.25Å; Y234-G483 PolarHBondContact OH-N 2.89Å; Y234-A486 HydrophobicContact CE1-CB 4.16Å
235	A	92.9	Very high	92.4	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-65	-33.9	-179.9	0	0	0	0	0	112.9	T213 I231 I232 Y238 S239 A486	T213-A235 HydrophobicContact CG2-CB 3.83Å; I231-A235 WeakPolarHBondContact O-CB 3.46Å; I231-A235 PolarHBondContact O-N 3.12Å; I232-A235 PolarHBondContact O-N 2.85Å; I232-A235 VanDerWaalsContact O-N 3.13Å; A235-Y238 PolarHBondContact O-N 2.79Å; A235-S239 PolarHBondContact O-N 3.01Å; A235-A486 HydrophobicContact CB-CB 4.11Å
236	V	94.4	Very high	93.2	Very high	29 Å²	29	21 Å²	21	18%	0.176	10%	0.098	C	C	.	.	H	α-helix	trans	-61.3	-45.3	171.5	170.6	0	0	0	0	110.7	F214 I232 F233 Y234 Y238 S239 F240	F214-V236 HydrophobicContact CD2-CG2 3.43Å; F214-V236 VanDerWaalsContact CD2-CG2 3.43Å; F214-V236 HydrophobicContact CE2-CG2 3.67Å; F214-V236 HydrophobicContact CG-CG2 4.14Å; I232-V236 WeakPolarHBondContact O-CG2 3.44Å; I232-V236 PolarHBondContact O-N 3.21Å; F233-V236 PolarHBondContact O-N 3.13Å; Y234-V236 VanDerWaalsContact C-N 3.32Å; Y234-V236 PolarHBondContact O-N 3.23Å; V236-Y238 VanDerWaalsContact C-N 3.35Å; V236-Y238 PolarHBondContact O-N 3.13Å; V236-S239 PolarHBondContact O-N 3.27Å; V236-S239 PolarHBondContact O-OG 3.21Å; V236-F240 HydrophobicContact CG1-CD2 4.13Å; V236-F240 HydrophobicContact CG1-CE2 3.99Å; V236-F240 WeakPolarHBondContact O-CD2 3.42Å; V236-F240 PolarHBondContact O-N 2.76Å
237	C	96.9	Very high	93.8	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-56.3	-48.3	176.7	-62.8	0	0	0	0	111.4	F233 Y234 S239 F240 V241 F288	F233-C237 PolarHBondContact O-N 2.96Å; F233-C237 PolarHBondContact O-SG 2.7Å; Y234-C237 WeakPolarHBondContact O-CB 3.35Å; Y234-C237 PolarHBondContact O-N 2.91Å; Y234-C237 VanDerWaalsContact O-N 3.12Å; C237-S239 VanDerWaalsContact C-N 3.34Å; C237-S239 PolarHBondContact O-N 2.93Å; C237-F240 PolarHBondContact O-N 2.87Å; C237-F240 VanDerWaalsContact O-N 3.13Å; C237-V241 WeakPolarHBondContact O-CG2 3.43Å; C237-V241 PolarHBondContact O-N 3.17Å; C237-F288 HydrophobicContact CB-CB 4.32Å; C237-F288 HydrophobicContact CB-CD1 4.18Å; C237-F288 WeakPolarHBondContact CB-O 3.27Å
238	Y	96.1	Very high	94.5	Very high	4 Å²	4	23.5 Å²	23.5	2%	0.016	11%	0.112	C	C	.	.	H	α-helix	trans	-75	-19.6	-179.5	-77.9	-94	0	0	0	114.3	Y234 A235 V236 V241 S242 T479 V482	Y234-Y238 AromaticContact CD2-CD2 3.92Å; Y234-Y238 HydrophobicContact CD2-CD2 3.92Å; Y234-Y238 HydrophobicContact CD2-CE2 4.01Å; Y234-Y238 AromaticContact CE2-CD2 3.14Å; Y234-Y238 HydrophobicContact CE2-CD2 3.14Å; Y234-Y238 AromaticContact CE2-CE2 3.28Å; Y234-Y238 HydrophobicContact CE2-CE2 3.28Å; Y234-Y238 HydrophobicContact CE2-CG 4.09Å; Y234-Y238 AromaticContact CZ-CD2 3.63Å; Y234-Y238 PolarHBondContact O-N 2.84Å; Y234-Y238 VanDerWaalsContact O-N 3.17Å; A235-Y238 PolarHBondContact O-N 2.79Å; V236-Y238 VanDerWaalsContact C-N 3.35Å; V236-Y238 PolarHBondContact O-N 3.13Å; Y238-V241 HydrophobicContact CD1-CB 4.32Å; Y238-V241 HydrophobicContact CD1-CG1 4.38Å; Y238-S242 WeakPolarHBondContact O-CB 3.38Å; Y238-S242 PolarHBondContact O-N 3.12Å; Y238-S242 PolarHBondContact O-OG 3.34Å; Y238-T479 WeakPolarHBondContact CD1-O 3.14Å; Y238-T479 WeakPolarHBondContact CE1-O 3.41Å; Y238-V482 HydrophobicContact CD1-CB 4.46Å; Y238-V482 HydrophobicContact CD1-CG1 3.82Å; Y238-V482 HydrophobicContact CD2-CG1 4.18Å; Y238-V482 HydrophobicContact CE1-CB 4.1Å; Y238-V482 HydrophobicContact CE1-CG1 3.42Å; Y238-V482 VanDerWaalsContact CE1-CG1 3.42Å; Y238-V482 HydrophobicContact CE2-CG1 3.8Å; Y238-V482 HydrophobicContact CG-CG1 4.18Å; Y238-V482 VanDerWaalsContact CZ-CG1 3.4Å
239	S	96.1	Very high	95.1	Very high	20 Å²	20	26 Å²	26	14%	0.14	12%	0.122	C	C	.	.	H	α-helix	trans	-65.2	-38	165.6	77.2	0	0	0	0	111.9	L207 T210 A235 V236 C237 S242 L243	L207-S239 WeakPolarHBondContact CD1-O 3.32Å; T210-S239 VanDerWaalsContact OG1-CA 3.32Å; T210-S239 WeakPolarHBondContact OG1-CA 3.37Å; T210-S239 WeakPolarHBondContact OG1-CB 3.25Å; A235-S239 PolarHBondContact O-N 3.01Å; V236-S239 PolarHBondContact O-N 3.27Å; V236-S239 PolarHBondContact O-OG 3.21Å; C237-S239 VanDerWaalsContact C-N 3.34Å; C237-S239 PolarHBondContact O-N 2.93Å; S239-S242 PolarHBondContact O-OG 3Å; S239-L243 VanDerWaalsContact O-CB 3.22Å; S239-L243 WeakPolarHBondContact O-CB 3.47Å; S239-L243 PolarHBondContact O-N 3.23Å
240	F	97.6	Very high	95.4	Very high	79 Å²	79	27.3 Å²	27.3	35%	0.346	13%	0.134	S	C	.	.	H	α-helix	trans	-72.5	-44	172.5	-79.3	-77	0	0	0	112.6	V236 C237 S242 L243 I244 F288	V236-F240 HydrophobicContact CG1-CD2 4.13Å; V236-F240 HydrophobicContact CG1-CE2 3.99Å; V236-F240 WeakPolarHBondContact O-CD2 3.42Å; V236-F240 PolarHBondContact O-N 2.76Å; C237-F240 PolarHBondContact O-N 2.87Å; C237-F240 VanDerWaalsContact O-N 3.13Å; F240-S242 VanDerWaalsContact C-N 3.32Å; F240-S242 PolarHBondContact O-N 3.38Å; F240-L243 PolarHBondContact O-N 2.91Å; F240-I244 WeakPolarHBondContact O-CG1 3.2Å; F240-I244 PolarHBondContact O-N 3.44Å; F240-F288 HydrophobicContact CB-CB 4.2Å; F240-F288 HydrophobicContact CB-CD1 4.28Å; F240-F288 HydrophobicContact CB-CD2 3.31Å; F240-F288 HydrophobicContact CB-CE2 3.63Å; F240-F288 HydrophobicContact CB-CG 3.68Å; F240-F288 HydrophobicContact CB-CZ 4.24Å; F240-F288 HydrophobicContact CD1-CD2 4.3Å; F240-F288 AromaticContact CD1-CE2 3.77Å; F240-F288 HydrophobicContact CD1-CE2 3.77Å; F240-F288 HydrophobicContact CD1-CZ 4.26Å; F240-F288 HydrophobicContact CD2-CD1 4.23Å; F240-F288 HydrophobicContact CD2-CD2 4.17Å; F240-F288 AromaticContact CD2-CE1 3.77Å; F240-F288 HydrophobicContact CD2-CE1 3.77Å; F240-F288 AromaticContact CD2-CE2 3.71Å; F240-F288 HydrophobicContact CD2-CE2 3.71Å; F240-F288 HydrophobicContact CD2-CG 4.42Å; F240-F288 AromaticContact CD2-CZ 3.49Å; F240-F288 HydrophobicContact CD2-CZ 3.49Å; F240-F288 VanDerWaalsContact CD2-CZ 3.49Å; F240-F288 HydrophobicContact CE1-CE2 4.34Å; F240-F288 HydrophobicContact CE2-CE1 4.27Å; F240-F288 HydrophobicContact CE2-CE2 4.29Å; F240-F288 AromaticContact CE2-CZ 3.82Å; F240-F288 HydrophobicContact CE2-CZ 3.82Å; F240-F288 AromaticContact CG-CD2 3.7Å; F240-F288 HydrophobicContact CG-CD2 3.7Å; F240-F288 HydrophobicContact CG-CE1 4.28Å; F240-F288 AromaticContact CG-CE2 3.42Å; F240-F288 HydrophobicContact CG-CE2 3.42Å; F240-F288 VanDerWaalsContact CG-CE2 3.42Å; F240-F288 HydrophobicContact CG-CG 4.25Å; F240-F288 AromaticContact CG-CZ 3.75Å; F240-F288 HydrophobicContact CG-CZ 3.75Å; F240-F288 HydrophobicContact CZ-CZ 4.33Å
241	V	97.8	Very high	95.5	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-55.9	-48	176.4	171	0	0	0	0	111	C237 Y238 I244 Y245 L285 F288 T479	C237-V241 WeakPolarHBondContact O-CG2 3.43Å; C237-V241 PolarHBondContact O-N 3.17Å; Y238-V241 HydrophobicContact CD1-CB 4.32Å; Y238-V241 HydrophobicContact CD1-CG1 4.38Å; V241-I244 PolarHBondContact O-N 3.19Å; V241-Y245 HydrophobicContact CG1-CD2 3.92Å; V241-Y245 HydrophobicContact CG1-CE2 3.76Å; V241-Y245 VanDerWaalsContact O-CD2 3.28Å; V241-Y245 WeakPolarHBondContact O-CD2 3.48Å; V241-Y245 PolarHBondContact O-N 3.11Å; V241-Y245 VanDerWaalsContact O-N 3.11Å; V241-L285 HydrophobicContact CB-CD1 4.33Å; V241-L285 HydrophobicContact CG1-CD1 3.84Å; V241-L285 HydrophobicContact CG2-CD1 4.34Å; V241-F288 HydrophobicContact CG2-CB 3.94Å; V241-T479 HydrophobicContact CG1-CG2 4.21Å
242	S	97.9	Very high	95.5	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-69	-36.4	177.9	55.4	0	0	0	0	113.5	S203 C206 L207 Y238 S239 F240 I244 Y245 F246	S203-S242 WeakPolarHBondContact CB-O 3.16Å; C206-S242 VanDerWaalsContact SG-CB 3.59Å; L207-S242 WeakPolarHBondContact CA-OG 3.38Å; L207-S242 PolarHBondContact N-OG 2.91Å; Y238-S242 WeakPolarHBondContact O-CB 3.38Å; Y238-S242 PolarHBondContact O-N 3.12Å; Y238-S242 PolarHBondContact O-OG 3.34Å; S239-S242 PolarHBondContact O-OG 3Å; F240-S242 VanDerWaalsContact C-N 3.32Å; F240-S242 PolarHBondContact O-N 3.38Å; S242-I244 PolarHBondContact O-N 3.2Å; S242-Y245 PolarHBondContact O-N 3.03Å; S242-F246 WeakPolarHBondContact O-CB 3.19Å; S242-F246 PolarHBondContact O-N 3.47Å
243	L	97.9	Very high	95.6	Very high	64 Å²	64	32.8 Å²	32.8	34%	0.335	17%	0.168	S	C	.	.	H	α-helix	trans	-61.3	-40.6	171.1	178.1	61.6	0	0	0	112.3	L207 S239 F240 F246 L247	L207-L243 HydrophobicContact CD1-CB 4.26Å; L207-L243 HydrophobicContact CD2-CD1 4.31Å; S239-L243 VanDerWaalsContact O-CB 3.22Å; S239-L243 WeakPolarHBondContact O-CB 3.47Å; S239-L243 PolarHBondContact O-N 3.23Å; F240-L243 PolarHBondContact O-N 2.91Å; L243-F246 PolarHBondContact O-N 3.14Å; L243-L247 HydrophobicContact CD1-CD1 4.3Å; L243-L247 HydrophobicContact CD1-CG 4.34Å; L243-L247 HydrophobicContact CG-CD1 4.12Å; L243-L247 WeakPolarHBondContact O-CB 3.15Å; L243-L247 VanDerWaalsContact O-CG 3.3Å; L243-L247 WeakPolarHBondContact O-CG 3.2Å; L243-L247 PolarHBondContact O-N 3.09Å
244	I	98.2	Very high	95.5	Very high	6 Å²	6	36.9 Å²	36.9	3%	0.031	19%	0.191	C	C	.	.	H	α-helix	trans	-68.6	-42.6	179.3	-64.9	-67.8	0	0	0	111.3	F240 V241 S242 F246 L247 G248 L281 L284 L285 V352	F240-I244 WeakPolarHBondContact O-CG1 3.2Å; F240-I244 PolarHBondContact O-N 3.44Å; V241-I244 PolarHBondContact O-N 3.19Å; S242-I244 PolarHBondContact O-N 3.2Å; I244-F246 VanDerWaalsContact C-N 3.33Å; I244-F246 PolarHBondContact O-N 3.22Å; I244-L247 HydrophobicContact CD1-CD1 4.4Å; I244-L247 PolarHBondContact O-N 3.4Å; I244-G248 PolarHBondContact O-N 3.05Å; I244-L281 HydrophobicContact CD1-CD2 3.98Å; I244-L281 HydrophobicContact CG2-CB 4.27Å; I244-L281 HydrophobicContact CG2-CD2 4.16Å; I244-L284 HydrophobicContact CD1-CB 3.88Å; I244-L284 HydrophobicContact CD1-CD1 3.82Å; I244-L284 HydrophobicContact CG1-CB 4.09Å; I244-L285 HydrophobicContact CG2-CB 3.94Å; I244-L285 HydrophobicContact CG2-CD2 4.39Å; I244-V352 HydrophobicContact CG2-CB 4.42Å; I244-V352 HydrophobicContact CG2-CG1 4.01Å; I244-V352 WeakPolarHBondContact O-CG1 3.42Å
245	Y	98.3	Very high	95.5	Very high	9 Å²	9	37 Å²	37	4%	0.035	19%	0.194	C	C	.	.	H	α-helix	trans	-63.8	-36.8	172.7	-76.9	-60.8	0	0	0	112.8	I199 V241 S242 G248 F249 L285 V352 Y476 T479 L480	I199-Y245 HydrophobicContact CG2-CD1 4.02Å; I199-Y245 HydrophobicContact CG2-CG 4.26Å; V241-Y245 HydrophobicContact CG1-CD2 3.92Å; V241-Y245 HydrophobicContact CG1-CE2 3.76Å; V241-Y245 VanDerWaalsContact O-CD2 3.28Å; V241-Y245 WeakPolarHBondContact O-CD2 3.48Å; V241-Y245 PolarHBondContact O-N 3.11Å; V241-Y245 VanDerWaalsContact O-N 3.11Å; S242-Y245 PolarHBondContact O-N 3.03Å; Y245-G248 PolarHBondContact O-N 2.86Å; Y245-F249 PolarHBondContact O-N 3.42Å; Y245-L285 HydrophobicContact CD2-CD1 4.25Å; Y245-L285 HydrophobicContact CE1-CD2 4.17Å; Y245-L285 HydrophobicContact CE2-CD1 3.73Å; Y245-V352 HydrophobicContact CD1-CG1 4.48Å; Y245-V352 HydrophobicContact CD1-CG2 4.26Å; Y245-V352 HydrophobicContact CE1-CG2 4Å; Y245-Y476 AromaticContact CE1-CD1 3.98Å; Y245-Y476 HydrophobicContact CE1-CD1 3.98Å; Y245-Y476 HydrophobicContact CE1-CE1 4.09Å; Y245-T479 HydrophobicContact CE2-CG2 4.11Å; Y245-L480 HydrophobicContact CD2-CD2 4.05Å
246	F	97.8	Very high	95.6	Very high	54 Å²	54	37 Å²	37	24%	0.237	19%	0.194	C	C	.	.	H	α-helix	trans	-64.8	-39.8	173.5	178.5	-118.4	0	0	0	112.1	S203 I204 S242 L243 I244 F249 L250	S203-F246 WeakPolarHBondContact OG-CA 3.36Å; S203-F246 WeakPolarHBondContact OG-CB 3.32Å; S203-F246 PolarHBondContact OG-N 2.94Å; I204-F246 HydrophobicContact CD1-CD2 4.06Å; I204-F246 HydrophobicContact CD1-CE2 3.81Å; I204-F246 HydrophobicContact CG1-CD2 3.59Å; I204-F246 HydrophobicContact CG1-CE2 3.72Å; I204-F246 HydrophobicContact CG1-CG 4.47Å; S242-F246 WeakPolarHBondContact O-CB 3.19Å; S242-F246 PolarHBondContact O-N 3.47Å; L243-F246 PolarHBondContact O-N 3.14Å; I244-F246 VanDerWaalsContact C-N 3.33Å; I244-F246 PolarHBondContact O-N 3.22Å; F246-F249 HydrophobicContact CD2-CD1 4.39Å; F246-F249 HydrophobicContact CE2-CD1 4.38Å; F246-F249 WeakPolarHBondContact O-CB 3.28Å; F246-F249 PolarHBondContact O-N 2.77Å; F246-L250 HydrophobicContact CD1-CD1 4.23Å; F246-L250 HydrophobicContact CE1-CD1 3.65Å; F246-L250 HydrophobicContact CE1-CG 4.39Å; F246-L250 HydrophobicContact CE2-CD1 4.31Å; F246-L250 HydrophobicContact CE2-CD2 4.32Å; F246-L250 HydrophobicContact CE2-CG 4.21Å; F246-L250 HydrophobicContact CZ-CD1 3.7Å; F246-L250 HydrophobicContact CZ-CD2 4.25Å; F246-L250 HydrophobicContact CZ-CG 4.09Å; F246-L250 WeakPolarHBondContact O-CG 3.33Å; F246-L250 PolarHBondContact O-N 3.12Å
247	L	96.9	Very high	95.6	Very high	61 Å²	61	36.4 Å²	36.4	32%	0.319	19%	0.191	S	C	.	.	H	α-helix	trans	-65.7	-38.5	173.3	-72.4	168	0	0	0	111.9	L243 I244 F249 L250 I251	L243-L247 HydrophobicContact CD1-CD1 4.3Å; L243-L247 HydrophobicContact CD1-CG 4.34Å; L243-L247 HydrophobicContact CG-CD1 4.12Å; L243-L247 WeakPolarHBondContact O-CB 3.15Å; L243-L247 VanDerWaalsContact O-CG 3.3Å; L243-L247 WeakPolarHBondContact O-CG 3.2Å; L243-L247 PolarHBondContact O-N 3.09Å; I244-L247 HydrophobicContact CD1-CD1 4.4Å; I244-L247 PolarHBondContact O-N 3.4Å; L247-F249 VanDerWaalsContact C-N 3.35Å; L247-F249 PolarHBondContact O-N 3.08Å; L247-L250 PolarHBondContact O-N 3.41Å; L247-I251 HydrophobicContact CB-CD1 4.39Å; L247-I251 WeakPolarHBondContact O-CB 3.36Å; L247-I251 WeakPolarHBondContact O-CD1 3.29Å; L247-I251 WeakPolarHBondContact O-CG1 3.44Å; L247-I251 PolarHBondContact O-N 3.31Å
248	G	95.6	Very high	95.4	Very high	1 Å²	1	39.7 Å²	39.7	1%	0.01	21%	0.211	C	C	.	.	H	α-helix	trans	-58.9	-43.5	171.5	0	0	0	0	0	112.9	I244 Y245 L250 I251 G252	I244-G248 PolarHBondContact O-N 3.05Å; Y245-G248 PolarHBondContact O-N 2.86Å; G248-L250 PolarHBondContact O-N 3.48Å; G248-I251 PolarHBondContact O-N 3.1Å; G248-G252 WeakPolarHBondContact O-CA 3.29Å; G248-G252 PolarHBondContact O-N 2.97Å
249	F	95.9	Very high	95	Very high	84 Å²	84	46.6 Å²	46.6	37%	0.368	24%	0.241	S	C	.	.	H	α-helix	trans	-60.2	-41.8	173.2	170.3	-100.5	0	0	0	112.8	K196 Y245 F246 L247	K196-F249 WeakPolarHBondContact O-CD2 3.46Å; Y245-F249 PolarHBondContact O-N 3.42Å; F246-F249 HydrophobicContact CD2-CD1 4.39Å; F246-F249 HydrophobicContact CE2-CD1 4.38Å; F246-F249 WeakPolarHBondContact O-CB 3.28Å; F246-F249 PolarHBondContact O-N 2.77Å; L247-F249 VanDerWaalsContact C-N 3.35Å; L247-F249 PolarHBondContact O-N 3.08Å
250	L	96.1	Very high	94.5	Very high	107 Å²	107	48 Å²	48	56%	0.56	25%	0.254	S	S	*	.	H	α-helix	trans	-73.3	-32	178	-67.5	179.4	0	0	0	114.1	F246 L247 G248	F246-L250 HydrophobicContact CD1-CD1 4.23Å; F246-L250 HydrophobicContact CE1-CD1 3.65Å; F246-L250 HydrophobicContact CE1-CG 4.39Å; F246-L250 HydrophobicContact CE2-CD1 4.31Å; F246-L250 HydrophobicContact CE2-CD2 4.32Å; F246-L250 HydrophobicContact CE2-CG 4.21Å; F246-L250 HydrophobicContact CZ-CD1 3.7Å; F246-L250 HydrophobicContact CZ-CD2 4.25Å; F246-L250 HydrophobicContact CZ-CG 4.09Å; F246-L250 WeakPolarHBondContact O-CG 3.33Å; F246-L250 PolarHBondContact O-N 3.12Å; L247-L250 PolarHBondContact O-N 3.41Å; G248-L250 PolarHBondContact O-N 3.48Å
251	I	93.8	Very high	93.3	Very high	66 Å²	66	49.2 Å²	49.2	34%	0.338	26%	0.264	S	S	.	.	H	α-helix	trans	-86.7	-25.8	-177.8	-66.6	165.6	0	0	0	111.4	L247 G248 N254 A255	L247-I251 HydrophobicContact CB-CD1 4.39Å; L247-I251 WeakPolarHBondContact O-CB 3.36Å; L247-I251 WeakPolarHBondContact O-CD1 3.29Å; L247-I251 WeakPolarHBondContact O-CG1 3.44Å; L247-I251 PolarHBondContact O-N 3.31Å; G248-I251 PolarHBondContact O-N 3.1Å; I251-N254 HydrophobicContact CG2-CB 3.94Å; I251-N254 PolarHBondContact O-ND2 3.21Å; I251-A255 HydrophobicContact CG2-CB 3.92Å
252	G	90.9	Very high	92.2	Very high	20 Å²	20	53 Å²	53	21%	0.206	28%	0.282	C	S	.	.	G	3₁₀ helix	trans	62.7	-150.6	-171.9	0	0	0	0	0	111.9	G248 N254	G248-G252 WeakPolarHBondContact O-CA 3.29Å; G248-G252 PolarHBondContact O-N 2.97Å; G252-N254 PolarHBondContact O-N 3.19Å; G252-N254 VanDerWaalsContact O-N 3.11Å
253	N	91.1	Very high	90.8	Very high	39 Å²	39	62.4 Å²	62.4	21%	0.209	33%	0.325	C	S	.	.	G	3₁₀ helix	trans	-69.8	-6.2	-177.9	-78.5	15.1	0	0	0	114.4	C182 K196 A255 A256 C257 N348	C182-N253 PolarHBondContact SG-ND2 3.27Å; K196-N253 WeakPolarHBondContact CE-OD1 3.49Å; K196-N253 PolarHBondContact NZ-OD1 3.24Å; N253-A255 PolarHBondContact O-N 3.34Å; N253-A255 VanDerWaalsContact O-N 3.09Å; N253-A256 PolarHBondContact O-N 2.92Å; N253-C257 HydrophobicContact CB-CB 4.43Å; N253-C257 PolarHBondContact O-N 3.44Å; N253-N348 PolarHBondContact OD1-O 3.14Å
254	N	91.4	Very high	89.5	Confident	125 Å²	125	62.2 Å²	62.2	67%	0.668	34%	0.339	S	S	*	.	G	3₁₀ helix	trans	-61.9	-20.7	-174.4	-66.3	-73.1	0	0	0	114.5	I251 G252	I251-N254 HydrophobicContact CG2-CB 3.94Å; I251-N254 PolarHBondContact O-ND2 3.21Å; G252-N254 PolarHBondContact O-N 3.19Å; G252-N254 VanDerWaalsContact O-N 3.11Å
255	A	92.4	Very high	88.6	Confident	9 Å²	9	62.9 Å²	62.9	7%	0.074	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.8	-29.1	171.9	0	0	0	0	0	113.4	I251 N253 C278 L281	I251-A255 HydrophobicContact CG2-CB 3.92Å; N253-A255 PolarHBondContact O-N 3.34Å; N253-A255 VanDerWaalsContact O-N 3.09Å; A255-C278 VanDerWaalsContact O-CB 3.32Å; A255-C278 WeakPolarHBondContact O-CB 3.48Å; A255-L281 HydrophobicContact CB-CD1 3.59Å
256	A	94.6	Very high	88.2	Confident	0 Å²	0	64.5 Å²	64.5	0%	0	36%	0.356	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.3	-16	-173.8	0	0	0	0	0	114	N253 V270 V352	N253-A256 PolarHBondContact O-N 2.92Å; A256-V270 PolarHBondContact O-N 3.08Å; A256-V352 WeakPolarHBondContact CB-O 3.31Å
257	C	94.3	Very high	87.9	Confident	17 Å²	17	66.3 Å²	66.3	12%	0.115	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	152.8	-175.2	-63.1	0	0	0	0	114.2	C182 N253 T268	C182-C257 HydrophobicContact CB-CB 3.69Å; C182-C257 WeakPolarHBondContact CB-SG 3.39Å; C182-C257 WeakPolarHBondContact SG-CB 2.91Å; C182-C257 CovalentContact SG-SG 2.03Å; C182-C257 PolarHBondContact SG-SG 3.11Å; N253-C257 HydrophobicContact CB-CB 4.43Å; N253-C257 PolarHBondContact O-N 3.44Å; C257-T268 CarbonylContact C-O 3.49Å; C257-T268 VanDerWaalsContact CA-O 3.29Å; C257-T268 WeakPolarHBondContact CA-O 3.5Å; C257-T268 WeakPolarHBondContact CB-O 3.5Å
258	T	91.7	Very high	87.7	Confident	69 Å²	69	64 Å²	64	42%	0.423	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	135.1	173.4	-49	0	0	0	0	109.1	E267 T268	T258-E267 WeakPolarHBondContact O-CA 3.47Å; T258-T268 PolarHBondContact N-O 3.18Å; T258-T268 PolarHBondContact O-N 2.79Å; T258-T268 VanDerWaalsContact O-N 3.08Å
259	K	88.6	Confident	87.7	Confident	149 Å²	149	64.1 Å²	64.1	65%	0.648	35%	0.354	S	S	*	.			trans	-71.7	152.3	178.3	-62.3	-166.2	172.3	-171.3	0	111.6	D261	K259-D261 PolarHBondContact O-N 3.38Å
260	A	84.8	Confident	87.6	Confident	50 Å²	50	60.4 Å²	60.4	41%	0.413	34%	0.338	S	S	.	.			trans	-56.4	133.3	172.6	0	0	0	0	0	111.4	A265	A260-A265 HydrophobicContact CB-CB 3.98Å; A260-A265 WeakPolarHBondContact CB-O 3.18Å
261	D	73.1	Confident	87.4	Confident	104 Å²	104	56.7 Å²	56.7	56%	0.556	32%	0.319	S	S	*	.			trans	-104	-17.2	-172.1	-164	69.6	0	0	0	113.6	K165 K259	K165-D261 WeakPolarHBondContact CE-OD1 3.45Å; K165-D261 WeakPolarHBondContact CE-OD2 3.43Å; K165-D261 IonicContact NZ-OD1 2.69Å; K165-D261 PolarHBondContact NZ-OD1 3.03Å; K165-D261 IonicContact NZ-OD2 2.67Å; K165-D261 PolarHBondContact NZ-OD2 2.94Å; K259-D261 PolarHBondContact O-N 3.38Å
262	H	74.6	Confident	87.2	Confident	79 Å²	79	53.6 Å²	53.6	37%	0.366	30%	0.303	S	S	.	.	S	Bend	trans	-145.8	159.9	-178.3	55.2	-89	0	0	0	111.2	G264 A265	H262-G264 PolarHBondContact O-N 3.23Å; H262-A265 VanDerWaalsContact O-CB 3.31Å; H262-A265 WeakPolarHBondContact O-CB 3.32Å; H262-A265 PolarHBondContact O-N 3.27Å
263	H	68.4	Low	87.1	Confident	197 Å²	197	54.7 Å²	54.7	91%	0.912	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	126.7	177.8	-70.2	-85.4	0	0	0	110.7
264	G	70.9	Confident	86.8	Confident	60 Å²	60	58.4 Å²	58.4	62%	0.619	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	90.9	-11.8	-176	0	0	0	0	0	115.3	Q161 H262	Q161-G264 VanDerWaalsContact CG-O 3.25Å; Q161-G264 WeakPolarHBondContact CG-O 3.27Å; H262-G264 PolarHBondContact O-N 3.23Å
265	A	80.2	Confident	86.8	Confident	20 Å²	20	54.3 Å²	54.3	17%	0.165	31%	0.305	C	S	.	.	P	Polyproline II helix	trans	-70	147.3	170.5	0	0	0	0	0	111.5	A260 H262	A260-A265 HydrophobicContact CB-CB 3.98Å; A260-A265 WeakPolarHBondContact CB-O 3.18Å; H262-A265 VanDerWaalsContact O-CB 3.31Å; H262-A265 WeakPolarHBondContact O-CB 3.32Å; H262-A265 PolarHBondContact O-N 3.27Å
266	V	88.6	Confident	86.8	Confident	44 Å²	44	63 Å²	63	27%	0.267	34%	0.341	S	S	.	.	P	Polyproline II helix	trans	-97.1	161.2	167.5	-61.7	0	0	0	0	110.7	Q161 L162 P181 T268	Q161-V266 WeakPolarHBondContact O-CG2 3.26Å; Q161-V266 PolarHBondContact O-N 3.32Å; Q161-V266 VanDerWaalsContact O-N 3.15Å; L162-V266 HydrophobicContact CD2-CG2 3.55Å; P181-V266 HydrophobicContact CB-CG2 4.43Å; V266-T268 PolarHBondContact O-N 2.98Å
267	E	92	Very high	86.7	Confident	92 Å²	92	64.8 Å²	64.8	43%	0.43	36%	0.359	S	S	.	.	P	Polyproline II helix	trans	-62.7	136.2	165.9	-60.9	-162.7	138.6	0	0	109.4	C182 T258	C182-E267 HydrophobicContact CB-CB 3.67Å; C182-E267 WeakPolarHBondContact CB-O 3.43Å; C182-E267 PolarHBondContact N-O 2.94Å; T258-E267 WeakPolarHBondContact O-CA 3.47Å
268	T	92.7	Very high	86.8	Confident	13 Å²	13	64 Å²	64	8%	0.08	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	157.3	-177.8	42.9	0	0	0	0	110.3	L162 A179 P180 C257 T258 V266	L162-T268 HydrophobicContact CD2-CG2 4.24Å; A179-T268 HydrophobicContact CB-CG2 4.19Å; P180-T268 CarbonylContact O-C 3.57Å; P180-T268 VanDerWaalsContact O-CA 3.3Å; P180-T268 WeakPolarHBondContact O-CA 3.23Å; P180-T268 WeakPolarHBondContact O-CB 3.16Å; C257-T268 CarbonylContact C-O 3.49Å; C257-T268 VanDerWaalsContact CA-O 3.29Å; C257-T268 WeakPolarHBondContact CA-O 3.5Å; C257-T268 WeakPolarHBondContact CB-O 3.5Å; T258-T268 PolarHBondContact N-O 3.18Å; T258-T268 PolarHBondContact O-N 2.79Å; T258-T268 VanDerWaalsContact O-N 3.08Å; V266-T268 PolarHBondContact O-N 2.98Å
269	V	94.4	Very high	87	Confident	2 Å²	2	61.2 Å²	61.2	1%	0.012	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	151.3	170.5	-61.3	0	0	0	0	110.7	P180 L271 N348 Y358	P180-V269 HydrophobicContact CB-CG2 3.82Å; P180-V269 HydrophobicContact CG-CG2 3.57Å; P180-V269 PolarHBondContact O-N 3.19Å; V269-L271 HydrophobicContact CG2-CD2 4.23Å; V269-L271 HydrophobicContact CG2-CG 4.49Å; V269-L271 PolarHBondContact O-N 3.34Å; V269-N348 HydrophobicContact CG1-CB 4.33Å; V269-Y358 HydrophobicContact CG2-CE2 3.87Å
270	V	93.8	Very high	87.4	Confident	6 Å²	6	58.6 Å²	58.6	4%	0.036	33%	0.33	C	S	.	.			trans	-66.2	125.6	170.7	176	0	0	0	0	108.9	A256 C278 E345 G346	A256-V270 PolarHBondContact O-N 3.08Å; V270-C278 HydrophobicContact CB-CB 4.36Å; V270-C278 HydrophobicContact CG1-CB 3.91Å; V270-C278 VanDerWaalsContact CG1-SG 3.51Å; V270-C278 HydrophobicContact CG2-CB 4.47Å; V270-E345 CarbonylContact O-C 3.52Å; V270-G346 PolarHBondContact O-N 2.97Å
271	L	92.4	Very high	88	Confident	29 Å²	29	56.9 Å²	56.9	15%	0.152	31%	0.313	C	S	.	.	B	Isolated β-bridge	trans	-115.5	137.8	164.1	-62.5	-176.8	0	0	0	109.3	C178 A179 V269 E345 Y358	C178-L271 WeakPolarHBondContact O-CD1 3.28Å; A179-L271 HydrophobicContact CB-CD1 3.77Å; A179-L271 HydrophobicContact CB-CG 4.13Å; V269-L271 HydrophobicContact CG2-CD2 4.23Å; V269-L271 HydrophobicContact CG2-CG 4.49Å; V269-L271 PolarHBondContact O-N 3.34Å; L271-E345 HydrophobicContact CD2-CB 4.38Å; L271-E345 HydrophobicContact CD2-CG 4.02Å; L271-Y358 HydrophobicContact CD2-CD2 4.42Å
272	G	89.9	Confident	89.2	Confident	2 Å²	2	51.9 Å²	51.9	2%	0.021	29%	0.287	C	S	.	.	S	Bend	trans	81.7	170.6	179.8	0	0	0	0	0	115.2	H274 N342 V344	G272-H274 VanDerWaalsContact C-N 3.26Å; G272-H274 PolarHBondContact O-N 3.49Å; G272-N342 WeakPolarHBondContact CA-O 3.37Å; G272-N342 WeakPolarHBondContact CA-OD1 3.25Å; G272-V344 PolarHBondContact N-O 2.88Å
273	S	88.7	Confident	90.3	Very high	42 Å²	42	51.1 Å²	51.1	29%	0.294	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.8	6.7	-171.7	59.7	0	0	0	0	115	T279 N342	S273-T279 VanDerWaalsContact C-OG1 3.25Å; S273-T279 VanDerWaalsContact CA-OG1 3.27Å; S273-T279 WeakPolarHBondContact CA-OG1 3.45Å; S273-T279 PolarHBondContact O-OG1 3Å; S273-N342 PolarHBondContact N-OD1 2.87Å; S273-N342 PolarHBondContact OG-OD1 2.9Å; S273-N342 VanDerWaalsContact OG-OD1 3.06Å
274	H	85.2	Confident	91.7	Very high	117 Å²	117	44.5 Å²	44.5	54%	0.542	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-34	-174.7	-59.1	-73.8	0	0	0	113.1	H168 G272 K276 N342	H168-H274 WeakPolarHBondContact CA-NE2 3.25Å; H168-H274 AromaticContact CD2-CD2 3.64Å; H168-H274 AromaticContact CD2-CG 3.8Å; H168-H274 PolarHBondContact O-NE2 3.49Å; G272-H274 VanDerWaalsContact C-N 3.26Å; G272-H274 PolarHBondContact O-N 3.49Å; H274-K276 PolarHBondContact O-N 3.37Å; H274-N342 PolarHBondContact NE2-ND2 3.04Å
275	S	90.9	Very high	93	Very high	40 Å²	40	41.6 Å²	41.6	28%	0.28	23%	0.226	S	C	.	.			trans	-78	108.7	175.1	175.6	0	0	0	0	110.3	G277 C278 T279	S275-G277 VanDerWaalsContact C-N 3.26Å; S275-G277 PolarHBondContact O-N 2.84Å; S275-C278 PolarHBondContact O-N 3.18Å; S275-C278 PolarHBondContact OG-N 2.74Å; S275-T279 VanDerWaalsContact O-CB 3.32Å; S275-T279 WeakPolarHBondContact O-CB 3.3Å; S275-T279 PolarHBondContact O-N 3.39Å; S275-T279 PolarHBondContact O-OG1 3.26Å
276	K	92.4	Very high	93.8	Very high	190 Å²	190	40.7 Å²	40.7	83%	0.826	22%	0.218	S	C	*	.	H	α-helix	trans	-56.4	-38.2	-178.7	-62.1	179.3	-177	176.5	0	112.9	H274 L280	H274-K276 PolarHBondContact O-N 3.37Å; K276-L280 WeakPolarHBondContact O-CB 3.46Å; K276-L280 PolarHBondContact O-N 2.8Å; K276-L280 VanDerWaalsContact O-N 3.14Å
277	G	93.5	Very high	94.3	Very high	38 Å²	38	40.8 Å²	40.8	39%	0.392	22%	0.215	S	C	.	.	H	α-helix	trans	-68.9	-54.4	178.6	0	0	0	0	0	112.1	S275 T279 L280 L281	S275-G277 VanDerWaalsContact C-N 3.26Å; S275-G277 PolarHBondContact O-N 2.84Å; G277-T279 VanDerWaalsContact C-N 3.33Å; G277-T279 PolarHBondContact O-N 3.41Å; G277-L280 PolarHBondContact O-N 2.75Å; G277-L281 WeakPolarHBondContact O-CG 3.39Å; G277-L281 PolarHBondContact O-N 3.31Å; G277-L281 VanDerWaalsContact O-N 3.08Å
278	C	95.6	Very high	94.6	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-52.8	-50.7	176.2	-178.2	0	0	0	0	111.7	A255 V270 S275 L280 L281 F282 C353	A255-C278 VanDerWaalsContact O-CB 3.32Å; A255-C278 WeakPolarHBondContact O-CB 3.48Å; V270-C278 HydrophobicContact CB-CB 4.36Å; V270-C278 HydrophobicContact CG1-CB 3.91Å; V270-C278 VanDerWaalsContact CG1-SG 3.51Å; V270-C278 HydrophobicContact CG2-CB 4.47Å; S275-C278 PolarHBondContact O-N 3.18Å; S275-C278 PolarHBondContact OG-N 2.74Å; C278-L280 VanDerWaalsContact C-N 3.33Å; C278-L280 PolarHBondContact O-N 2.86Å; C278-L281 PolarHBondContact O-N 3.01Å; C278-F282 WeakPolarHBondContact O-CB 3.38Å; C278-F282 PolarHBondContact O-N 3.24Å; C278-C353 WeakPolarHBondContact CA-SG 3.41Å; C278-C353 HydrophobicContact CB-CB 4.13Å; C278-C353 WeakPolarHBondContact CB-SG 3.34Å; C278-C353 WeakPolarHBondContact O-CB 3.42Å; C278-C353 WeakPolarHBondContact SG-CB 3.24Å; C278-C353 CovalentContact SG-SG 2.02Å; C278-C353 PolarHBondContact SG-SG 2.89Å
279	T	96.1	Very high	94.9	Very high	12 Å²	12	37.8 Å²	37.8	7%	0.074	20%	0.201	C	C	.	.	H	α-helix	trans	-63.2	-37.4	-177.6	-51.4	0	0	0	0	112.1	S273 S275 G277 M283 L339	S273-T279 VanDerWaalsContact C-OG1 3.25Å; S273-T279 VanDerWaalsContact CA-OG1 3.27Å; S273-T279 WeakPolarHBondContact CA-OG1 3.45Å; S273-T279 PolarHBondContact O-OG1 3Å; S275-T279 VanDerWaalsContact O-CB 3.32Å; S275-T279 WeakPolarHBondContact O-CB 3.3Å; S275-T279 PolarHBondContact O-N 3.39Å; S275-T279 PolarHBondContact O-OG1 3.26Å; G277-T279 VanDerWaalsContact C-N 3.33Å; G277-T279 PolarHBondContact O-N 3.41Å; T279-M283 HydrophobicContact CG2-CE 4.27Å; T279-M283 HydrophobicContact CG2-CG 4.46Å; T279-M283 WeakPolarHBondContact O-CB 3.38Å; T279-M283 VanDerWaalsContact O-CG 3.24Å; T279-M283 WeakPolarHBondContact O-CG 3.32Å; T279-M283 PolarHBondContact O-N 3.46Å; T279-L339 HydrophobicContact CG2-CD2 3.48Å; T279-L339 VanDerWaalsContact CG2-CD2 3.48Å
280	L	96.8	Very high	95	Very high	93 Å²	93	38.1 Å²	38.1	49%	0.487	20%	0.202	S	C	.	.	H	α-helix	trans	-67.3	-44.2	175.5	-178.8	60.9	0	0	0	112.3	K276 G277 C278 M283 L284	K276-L280 WeakPolarHBondContact O-CB 3.46Å; K276-L280 PolarHBondContact O-N 2.8Å; K276-L280 VanDerWaalsContact O-N 3.14Å; G277-L280 PolarHBondContact O-N 2.75Å; C278-L280 VanDerWaalsContact C-N 3.33Å; C278-L280 PolarHBondContact O-N 2.86Å; L280-M283 HydrophobicContact CD1-CE 4.16Å; L280-M283 PolarHBondContact O-N 2.91Å; L280-L284 HydrophobicContact CD1-CD1 3.91Å; L280-L284 HydrophobicContact CD1-CG 4.28Å; L280-L284 HydrophobicContact CG-CD1 4.13Å; L280-L284 WeakPolarHBondContact O-CG 3.28Å; L280-L284 PolarHBondContact O-N 3.3Å
281	L	97.1	Very high	95.2	Very high	14 Å²	14	37.8 Å²	37.8	7%	0.073	20%	0.2	C	C	.	.	H	α-helix	trans	-63	-45.2	176	-62.5	178.4	0	0	0	110.9	I244 A255 G277 C278 L284 L285 V352	I244-L281 HydrophobicContact CD1-CD2 3.98Å; I244-L281 HydrophobicContact CG2-CB 4.27Å; I244-L281 HydrophobicContact CG2-CD2 4.16Å; A255-L281 HydrophobicContact CB-CD1 3.59Å; G277-L281 WeakPolarHBondContact O-CG 3.39Å; G277-L281 PolarHBondContact O-N 3.31Å; G277-L281 VanDerWaalsContact O-N 3.08Å; C278-L281 PolarHBondContact O-N 3.01Å; L281-L284 PolarHBondContact O-N 3.34Å; L281-L285 WeakPolarHBondContact O-CB 3.26Å; L281-L285 PolarHBondContact O-N 2.87Å; L281-V352 HydrophobicContact CB-CB 4.43Å; L281-V352 HydrophobicContact CD1-CB 4.35Å; L281-V352 HydrophobicContact CD1-CG1 4.42Å
282	F	98	Very high	95.4	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-56.2	-54.4	174.2	160.8	-100.2	0	0	0	112.2	C278 L284 L285 Y286 T335 L338 L339 V344 C353 V355	C278-F282 WeakPolarHBondContact O-CB 3.38Å; C278-F282 PolarHBondContact O-N 3.24Å; F282-L284 VanDerWaalsContact C-N 3.29Å; F282-L284 PolarHBondContact O-N 3.02Å; F282-L285 PolarHBondContact O-N 3.26Å; F282-Y286 HydrophobicContact CE2-CD2 4.33Å; F282-Y286 HydrophobicContact CE2-CG 4.04Å; F282-Y286 HydrophobicContact CZ-CG 4.31Å; F282-Y286 VanDerWaalsContact O-CB 3.28Å; F282-Y286 WeakPolarHBondContact O-CB 3.43Å; F282-Y286 PolarHBondContact O-N 3.07Å; F282-T335 HydrophobicContact CE1-CG2 4.35Å; F282-L338 HydrophobicContact CE1-CB 4.32Å; F282-L338 HydrophobicContact CE2-CD1 4.09Å; F282-L338 HydrophobicContact CZ-CB 3.71Å; F282-L338 HydrophobicContact CZ-CD1 3.69Å; F282-L338 HydrophobicContact CZ-CG 4.34Å; F282-L339 HydrophobicContact CD1-CD2 4.15Å; F282-L339 HydrophobicContact CE1-CD2 3.94Å; F282-L339 HydrophobicContact CE1-CG 4.3Å; F282-V344 HydrophobicContact CB-CG1 3.79Å; F282-V344 HydrophobicContact CD1-CB 4.46Å; F282-V344 HydrophobicContact CD1-CG1 4.08Å; F282-V344 HydrophobicContact CD1-CG2 3.61Å; F282-V344 HydrophobicContact CD2-CG1 4.34Å; F282-V344 HydrophobicContact CE1-CG2 3.74Å; F282-V344 HydrophobicContact CG-CB 4.48Å; F282-V344 HydrophobicContact CG-CG1 3.78Å; F282-V344 HydrophobicContact CG-CG2 4.08Å; F282-V344 HydrophobicContact CZ-CG2 4.3Å; F282-C353 WeakPolarHBondContact CA-O 3.34Å; F282-C353 HydrophobicContact CB-CB 3.95Å; F282-V355 HydrophobicContact CE2-CB 4.07Å; F282-V355 HydrophobicContact CE2-CG1 4.11Å
283	M	97.8	Very high	95.7	Very high	62 Å²	62	37 Å²	37	31%	0.305	20%	0.196	S	C	.	.	H	α-helix	trans	-55.5	-46	-177.2	-80.8	-172.7	-63.8	0	0	111.4	T279 L280 F287 T335 L339	T279-M283 HydrophobicContact CG2-CE 4.27Å; T279-M283 HydrophobicContact CG2-CG 4.46Å; T279-M283 WeakPolarHBondContact O-CB 3.38Å; T279-M283 VanDerWaalsContact O-CG 3.24Å; T279-M283 WeakPolarHBondContact O-CG 3.32Å; T279-M283 PolarHBondContact O-N 3.46Å; L280-M283 HydrophobicContact CD1-CE 4.16Å; L280-M283 PolarHBondContact O-N 2.91Å; M283-F287 WeakPolarHBondContact O-CB 3.17Å; M283-F287 PolarHBondContact O-N 3.43Å; M283-F287 VanDerWaalsContact O-N 3.14Å; M283-T335 HydrophobicContact CB-CG2 4.22Å; M283-T335 HydrophobicContact CG-CG2 3.99Å; M283-L339 HydrophobicContact CG-CD1 3.91Å; M283-L339 HydrophobicContact CG-CD2 4.07Å; M283-L339 HydrophobicContact CG-CG 4.42Å; M283-L339 HydrophobicContact SD-CD1 3.67Å; M283-L339 HydrophobicContact SD-CD2 4.42Å
284	L	98.1	Very high	96.1	Very high	58 Å²	58	36.3 Å²	36.3	30%	0.304	19%	0.189	S	C	.	.	H	α-helix	trans	-70.6	-48.7	-179.3	-65	170.5	0	0	0	111.4	I244 L280 L281 F282 F288	I244-L284 HydrophobicContact CD1-CB 3.88Å; I244-L284 HydrophobicContact CD1-CD1 3.82Å; I244-L284 HydrophobicContact CG1-CB 4.09Å; L280-L284 HydrophobicContact CD1-CD1 3.91Å; L280-L284 HydrophobicContact CD1-CG 4.28Å; L280-L284 HydrophobicContact CG-CD1 4.13Å; L280-L284 WeakPolarHBondContact O-CG 3.28Å; L280-L284 PolarHBondContact O-N 3.3Å; L281-L284 PolarHBondContact O-N 3.34Å; F282-L284 VanDerWaalsContact C-N 3.29Å; F282-L284 PolarHBondContact O-N 3.02Å; L284-F288 HydrophobicContact CD2-CE2 4.14Å; L284-F288 WeakPolarHBondContact O-CB 3.4Å; L284-F288 WeakPolarHBondContact O-CD2 3.34Å; L284-F288 PolarHBondContact O-N 3.41Å
285	L	98.3	Very high	96.6	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-62	-49.6	-177.8	-179.6	56.8	0	0	0	112	V241 I244 Y245 L281 F282 T289 V352 F354	V241-L285 HydrophobicContact CB-CD1 4.33Å; V241-L285 HydrophobicContact CG1-CD1 3.84Å; V241-L285 HydrophobicContact CG2-CD1 4.34Å; I244-L285 HydrophobicContact CG2-CB 3.94Å; I244-L285 HydrophobicContact CG2-CD2 4.39Å; Y245-L285 HydrophobicContact CD2-CD1 4.25Å; Y245-L285 HydrophobicContact CE1-CD2 4.17Å; Y245-L285 HydrophobicContact CE2-CD1 3.73Å; L281-L285 WeakPolarHBondContact O-CB 3.26Å; L281-L285 PolarHBondContact O-N 2.87Å; F282-L285 PolarHBondContact O-N 3.26Å; L285-T289 VanDerWaalsContact O-CB 3.25Å; L285-T289 WeakPolarHBondContact O-CB 3.25Å; L285-T289 PolarHBondContact O-N 3.48Å; L285-T289 PolarHBondContact O-OG1 3.32Å; L285-V352 HydrophobicContact CD2-CB 4.43Å; L285-V352 HydrophobicContact CD2-CG2 3.53Å; L285-F354 HydrophobicContact CD2-CD2 3.83Å; L285-F354 HydrophobicContact CD2-CE2 4.42Å; L285-F354 HydrophobicContact CG-CD2 4.01Å; L285-F354 HydrophobicContact CG-CE2 4.17Å
286	Y	98.5	Very high	96.9	Very high	0 Å²	0	29 Å²	29	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-66.8	-46.3	-178.7	-177.5	-92	0	0	0	111.4	F282 F288 T289 M290 L334 L338 F354 V355 F366	F282-Y286 HydrophobicContact CE2-CD2 4.33Å; F282-Y286 HydrophobicContact CE2-CG 4.04Å; F282-Y286 HydrophobicContact CZ-CG 4.31Å; F282-Y286 VanDerWaalsContact O-CB 3.28Å; F282-Y286 WeakPolarHBondContact O-CB 3.43Å; F282-Y286 PolarHBondContact O-N 3.07Å; Y286-F288 PolarHBondContact O-N 3.42Å; Y286-T289 PolarHBondContact O-N 2.93Å; Y286-M290 HydrophobicContact CD1-CG 4.34Å; Y286-M290 HydrophobicContact CD2-CE 4.37Å; Y286-M290 HydrophobicContact CD2-CG 4.48Å; Y286-M290 HydrophobicContact CE1-CG 3.91Å; Y286-M290 HydrophobicContact CE2-CE 3.62Å; Y286-M290 HydrophobicContact CE2-CG 4.08Å; Y286-M290 WeakPolarHBondContact O-CB 3.08Å; Y286-M290 WeakPolarHBondContact O-CG 3.27Å; Y286-M290 PolarHBondContact O-N 3.43Å; Y286-L334 HydrophobicContact CE1-CB 3.8Å; Y286-L338 HydrophobicContact CD1-CD1 4.07Å; Y286-L338 HydrophobicContact CD2-CD1 4.14Å; Y286-L338 HydrophobicContact CE1-CD1 3.66Å; Y286-L338 HydrophobicContact CE2-CD1 3.73Å; Y286-L338 HydrophobicContact CG-CD1 4.3Å; Y286-L338 VanDerWaalsContact CZ-CD1 3.48Å; Y286-F354 HydrophobicContact CD2-CE2 4.12Å; Y286-F354 HydrophobicContact CD2-CZ 4.2Å; Y286-V355 HydrophobicContact CD2-CG1 3.58Å; Y286-V355 HydrophobicContact CE2-CG1 3.62Å; Y286-F366 PolarHBondContact OH-O 2.58Å
287	F	98.6	Very high	97	Very high	46 Å²	46	20.9 Å²	20.9	20%	0.202	12%	0.118	C	C	.	.	H	α-helix	trans	-57.1	-51.2	177.2	176.8	-92.9	0	0	0	112	M283 M290 A291 W328 P331	M283-F287 WeakPolarHBondContact O-CB 3.17Å; M283-F287 PolarHBondContact O-N 3.43Å; M283-F287 VanDerWaalsContact O-N 3.14Å; F287-M290 PolarHBondContact O-N 2.89Å; F287-A291 VanDerWaalsContact O-CB 3.25Å; F287-A291 WeakPolarHBondContact O-CB 3.43Å; F287-A291 PolarHBondContact O-N 2.85Å; F287-W328 HydrophobicContact CE1-CE3 4.08Å; F287-W328 HydrophobicContact CE1-CZ3 4.36Å; F287-W328 HydrophobicContact CZ-CB 4.5Å; F287-W328 AromaticContact CZ-CE3 3.91Å; F287-W328 HydrophobicContact CZ-CE3 3.91Å; F287-P331 HydrophobicContact CD2-CB 3.7Å; F287-P331 HydrophobicContact CE2-CB 3.93Å; F287-P331 HydrophobicContact CG-CB 4.31Å; F287-P331 WeakPolarHBondContact O-CB 3.44Å
288	F	98.4	Very high	97.2	Very high	25 Å²	25	19.4 Å²	19.4	11%	0.11	10%	0.1	C	C	.	.	H	α-helix	trans	-73.2	-30.4	-177.5	-73.7	-62.7	0	0	0	113.1	C237 F240 V241 L284 Y286 G292	C237-F288 HydrophobicContact CB-CB 4.32Å; C237-F288 HydrophobicContact CB-CD1 4.18Å; C237-F288 WeakPolarHBondContact CB-O 3.27Å; F240-F288 HydrophobicContact CB-CB 4.2Å; F240-F288 HydrophobicContact CB-CD1 4.28Å; F240-F288 HydrophobicContact CB-CD2 3.31Å; F240-F288 HydrophobicContact CB-CE2 3.63Å; F240-F288 HydrophobicContact CB-CG 3.68Å; F240-F288 HydrophobicContact CB-CZ 4.24Å; F240-F288 HydrophobicContact CD1-CD2 4.3Å; F240-F288 AromaticContact CD1-CE2 3.77Å; F240-F288 HydrophobicContact CD1-CE2 3.77Å; F240-F288 HydrophobicContact CD1-CZ 4.26Å; F240-F288 HydrophobicContact CD2-CD1 4.23Å; F240-F288 HydrophobicContact CD2-CD2 4.17Å; F240-F288 AromaticContact CD2-CE1 3.77Å; F240-F288 HydrophobicContact CD2-CE1 3.77Å; F240-F288 AromaticContact CD2-CE2 3.71Å; F240-F288 HydrophobicContact CD2-CE2 3.71Å; F240-F288 HydrophobicContact CD2-CG 4.42Å; F240-F288 AromaticContact CD2-CZ 3.49Å; F240-F288 HydrophobicContact CD2-CZ 3.49Å; F240-F288 VanDerWaalsContact CD2-CZ 3.49Å; F240-F288 HydrophobicContact CE1-CE2 4.34Å; F240-F288 HydrophobicContact CE2-CE1 4.27Å; F240-F288 HydrophobicContact CE2-CE2 4.29Å; F240-F288 AromaticContact CE2-CZ 3.82Å; F240-F288 HydrophobicContact CE2-CZ 3.82Å; F240-F288 AromaticContact CG-CD2 3.7Å; F240-F288 HydrophobicContact CG-CD2 3.7Å; F240-F288 HydrophobicContact CG-CE1 4.28Å; F240-F288 AromaticContact CG-CE2 3.42Å; F240-F288 HydrophobicContact CG-CE2 3.42Å; F240-F288 VanDerWaalsContact CG-CE2 3.42Å; F240-F288 HydrophobicContact CG-CG 4.25Å; F240-F288 AromaticContact CG-CZ 3.75Å; F240-F288 HydrophobicContact CG-CZ 3.75Å; F240-F288 HydrophobicContact CZ-CZ 4.33Å; V241-F288 HydrophobicContact CG2-CB 3.94Å; L284-F288 HydrophobicContact CD2-CE2 4.14Å; L284-F288 WeakPolarHBondContact O-CB 3.4Å; L284-F288 WeakPolarHBondContact O-CD2 3.34Å; L284-F288 PolarHBondContact O-N 3.41Å; Y286-F288 PolarHBondContact O-N 3.42Å; F288-G292 PolarHBondContact O-N 3.02Å
289	T	97.6	Very high	97.1	Very high	17 Å²	17	19.6 Å²	19.6	10%	0.104	10%	0.102	C	C	.	.	H	α-helix	trans	-63.7	-48.9	172.1	-59.1	0	0	0	0	110.9	L285 Y286 G292 I293	L285-T289 VanDerWaalsContact O-CB 3.25Å; L285-T289 WeakPolarHBondContact O-CB 3.25Å; L285-T289 PolarHBondContact O-N 3.48Å; L285-T289 PolarHBondContact O-OG1 3.32Å; Y286-T289 PolarHBondContact O-N 2.93Å; T289-G292 PolarHBondContact O-N 3.02Å; T289-I293 PolarHBondContact O-N 3.11Å; T289-I293 VanDerWaalsContact O-N 3.16Å
290	M	97.9	Very high	97	Very high	9 Å²	9	19 Å²	19	4%	0.044	10%	0.098	C	C	.	.	H	α-helix	trans	-68	-40.2	178.9	-69.4	-61.6	163.7	0	0	112.3	Y286 F287 G292 I293 V294 P331 F366 P370	Y286-M290 HydrophobicContact CD1-CG 4.34Å; Y286-M290 HydrophobicContact CD2-CE 4.37Å; Y286-M290 HydrophobicContact CD2-CG 4.48Å; Y286-M290 HydrophobicContact CE1-CG 3.91Å; Y286-M290 HydrophobicContact CE2-CE 3.62Å; Y286-M290 HydrophobicContact CE2-CG 4.08Å; Y286-M290 WeakPolarHBondContact O-CB 3.08Å; Y286-M290 WeakPolarHBondContact O-CG 3.27Å; Y286-M290 PolarHBondContact O-N 3.43Å; F287-M290 PolarHBondContact O-N 2.89Å; M290-G292 VanDerWaalsContact C-N 3.26Å; M290-G292 PolarHBondContact O-N 2.85Å; M290-I293 PolarHBondContact O-N 3.45Å; M290-I293 HydrophobicContact SD-CD1 4.04Å; M290-V294 WeakPolarHBondContact O-CG2 3.41Å; M290-V294 PolarHBondContact O-N 3.05Å; M290-P331 HydrophobicContact CB-CB 3.9Å; M290-P331 HydrophobicContact CB-CG 4.03Å; M290-F366 WeakPolarHBondContact CE-O 3.37Å; M290-P370 HydrophobicContact CE-CB 4.49Å; M290-P370 HydrophobicContact SD-CB 3.97Å
291	A	98.1	Very high	96.9	Very high	0 Å²	0	17 Å²	17	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-60.4	-38.2	172.5	0	0	0	0	0	111.7	F287 V294 W295 W328 P331	F287-A291 VanDerWaalsContact O-CB 3.25Å; F287-A291 WeakPolarHBondContact O-CB 3.43Å; F287-A291 PolarHBondContact O-N 2.85Å; A291-V294 PolarHBondContact O-N 2.94Å; A291-W295 WeakPolarHBondContact O-CB 3.26Å; A291-W295 PolarHBondContact O-N 3.23Å; A291-W328 HydrophobicContact CB-CE3 3.93Å; A291-W328 HydrophobicContact CB-CZ3 3.7Å; A291-P331 VanDerWaalsContact CA-CG 3.5Å; A291-P331 HydrophobicContact CB-CB 4.36Å; A291-P331 HydrophobicContact CB-CG 3.83Å; A291-P331 VanDerWaalsContact N-CG 3.33Å
292	G	96.1	Very high	96.7	Very high	0 Å²	0	16.3 Å²	16.3	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-57.1	-46.4	173.4	0	0	0	0	0	113.5	F288 T289 M290 W295 W296	F288-G292 PolarHBondContact O-N 3.02Å; T289-G292 PolarHBondContact O-N 3.02Å; M290-G292 VanDerWaalsContact C-N 3.26Å; M290-G292 PolarHBondContact O-N 2.85Å; G292-W295 PolarHBondContact O-N 2.78Å; G292-W296 PolarHBondContact O-N 3.44Å; G292-W296 VanDerWaalsContact O-N 3.11Å
293	I	95.7	Very high	96.4	Very high	14 Å²	14	16.5 Å²	16.5	7%	0.072	8%	0.084	C	C	.	.	H	α-helix	trans	-63	-47.8	175.5	-65.5	161.6	0	0	0	110.6	T289 M290 W295 W296 V297 L371 L424	T289-I293 PolarHBondContact O-N 3.11Å; T289-I293 VanDerWaalsContact O-N 3.16Å; M290-I293 PolarHBondContact O-N 3.45Å; M290-I293 HydrophobicContact SD-CD1 4.04Å; I293-W295 VanDerWaalsContact C-N 3.33Å; I293-W295 PolarHBondContact O-N 3.14Å; I293-W296 PolarHBondContact O-N 3.28Å; I293-V297 PolarHBondContact O-N 3.08Å; I293-L371 HydrophobicContact CD1-CD1 4.25Å; I293-L424 HydrophobicContact CG1-CD2 4.46Å
294	V	97.4	Very high	96.1	Very high	27 Å²	27	16.2 Å²	16.2	16%	0.164	8%	0.081	C	C	.	.	H	α-helix	trans	-64.8	-36.2	180	-177.3	0	0	0	0	111.7	M290 A291 V297 I298 A327	M290-V294 WeakPolarHBondContact O-CG2 3.41Å; M290-V294 PolarHBondContact O-N 3.05Å; A291-V294 PolarHBondContact O-N 2.94Å; V294-V297 PolarHBondContact O-N 2.89Å; V294-I298 HydrophobicContact CG1-CD1 3.97Å; V294-I298 WeakPolarHBondContact O-CG1 3.38Å; V294-I298 PolarHBondContact O-N 2.81Å; V294-A327 HydrophobicContact CG1-CB 4.28Å
295	W	96.9	Very high	95.7	Very high	0 Å²	0	14.7 Å²	14.7	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-65.8	-34.9	174	-83.5	119.4	0	0	0	113.5	P230 F233 A291 G292 I293 I298 L299 H324 A327 W328	P230-W295 HydrophobicContact CB-CE3 3.93Å; P230-W295 HydrophobicContact CB-CZ3 4.35Å; P230-W295 HydrophobicContact CG-CE3 4.5Å; P230-W295 HydrophobicContact CG-CZ3 4.48Å; F233-W295 HydrophobicContact CB-CD2 3.73Å; F233-W295 HydrophobicContact CB-CE3 4.28Å; F233-W295 HydrophobicContact CB-CG 4.15Å; F233-W295 HydrophobicContact CB-CH2 4.3Å; F233-W295 HydrophobicContact CB-CZ2 3.72Å; F233-W295 HydrophobicContact CD2-CE3 4.29Å; F233-W295 AromaticContact CD2-CH2 3.54Å; F233-W295 HydrophobicContact CD2-CH2 3.54Å; F233-W295 AromaticContact CD2-CZ2 3.76Å; F233-W295 HydrophobicContact CD2-CZ2 3.76Å; F233-W295 AromaticContact CD2-CZ3 3.82Å; F233-W295 HydrophobicContact CD2-CZ3 3.82Å; F233-W295 HydrophobicContact CE2-CH2 4.14Å; F233-W295 HydrophobicContact CG-CH2 4.09Å; F233-W295 AromaticContact CG-CZ2 3.79Å; F233-W295 HydrophobicContact CG-CZ2 3.79Å; A291-W295 WeakPolarHBondContact O-CB 3.26Å; A291-W295 PolarHBondContact O-N 3.23Å; G292-W295 PolarHBondContact O-N 2.78Å; I293-W295 VanDerWaalsContact C-N 3.33Å; I293-W295 PolarHBondContact O-N 3.14Å; W295-I298 HydrophobicContact CD2-CD1 4.47Å; W295-I298 HydrophobicContact CE3-CB 4.21Å; W295-I298 HydrophobicContact CE3-CD1 3.95Å; W295-I298 HydrophobicContact CE3-CG2 4.05Å; W295-I298 HydrophobicContact CZ3-CD1 4.08Å; W295-I298 HydrophobicContact CZ3-CG2 3.98Å; W295-I298 PolarHBondContact O-N 2.7Å; W295-L299 PolarHBondContact O-N 2.86Å; W295-H324 AromaticContact CH2-CE1 3.44Å; W295-H324 VanDerWaalsContact CH2-CE1 3.44Å; W295-H324 WeakPolarHBondContact CH2-CE1 3.4Å; W295-H324 AromaticContact CH2-ND1 3.41Å; W295-H324 WeakPolarHBondContact CH2-ND1 3.39Å; W295-H324 AromaticContact CZ2-CE1 3.69Å; W295-H324 AromaticContact CZ2-ND1 3.44Å; W295-H324 WeakPolarHBondContact CZ2-ND1 3.04Å; W295-A327 HydrophobicContact CD2-CB 3.85Å; W295-A327 HydrophobicContact CE3-CB 4.39Å; W295-A327 HydrophobicContact CG-CB 4.33Å; W295-A327 HydrophobicContact CH2-CB 4.06Å; W295-A327 HydrophobicContact CZ2-CB 3.46Å; W295-A327 VanDerWaalsContact CZ2-CB 3.46Å; W295-A327 HydrophobicContact CZ3-CB 4.49Å; W295-W328 AromaticContact CE2-CZ2 3.92Å; W295-W328 AromaticContact CZ2-CE2 3.99Å; W295-W328 HydrophobicContact CZ2-CH2 4.46Å; W295-W328 AromaticContact CZ2-CZ2 3.83Å; W295-W328 HydrophobicContact CZ2-CZ2 3.83Å; W295-W328 AromaticContact NE1-CE2 3.96Å; W295-W328 AromaticContact NE1-CH2 3.16Å; W295-W328 AromaticContact NE1-CZ2 3.43Å; W295-W328 AromaticContact NE1-CZ3 3.48Å
296	W	95.4	Very high	95.1	Very high	3 Å²	3	15.5 Å²	15.5	1%	0.011	8%	0.08	C	C	.	.	H	α-helix	trans	-68.1	-41.4	170.6	169.8	77.7	0	0	0	112.1	G292 I293 I298 L299 T300 G374 I382 S417 Y420 L421 L424	G292-W296 PolarHBondContact O-N 3.44Å; G292-W296 VanDerWaalsContact O-N 3.11Å; I293-W296 PolarHBondContact O-N 3.28Å; W296-I298 VanDerWaalsContact C-N 3.3Å; W296-I298 PolarHBondContact O-N 2.69Å; W296-L299 WeakPolarHBondContact O-CA 3.38Å; W296-L299 WeakPolarHBondContact O-CB 3.38Å; W296-L299 PolarHBondContact O-N 2.91Å; W296-T300 HydrophobicContact CD2-CG2 4.42Å; W296-T300 HydrophobicContact CZ2-CG2 4.11Å; W296-T300 PolarHBondContact O-N 3.46Å; W296-G374 VanDerWaalsContact CZ3-O 3.32Å; W296-G374 WeakPolarHBondContact CZ3-O 3.38Å; W296-I382 HydrophobicContact CZ2-CD1 4.08Å; W296-S417 PolarHBondContact NE1-O 3.07Å; W296-Y420 HydrophobicContact CB-CD1 3.98Å; W296-Y420 HydrophobicContact CB-CE1 3.57Å; W296-Y420 AromaticContact CD1-CD1 3.1Å; W296-Y420 AromaticContact CD1-CE1 3.67Å; W296-Y420 AromaticContact CD1-CG 3.4Å; W296-Y420 AromaticContact CD2-CD1 3.77Å; W296-Y420 HydrophobicContact CD2-CD1 3.77Å; W296-Y420 AromaticContact CD2-CE1 3.99Å; W296-Y420 HydrophobicContact CD2-CE1 3.99Å; W296-Y420 AromaticContact CE2-CD1 3.79Å; W296-Y420 AromaticContact CG-CD1 3.34Å; W296-Y420 HydrophobicContact CG-CD1 3.34Å; W296-Y420 AromaticContact CG-CE1 3.44Å; W296-Y420 HydrophobicContact CG-CE1 3.44Å; W296-Y420 VanDerWaalsContact CG-CE1 3.44Å; W296-Y420 HydrophobicContact CG-CG 4.06Å; W296-Y420 AromaticContact NE1-CD1 3.36Å; W296-Y420 AromaticContact NE1-CG 3.73Å; W296-L421 HydrophobicContact CH2-CD1 4.08Å; W296-L421 HydrophobicContact CZ2-CB 4.28Å; W296-L421 HydrophobicContact CZ2-CD1 4.11Å; W296-L424 HydrophobicContact CD2-CD1 3.71Å; W296-L424 HydrophobicContact CE3-CD1 3.38Å; W296-L424 HydrophobicContact CH2-CD1 3.66Å; W296-L424 HydrophobicContact CZ2-CD1 3.98Å; W296-L424 HydrophobicContact CZ3-CD1 3.35Å
297	V	96.2	Very high	94.4	Very high	21 Å²	21	15.6 Å²	15.6	13%	0.127	8%	0.081	C	C	.	.	H	α-helix	trans	-58.6	-45.1	173.3	176	0	0	0	0	110.1	I293 V294 L299 T300 I301 V377	I293-V297 PolarHBondContact O-N 3.08Å; V294-V297 PolarHBondContact O-N 2.89Å; V297-L299 VanDerWaalsContact C-N 3.31Å; V297-L299 PolarHBondContact O-N 3.45Å; V297-T300 PolarHBondContact O-N 2.75Å; V297-T300 VanDerWaalsContact O-N 3.12Å; V297-T300 PolarHBondContact O-OG1 3.38Å; V297-I301 HydrophobicContact CG1-CD1 3.99Å; V297-I301 HydrophobicContact CG1-CG1 4.43Å; V297-I301 WeakPolarHBondContact O-CG1 3.31Å; V297-I301 PolarHBondContact O-N 3.46Å; V297-V377 HydrophobicContact CG1-CG1 3.93Å
298	I	96.1	Very high	93.7	Very high	6 Å²	6	14.6 Å²	14.6	3%	0.031	8%	0.083	C	C	.	.	H	α-helix	trans	-60.8	-36.4	174.3	-70.3	161	0	0	0	112.3	P230 V294 W295 W296 I301 T302 F323 A327	P230-I298 HydrophobicContact CB-CG2 4.43Å; P230-I298 HydrophobicContact CG-CG2 3.99Å; V294-I298 HydrophobicContact CG1-CD1 3.97Å; V294-I298 WeakPolarHBondContact O-CG1 3.38Å; V294-I298 PolarHBondContact O-N 2.81Å; W295-I298 HydrophobicContact CD2-CD1 4.47Å; W295-I298 HydrophobicContact CE3-CB 4.21Å; W295-I298 HydrophobicContact CE3-CD1 3.95Å; W295-I298 HydrophobicContact CE3-CG2 4.05Å; W295-I298 HydrophobicContact CZ3-CD1 4.08Å; W295-I298 HydrophobicContact CZ3-CG2 3.98Å; W295-I298 PolarHBondContact O-N 2.7Å; W296-I298 VanDerWaalsContact C-N 3.3Å; W296-I298 PolarHBondContact O-N 2.69Å; I298-I301 PolarHBondContact O-N 3.03Å; I298-T302 HydrophobicContact CG2-CG2 4.31Å; I298-T302 WeakPolarHBondContact O-CB 3.32Å; I298-T302 WeakPolarHBondContact O-CG2 3.34Å; I298-T302 PolarHBondContact O-N 3.35Å; I298-T302 PolarHBondContact O-OG1 2.96Å; I298-F323 HydrophobicContact CD1-CB 4.11Å; I298-F323 WeakPolarHBondContact CD1-O 3.33Å; I298-F323 HydrophobicContact CG1-CB 4.47Å; I298-F323 HydrophobicContact CG1-CD1 4.4Å; I298-F323 HydrophobicContact CG2-CB 3.99Å; I298-F323 HydrophobicContact CG2-CD1 4.14Å; I298-F323 HydrophobicContact CG2-CD2 4.39Å; I298-F323 HydrophobicContact CG2-CG 3.93Å; I298-A327 HydrophobicContact CD1-CB 3.73Å
299	L	93.4	Very high	93	Very high	5 Å²	5	16.5 Å²	16.5	3%	0.026	10%	0.099	C	C	.	.	H	α-helix	trans	-62.1	-45.6	172.6	-175.3	61.8	0	0	0	111.4	P230 I231 W295 W296 V297 I301 T302 W303 I413 F416	P230-L299 HydrophobicContact CB-CB 4.19Å; P230-L299 HydrophobicContact CB-CD1 4.28Å; I231-L299 HydrophobicContact CD1-CD1 4.3Å; I231-L299 HydrophobicContact CD1-CD2 4.34Å; I231-L299 HydrophobicContact CG1-CD1 3.96Å; I231-L299 HydrophobicContact CG1-CD2 3.83Å; W295-L299 PolarHBondContact O-N 2.86Å; W296-L299 WeakPolarHBondContact O-CA 3.38Å; W296-L299 WeakPolarHBondContact O-CB 3.38Å; W296-L299 PolarHBondContact O-N 2.91Å; V297-L299 VanDerWaalsContact C-N 3.31Å; V297-L299 PolarHBondContact O-N 3.45Å; L299-I301 PolarHBondContact O-N 3.14Å; L299-T302 PolarHBondContact O-N 2.98Å; L299-T302 PolarHBondContact O-OG1 2.9Å; L299-W303 VanDerWaalsContact O-CB 3.23Å; L299-W303 WeakPolarHBondContact O-CB 3.45Å; L299-W303 PolarHBondContact O-N 3.43Å; L299-I413 HydrophobicContact CD1-CG2 4.06Å; L299-I413 HydrophobicContact CG-CG2 4.48Å; L299-F416 HydrophobicContact CD2-CD1 3.75Å; L299-F416 HydrophobicContact CD2-CE1 3.72Å
300	T	94.6	Very high	92.3	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-65.4	-36.8	175.9	66.8	0	0	0	0	112.7	W296 V297 F304 L381 I382	W296-T300 HydrophobicContact CD2-CG2 4.42Å; W296-T300 HydrophobicContact CZ2-CG2 4.11Å; W296-T300 PolarHBondContact O-N 3.46Å; V297-T300 PolarHBondContact O-N 2.75Å; V297-T300 VanDerWaalsContact O-N 3.12Å; V297-T300 PolarHBondContact O-OG1 3.38Å; T300-F304 WeakPolarHBondContact O-CB 3.28Å; T300-F304 PolarHBondContact O-N 2.97Å; T300-L381 WeakPolarHBondContact OG1-CD1 3.43Å; T300-I382 HydrophobicContact CG2-CD1 3.94Å; T300-I382 HydrophobicContact CG2-CG1 3.88Å
301	I	94.2	Very high	91.7	Very high	50 Å²	50	25.8 Å²	25.8	26%	0.256	13%	0.134	S	C	.	.	H	α-helix	trans	-61.9	-53.6	173.5	-68.9	168.8	0	0	0	110.6	V297 I298 L299 W303 F304 L305 F323 L381	V297-I301 HydrophobicContact CG1-CD1 3.99Å; V297-I301 HydrophobicContact CG1-CG1 4.43Å; V297-I301 WeakPolarHBondContact O-CG1 3.31Å; V297-I301 PolarHBondContact O-N 3.46Å; I298-I301 PolarHBondContact O-N 3.03Å; L299-I301 PolarHBondContact O-N 3.14Å; I301-W303 VanDerWaalsContact C-N 3.29Å; I301-W303 PolarHBondContact O-N 2.83Å; I301-F304 PolarHBondContact O-N 3.42Å; I301-L305 HydrophobicContact CG2-CD1 3.82Å; I301-L305 HydrophobicContact CG2-CG 4.37Å; I301-L305 VanDerWaalsContact O-CG 3.3Å; I301-L305 WeakPolarHBondContact O-CG 3.5Å; I301-L305 PolarHBondContact O-N 3.43Å; I301-F323 HydrophobicContact CG2-CE1 4.28Å; I301-L381 HydrophobicContact CB-CD1 4.38Å; I301-L381 HydrophobicContact CD1-CD1 4.5Å; I301-L381 HydrophobicContact CG1-CD1 3.42Å; I301-L381 VanDerWaalsContact CG1-CD1 3.42Å
302	T	92.8	Very high	91	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-66.8	-32.1	-177.3	53.4	0	0	0	0	112.4	Y226 I298 L299 A306 I316 F323	Y226-T302 HydrophobicContact CD1-CG2 4.41Å; I298-T302 HydrophobicContact CG2-CG2 4.31Å; I298-T302 WeakPolarHBondContact O-CB 3.32Å; I298-T302 WeakPolarHBondContact O-CG2 3.34Å; I298-T302 PolarHBondContact O-N 3.35Å; I298-T302 PolarHBondContact O-OG1 2.96Å; L299-T302 PolarHBondContact O-N 2.98Å; L299-T302 PolarHBondContact O-OG1 2.9Å; T302-A306 PolarHBondContact O-N 3.43Å; T302-A306 VanDerWaalsContact O-N 3.16Å; T302-I316 HydrophobicContact CG2-CG2 3.63Å; T302-F323 HydrophobicContact CG2-CD2 4.33Å; T302-F323 HydrophobicContact CG2-CE2 3.72Å; T302-F323 HydrophobicContact CG2-CZ 3.86Å
303	W	91.6	Very high	90.4	Very high	4 Å²	4	30.8 Å²	30.8	2%	0.015	17%	0.169	C	C	.	.	H	α-helix	trans	-66.6	-46.9	170.3	-179.1	73.8	0	0	0	112.7	L299 I301 L305 A306 A307 I382 G385 I386 L389 M410 I413	L299-W303 VanDerWaalsContact O-CB 3.23Å; L299-W303 WeakPolarHBondContact O-CB 3.45Å; L299-W303 PolarHBondContact O-N 3.43Å; I301-W303 VanDerWaalsContact C-N 3.29Å; I301-W303 PolarHBondContact O-N 2.83Å; W303-L305 PolarHBondContact O-N 3.18Å; W303-A306 PolarHBondContact O-N 2.97Å; W303-A307 WeakPolarHBondContact O-CB 3.43Å; W303-A307 PolarHBondContact O-N 2.68Å; W303-I382 WeakPolarHBondContact CZ3-O 3.14Å; W303-G385 VanDerWaalsContact CZ3-CA 3.47Å; W303-I386 HydrophobicContact CH2-CG1 4.02Å; W303-L389 HydrophobicContact CH2-CD1 4.18Å; W303-L389 HydrophobicContact CZ2-CD1 3.58Å; W303-M410 PolarHBondContact NE1-O 3.39Å; W303-I413 HydrophobicContact CB-CG2 3.97Å; W303-I413 HydrophobicContact CG-CB 4.46Å; W303-I413 HydrophobicContact CG-CG2 3.88Å
304	F	91.7	Very high	89.9	Confident	55 Å²	55	34.9 Å²	34.9	24%	0.241	19%	0.188	C	C	.	.	H	α-helix	trans	-60.4	-43.2	175.4	170.2	-107.4	0	0	0	112.1	T300 I301 A306 A307 G308 L381 A384	T300-F304 WeakPolarHBondContact O-CB 3.28Å; T300-F304 PolarHBondContact O-N 2.97Å; I301-F304 PolarHBondContact O-N 3.42Å; F304-A306 VanDerWaalsContact C-N 3.31Å; F304-A306 PolarHBondContact O-N 3.13Å; F304-A307 PolarHBondContact O-N 3.18Å; F304-G308 PolarHBondContact O-N 2.82Å; F304-L381 HydrophobicContact CB-CB 4.43Å; F304-L381 HydrophobicContact CB-CD2 4.09Å; F304-L381 HydrophobicContact CD1-CD2 3.83Å; F304-L381 HydrophobicContact CG-CD2 3.97Å; F304-A384 HydrophobicContact CD2-CB 3.91Å; F304-A384 HydrophobicContact CE2-CB 3.67Å; F304-A384 HydrophobicContact CZ-CB 4.49Å
305	L	90.5	Very high	89.5	Confident	26 Å²	26	35.3 Å²	35.3	14%	0.136	19%	0.194	C	C	.	.	H	α-helix	trans	-63.2	-35.3	177.7	-70.4	172.1	0	0	0	112.6	I301 W303 P309 K310 W311	I301-L305 HydrophobicContact CG2-CD1 3.82Å; I301-L305 HydrophobicContact CG2-CG 4.37Å; I301-L305 VanDerWaalsContact O-CG 3.3Å; I301-L305 WeakPolarHBondContact O-CG 3.5Å; I301-L305 PolarHBondContact O-N 3.43Å; W303-L305 PolarHBondContact O-N 3.18Å; L305-P309 HydrophobicContact CD2-CG 3.99Å; L305-P309 WeakPolarHBondContact O-CD 3.49Å; L305-P309 WeakPolarHBondContact O-CG 3.35Å; L305-K310 PolarHBondContact O-N 2.98Å; L305-W311 HydrophobicContact CB-CB 4.43Å; L305-W311 HydrophobicContact CB-CD2 4.24Å; L305-W311 HydrophobicContact CB-CE3 4.32Å; L305-W311 HydrophobicContact CB-CG 4.31Å; L305-W311 HydrophobicContact CD1-CE3 3.98Å; L305-W311 HydrophobicContact CD1-CH2 4.39Å; L305-W311 HydrophobicContact CD1-CZ3 3.9Å; L305-W311 HydrophobicContact CD2-CD2 4.13Å; L305-W311 HydrophobicContact CD2-CE3 4.35Å; L305-W311 HydrophobicContact CD2-CH2 4.26Å; L305-W311 HydrophobicContact CD2-CZ2 4.06Å; L305-W311 HydrophobicContact CD2-CZ3 4.41Å; L305-W311 HydrophobicContact CG-CE3 4.45Å; L305-W311 PolarHBondContact O-N 2.63Å
306	A	85.9	Confident	89.1	Confident	17 Å²	17	35.3 Å²	35.3	14%	0.14	19%	0.194	C	C	.	.	H	α-helix	trans	-70.4	-35.1	170.8	0	0	0	0	0	112.2	T302 W303 F304 K310 I316 M410	T302-A306 PolarHBondContact O-N 3.43Å; T302-A306 VanDerWaalsContact O-N 3.16Å; W303-A306 PolarHBondContact O-N 2.97Å; F304-A306 VanDerWaalsContact C-N 3.31Å; F304-A306 PolarHBondContact O-N 3.13Å; A306-K310 WeakPolarHBondContact O-CA 3.36Å; A306-I316 HydrophobicContact CB-CD1 4.39Å; A306-M410 HydrophobicContact CB-CE 4.1Å; A306-M410 WeakPolarHBondContact O-CE 3.26Å
307	A	84.3	Confident	88.8	Confident	3 Å²	3	38.5 Å²	38.5	3%	0.025	21%	0.209	C	C	.	.	H	α-helix	trans	-79.5	-50.9	-174.6	0	0	0	0	0	115	W303 F304 L389 M410	W303-A307 WeakPolarHBondContact O-CB 3.43Å; W303-A307 PolarHBondContact O-N 2.68Å; F304-A307 PolarHBondContact O-N 3.18Å; A307-L389 HydrophobicContact CB-CD2 4.39Å; A307-L389 HydrophobicContact CB-CG 4.08Å; A307-M410 VanDerWaalsContact CA-CE 3.45Å; A307-M410 HydrophobicContact CB-CE 4.11Å
308	G	82.8	Confident	88.6	Confident	24 Å²	24	45.9 Å²	45.9	25%	0.247	24%	0.239	C	C	.	.	S	Bend	trans	-83.3	-76.5	-175.5	0	0	0	0	0	112.8	F304 K310 S388	F304-G308 PolarHBondContact O-N 2.82Å; G308-K310 PolarHBondContact O-N 2.75Å; G308-S388 WeakPolarHBondContact CA-OG 3.45Å
309	P	83.3	Confident	88.5	Confident	66 Å²	66	50.3 Å²	50.3	43%	0.429	26%	0.259	S	S	.	.	S	Bend	trans	-77.8	7.5	-178.9	32.5	-34.4	0	0	0	113.9	L305 W311	L305-P309 HydrophobicContact CD2-CG 3.99Å; L305-P309 WeakPolarHBondContact O-CD 3.49Å; L305-P309 WeakPolarHBondContact O-CG 3.35Å; P309-W311 VanDerWaalsContact C-N 3.31Å; P309-W311 HydrophobicContact CG-CG 4.47Å; P309-W311 PolarHBondContact O-N 2.97Å
310	K	83.4	Confident	88.4	Confident	123 Å²	123	50.8 Å²	50.8	54%	0.535	26%	0.263	S	S	.	.			trans	53.9	40.1	173.4	-56.6	175.1	-173.4	170.2	0	114.1	L305 A306 G308 S312	L305-K310 PolarHBondContact O-N 2.98Å; A306-K310 WeakPolarHBondContact O-CA 3.36Å; G308-K310 PolarHBondContact O-N 2.75Å; K310-S312 PolarHBondContact O-N 3.37Å
311	W	84.8	Confident	88.4	Confident	97 Å²	97	55.8 Å²	55.8	37%	0.367	29%	0.294	S	S	.	.			trans	-63.3	136.4	179.6	-75.5	22.3	0	0	0	111.2	L305 P309 A315 I316 K319	L305-W311 HydrophobicContact CB-CB 4.43Å; L305-W311 HydrophobicContact CB-CD2 4.24Å; L305-W311 HydrophobicContact CB-CE3 4.32Å; L305-W311 HydrophobicContact CB-CG 4.31Å; L305-W311 HydrophobicContact CD1-CE3 3.98Å; L305-W311 HydrophobicContact CD1-CH2 4.39Å; L305-W311 HydrophobicContact CD1-CZ3 3.9Å; L305-W311 HydrophobicContact CD2-CD2 4.13Å; L305-W311 HydrophobicContact CD2-CE3 4.35Å; L305-W311 HydrophobicContact CD2-CH2 4.26Å; L305-W311 HydrophobicContact CD2-CZ2 4.06Å; L305-W311 HydrophobicContact CD2-CZ3 4.41Å; L305-W311 HydrophobicContact CG-CE3 4.45Å; L305-W311 PolarHBondContact O-N 2.63Å; P309-W311 VanDerWaalsContact C-N 3.31Å; P309-W311 HydrophobicContact CG-CG 4.47Å; P309-W311 PolarHBondContact O-N 2.97Å; W311-A315 HydrophobicContact CB-CB 4.32Å; W311-A315 HydrophobicContact CE3-CB 4.42Å; W311-I316 HydrophobicContact CB-CD1 4.33Å; W311-I316 HydrophobicContact CB-CG1 3.97Å; W311-I316 HydrophobicContact CE3-CG1 4.06Å; W311-K319 HydrophobicContact CZ3-CG 4.16Å
312	S	83.8	Confident	88.5	Confident	58 Å²	58	62.1 Å²	62.1	41%	0.406	31%	0.314	S	S	.	.			trans	-71.6	160.4	172.6	89.5	0	0	0	0	111.3	K310 E314 A315 I316	K310-S312 PolarHBondContact O-N 3.37Å; S312-E314 WeakPolarHBondContact CB-OE2 3.36Å; S312-E314 PolarHBondContact O-N 2.94Å; S312-E314 PolarHBondContact OG-N 2.67Å; S312-E314 PolarHBondContact OG-OE2 3.44Å; S312-A315 WeakPolarHBondContact O-CB 3.32Å; S312-A315 PolarHBondContact O-N 2.75Å; S312-A315 PolarHBondContact OG-N 3.24Å; S312-I316 PolarHBondContact O-N 3.37Å; S312-I316 VanDerWaalsContact O-N 3.1Å
313	C	83	Confident	88.7	Confident	48 Å²	48	63.2 Å²	63.2	32%	0.324	32%	0.319	S	S	.	.	H	α-helix	trans	-57.4	-36	178.6	-58.6	0	0	0	0	111.9	Y226 I316 E317	Y226-C313 WeakPolarHBondContact O-CB 3.41Å; Y226-C313 PolarHBondContact O-SG 3.38Å; Y226-C313 VanDerWaalsContact O-SG 3.4Å; C313-I316 PolarHBondContact O-N 3.05Å; C313-E317 WeakPolarHBondContact O-CB 3.41Å; C313-E317 PolarHBondContact O-N 2.97Å
314	E	86	Confident	88.9	Confident	100 Å²	100	65.1 Å²	65.1	47%	0.467	33%	0.328	S	S	.	.	H	α-helix	trans	-70	-34.1	177.3	-53.9	69.7	-150.2	0	0	112.1	S312 K318	S312-E314 WeakPolarHBondContact CB-OE2 3.36Å; S312-E314 PolarHBondContact O-N 2.94Å; S312-E314 PolarHBondContact OG-N 2.67Å; S312-E314 PolarHBondContact OG-OE2 3.44Å; E314-K318 VanDerWaalsContact O-CG 3.28Å; E314-K318 WeakPolarHBondContact O-CG 3.37Å; E314-K318 PolarHBondContact O-N 3.21Å
315	A	88.3	Confident	89.2	Confident	35 Å²	35	66.6 Å²	66.6	29%	0.289	34%	0.342	S	S	.	.	H	α-helix	trans	-69	-38.4	175.3	0	0	0	0	0	111.6	W311 S312	W311-A315 HydrophobicContact CB-CB 4.32Å; W311-A315 HydrophobicContact CE3-CB 4.42Å; S312-A315 WeakPolarHBondContact O-CB 3.32Å; S312-A315 PolarHBondContact O-N 2.75Å; S312-A315 PolarHBondContact OG-N 3.24Å
316	I	89.6	Confident	89.5	Confident	0 Å²	0	67 Å²	67	0%	0	35%	0.349	C	S	.	.	H	α-helix	trans	-69.3	-44	173.5	-60.5	172.9	0	0	0	110.5	Y226 P227 T302 A306 W311 S312 C313 K318 K319 F323	Y226-I316 HydrophobicContact CD1-CG2 3.89Å; Y226-I316 HydrophobicContact CG-CG2 4.03Å; P227-I316 HydrophobicContact CB-CD1 4.47Å; T302-I316 HydrophobicContact CG2-CG2 3.63Å; A306-I316 HydrophobicContact CB-CD1 4.39Å; W311-I316 HydrophobicContact CB-CD1 4.33Å; W311-I316 HydrophobicContact CB-CG1 3.97Å; W311-I316 HydrophobicContact CE3-CG1 4.06Å; S312-I316 PolarHBondContact O-N 3.37Å; S312-I316 VanDerWaalsContact O-N 3.1Å; C313-I316 PolarHBondContact O-N 3.05Å; I316-K318 VanDerWaalsContact C-N 3.3Å; I316-K318 PolarHBondContact O-N 3.07Å; I316-K319 PolarHBondContact O-N 3.19Å; I316-F323 HydrophobicContact CG2-CE2 3.94Å
317	E	89.5	Confident	90	Very high	70 Å²	70	66.2 Å²	66.2	33%	0.327	34%	0.342	S	S	.	.	H	α-helix	trans	-64.2	-32.4	-180	-172.9	149.9	-126.5	0	0	112.6	Y226 R229 C313 K319 A320	Y226-E317 HydrophobicContact CD2-CB 3.9Å; Y226-E317 HydrophobicContact CD2-CG 3.95Å; Y226-E317 HydrophobicContact CE2-CG 4.4Å; R229-E317 IonicContact NH1-OE1 3.19Å; R229-E317 PolarHBondContact NH1-OE1 3.43Å; C313-E317 WeakPolarHBondContact O-CB 3.41Å; C313-E317 PolarHBondContact O-N 2.97Å; E317-K319 PolarHBondContact O-N 2.87Å; E317-K319 VanDerWaalsContact O-N 3.09Å; E317-A320 WeakPolarHBondContact O-CB 3.28Å; E317-A320 PolarHBondContact O-N 2.83Å
318	K	91.8	Very high	90.7	Very high	176 Å²	176	70.1 Å²	70.1	77%	0.765	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-12.9	169.2	-77.3	172.1	-177	-178.5	0	114.6	E314 I316	E314-K318 VanDerWaalsContact O-CG 3.28Å; E314-K318 WeakPolarHBondContact O-CG 3.37Å; E314-K318 PolarHBondContact O-N 3.21Å; I316-K318 VanDerWaalsContact C-N 3.3Å; I316-K318 PolarHBondContact O-N 3.07Å
319	K	93.7	Very high	91.4	Very high	100 Å²	100	70.8 Å²	70.8	44%	0.435	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.2	1.5	174.4	-61.5	-60.2	-173.4	176.5	0	113.7	W311 I316 E317 V321 W322 F323	W311-K319 HydrophobicContact CZ3-CG 4.16Å; I316-K319 PolarHBondContact O-N 3.19Å; E317-K319 PolarHBondContact O-N 2.87Å; E317-K319 VanDerWaalsContact O-N 3.09Å; K319-V321 PolarHBondContact O-N 3.45Å; K319-V321 VanDerWaalsContact O-N 3.1Å; K319-W322 PolarHBondContact O-N 3.45Å; K319-F323 HydrophobicContact CB-CE2 4.04Å; K319-F323 HydrophobicContact CB-CZ 4.04Å; K319-F323 PolarHBondContact O-N 3.3Å
320	A	91.6	Very high	92.1	Very high	14 Å²	14	71.8 Å²	71.8	12%	0.116	37%	0.365	C	S	.	.	H	α-helix	trans	-52.3	-36.3	-176.4	0	0	0	0	0	114.7	Y226 E317 W322 F323 H324	Y226-A320 HydrophobicContact CD2-CB 4.47Å; Y226-A320 HydrophobicContact CE2-CB 3.51Å; E317-A320 WeakPolarHBondContact O-CB 3.28Å; E317-A320 PolarHBondContact O-N 2.83Å; A320-W322 PolarHBondContact O-N 2.86Å; A320-F323 PolarHBondContact O-N 3.44Å; A320-H324 PolarHBondContact O-CD2 2.81Å; A320-H324 VanDerWaalsContact O-CD2 3.22Å; A320-H324 PolarHBondContact O-N 3.38Å
321	V	94.7	Very high	92.8	Very high	106 Å²	106	66 Å²	66	64%	0.642	34%	0.339	S	S	*	.	H	α-helix	trans	-58.1	-48.1	178.1	-177.9	0	0	0	0	111	K319 F323 H324 T325	K319-V321 PolarHBondContact O-N 3.45Å; K319-V321 VanDerWaalsContact O-N 3.1Å; V321-F323 VanDerWaalsContact C-N 3.35Å; V321-F323 PolarHBondContact O-N 3.4Å; V321-H324 PolarHBondContact O-N 3.37Å; V321-H324 VanDerWaalsContact O-N 3.16Å; V321-T325 PolarHBondContact O-N 3.33Å; V321-T325 PolarHBondContact O-OG1 3.18Å; V321-T325 VanDerWaalsContact O-OG1 3.05Å
322	W	96.3	Very high	93.4	Very high	183 Å²	183	62.4 Å²	62.4	69%	0.693	33%	0.332	S	S	*	.	H	α-helix	trans	-64	-38.2	-180	-68.3	97.9	0	0	0	112.6	K319 A320 T325 A326	K319-W322 PolarHBondContact O-N 3.45Å; A320-W322 PolarHBondContact O-N 2.86Å; W322-T325 PolarHBondContact O-N 3.05Å; W322-A326 WeakPolarHBondContact O-CB 3.02Å; W322-A326 PolarHBondContact O-N 3.48Å
323	F	95.9	Very high	94.1	Very high	22 Å²	22	62.6 Å²	62.6	10%	0.096	34%	0.338	C	S	.	.	H	α-helix	trans	-62	-44.1	173.6	-58.2	-37.5	0	0	0	111.4	Y226 I298 I301 T302 I316 K319 A320 V321 A326 A327	Y226-F323 HydrophobicContact CE1-CD2 4.03Å; I298-F323 HydrophobicContact CD1-CB 4.11Å; I298-F323 WeakPolarHBondContact CD1-O 3.33Å; I298-F323 HydrophobicContact CG1-CB 4.47Å; I298-F323 HydrophobicContact CG1-CD1 4.4Å; I298-F323 HydrophobicContact CG2-CB 3.99Å; I298-F323 HydrophobicContact CG2-CD1 4.14Å; I298-F323 HydrophobicContact CG2-CD2 4.39Å; I298-F323 HydrophobicContact CG2-CG 3.93Å; I301-F323 HydrophobicContact CG2-CE1 4.28Å; T302-F323 HydrophobicContact CG2-CD2 4.33Å; T302-F323 HydrophobicContact CG2-CE2 3.72Å; T302-F323 HydrophobicContact CG2-CZ 3.86Å; I316-F323 HydrophobicContact CG2-CE2 3.94Å; K319-F323 HydrophobicContact CB-CE2 4.04Å; K319-F323 HydrophobicContact CB-CZ 4.04Å; K319-F323 PolarHBondContact O-N 3.3Å; A320-F323 PolarHBondContact O-N 3.44Å; V321-F323 VanDerWaalsContact C-N 3.35Å; V321-F323 PolarHBondContact O-N 3.4Å; F323-A326 PolarHBondContact O-N 3.46Å; F323-A327 WeakPolarHBondContact O-CB 3.05Å; F323-A327 PolarHBondContact O-N 2.83Å
324	H	96.1	Very high	94.8	Very high	45 Å²	45	61.8 Å²	61.8	21%	0.208	33%	0.33	C	S	.	.	H	α-helix	trans	-65.9	-42.8	175.9	-80.9	-64	0	0	0	113.3	F233 W295 A320 V321 A326 A327 W328	F233-H324 AromaticContact CD2-CE1 3.8Å; F233-H324 AromaticContact CE1-CE1 3.82Å; F233-H324 AromaticContact CE2-CE1 3.32Å; F233-H324 WeakPolarHBondContact CE2-CE1 3.49Å; F233-H324 AromaticContact CE2-NE2 3.61Å; F233-H324 AromaticContact CZ-CE1 3.35Å; F233-H324 WeakPolarHBondContact CZ-CE1 3.19Å; F233-H324 AromaticContact CZ-NE2 3.68Å; W295-H324 AromaticContact CH2-CE1 3.44Å; W295-H324 VanDerWaalsContact CH2-CE1 3.44Å; W295-H324 WeakPolarHBondContact CH2-CE1 3.4Å; W295-H324 AromaticContact CH2-ND1 3.41Å; W295-H324 WeakPolarHBondContact CH2-ND1 3.39Å; W295-H324 AromaticContact CZ2-CE1 3.69Å; W295-H324 AromaticContact CZ2-ND1 3.44Å; W295-H324 WeakPolarHBondContact CZ2-ND1 3.04Å; A320-H324 PolarHBondContact O-CD2 2.81Å; A320-H324 VanDerWaalsContact O-CD2 3.22Å; A320-H324 PolarHBondContact O-N 3.38Å; V321-H324 PolarHBondContact O-N 3.37Å; V321-H324 VanDerWaalsContact O-N 3.16Å; H324-A326 VanDerWaalsContact C-N 3.34Å; H324-A326 PolarHBondContact O-N 2.97Å; H324-A327 PolarHBondContact O-N 3.2Å; H324-W328 AromaticContact ND1-NE1 3.46Å; H324-W328 PolarHBondContact ND1-NE1 3.38Å; H324-W328 VanDerWaalsContact O-CD1 3.22Å; H324-W328 PolarHBondContact O-N 2.86Å; H324-W328 VanDerWaalsContact O-N 3.14Å
325	T	97.4	Very high	95.3	Very high	86 Å²	86	57.5 Å²	57.5	53%	0.528	31%	0.311	S	S	.	.	H	α-helix	trans	-60.4	-43.4	176.6	-56.6	0	0	0	0	111.3	V321 W322 G329	V321-T325 PolarHBondContact O-N 3.33Å; V321-T325 PolarHBondContact O-OG1 3.18Å; V321-T325 VanDerWaalsContact O-OG1 3.05Å; W322-T325 PolarHBondContact O-N 3.05Å; T325-G329 VanDerWaalsContact O-CA 3.28Å; T325-G329 WeakPolarHBondContact O-CA 3.17Å; T325-G329 PolarHBondContact O-N 3.24Å
326	A	97.1	Very high	95.7	Very high	35 Å²	35	60.4 Å²	60.4	29%	0.289	32%	0.324	S	S	.	.	H	α-helix	trans	-67.5	-47.9	176.1	0	0	0	0	0	112.4	W322 F323 H324 W328 I330	W322-A326 WeakPolarHBondContact O-CB 3.02Å; W322-A326 PolarHBondContact O-N 3.48Å; F323-A326 PolarHBondContact O-N 3.46Å; H324-A326 VanDerWaalsContact C-N 3.34Å; H324-A326 PolarHBondContact O-N 2.97Å; A326-W328 VanDerWaalsContact C-N 3.31Å; A326-W328 PolarHBondContact O-N 2.9Å; A326-I330 HydrophobicContact CB-CD1 4.3Å; A326-I330 WeakPolarHBondContact O-CB 3.34Å; A326-I330 WeakPolarHBondContact O-CG1 3.43Å; A326-I330 PolarHBondContact O-N 2.97Å; A326-I330 VanDerWaalsContact O-N 3.11Å
327	A	97.1	Very high	96.1	Very high	0 Å²	0	64.7 Å²	64.7	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-64.8	-28.9	-174.1	0	0	0	0	0	114.8	V294 W295 I298 F323 H324 P331	V294-A327 HydrophobicContact CG1-CB 4.28Å; W295-A327 HydrophobicContact CD2-CB 3.85Å; W295-A327 HydrophobicContact CE3-CB 4.39Å; W295-A327 HydrophobicContact CG-CB 4.33Å; W295-A327 HydrophobicContact CH2-CB 4.06Å; W295-A327 HydrophobicContact CZ2-CB 3.46Å; W295-A327 VanDerWaalsContact CZ2-CB 3.46Å; W295-A327 HydrophobicContact CZ3-CB 4.49Å; I298-A327 HydrophobicContact CD1-CB 3.73Å; F323-A327 WeakPolarHBondContact O-CB 3.05Å; F323-A327 PolarHBondContact O-N 2.83Å; H324-A327 PolarHBondContact O-N 3.2Å; A327-P331 VanDerWaalsContact O-CD 3.29Å; A327-P331 WeakPolarHBondContact O-CD 3.41Å; A327-P331 VanDerWaalsContact O-CG 3.29Å; A327-P331 WeakPolarHBondContact O-CG 3.46Å
328	W	97.9	Very high	96.4	Very high	84 Å²	84	61.4 Å²	61.4	32%	0.318	33%	0.33	S	S	.	.	H	α-helix	trans	-103.7	-32.5	177.4	-52.1	133.9	0	0	0	112.7	F233 F287 A291 W295 H324 A326 G332	F233-W328 HydrophobicContact CB-CH2 4.42Å; F233-W328 HydrophobicContact CB-CZ2 4.35Å; F233-W328 HydrophobicContact CD1-CZ2 4.4Å; F287-W328 HydrophobicContact CE1-CE3 4.08Å; F287-W328 HydrophobicContact CE1-CZ3 4.36Å; F287-W328 HydrophobicContact CZ-CB 4.5Å; F287-W328 AromaticContact CZ-CE3 3.91Å; F287-W328 HydrophobicContact CZ-CE3 3.91Å; A291-W328 HydrophobicContact CB-CE3 3.93Å; A291-W328 HydrophobicContact CB-CZ3 3.7Å; W295-W328 AromaticContact CE2-CZ2 3.92Å; W295-W328 AromaticContact CZ2-CE2 3.99Å; W295-W328 HydrophobicContact CZ2-CH2 4.46Å; W295-W328 AromaticContact CZ2-CZ2 3.83Å; W295-W328 HydrophobicContact CZ2-CZ2 3.83Å; W295-W328 AromaticContact NE1-CE2 3.96Å; W295-W328 AromaticContact NE1-CH2 3.16Å; W295-W328 AromaticContact NE1-CZ2 3.43Å; W295-W328 AromaticContact NE1-CZ3 3.48Å; H324-W328 AromaticContact ND1-NE1 3.46Å; H324-W328 PolarHBondContact ND1-NE1 3.38Å; H324-W328 VanDerWaalsContact O-CD1 3.22Å; H324-W328 PolarHBondContact O-N 2.86Å; H324-W328 VanDerWaalsContact O-N 3.14Å; A326-W328 VanDerWaalsContact C-N 3.31Å; A326-W328 PolarHBondContact O-N 2.9Å; W328-G332 PolarHBondContact O-N 3.46Å; W328-G332 VanDerWaalsContact O-N 3.11Å
329	G	97.9	Very high	96.5	Very high	39 Å²	39	55 Å²	55	40%	0.402	30%	0.304	S	S	.	.	H	α-helix	trans	-70.6	-42.9	-179.1	0	0	0	0	0	113.7	T325 G332 A333	T325-G329 VanDerWaalsContact O-CA 3.28Å; T325-G329 WeakPolarHBondContact O-CA 3.17Å; T325-G329 PolarHBondContact O-N 3.24Å; G329-G332 PolarHBondContact O-N 2.87Å; G329-A333 WeakPolarHBondContact O-CB 3.34Å; G329-A333 PolarHBondContact O-N 2.95Å
330	I	97.4	Very high	96.6	Very high	87 Å²	87	54.4 Å²	54.4	45%	0.446	32%	0.318	S	S	.	.	H	α-helix	trans	-65	-50.9	-179.6	-64.3	168.4	0	0	0	111	A326 G332 A333 L334	A326-I330 HydrophobicContact CB-CD1 4.3Å; A326-I330 WeakPolarHBondContact O-CB 3.34Å; A326-I330 WeakPolarHBondContact O-CG1 3.43Å; A326-I330 PolarHBondContact O-N 2.97Å; A326-I330 VanDerWaalsContact O-N 3.11Å; I330-G332 VanDerWaalsContact C-N 3.34Å; I330-G332 PolarHBondContact O-N 3.43Å; I330-A333 PolarHBondContact O-N 2.96Å; I330-L334 HydrophobicContact CG2-CD1 4.11Å; I330-L334 WeakPolarHBondContact O-CG 3.33Å; I330-L334 PolarHBondContact O-N 2.93Å; I330-L334 VanDerWaalsContact O-N 3.07Å
331	P	98.2	Very high	96.6	Very high	0 Å²	0	58.1 Å²	58.1	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-62.4	-38.3	175.1	-24.8	36.8	0	0	0	113.3	F287 M290 A291 A327 L334 T335	F287-P331 HydrophobicContact CD2-CB 3.7Å; F287-P331 HydrophobicContact CE2-CB 3.93Å; F287-P331 HydrophobicContact CG-CB 4.31Å; F287-P331 WeakPolarHBondContact O-CB 3.44Å; M290-P331 HydrophobicContact CB-CB 3.9Å; M290-P331 HydrophobicContact CB-CG 4.03Å; A291-P331 VanDerWaalsContact CA-CG 3.5Å; A291-P331 HydrophobicContact CB-CB 4.36Å; A291-P331 HydrophobicContact CB-CG 3.83Å; A291-P331 VanDerWaalsContact N-CG 3.33Å; A327-P331 VanDerWaalsContact O-CD 3.29Å; A327-P331 WeakPolarHBondContact O-CD 3.41Å; A327-P331 VanDerWaalsContact O-CG 3.29Å; A327-P331 WeakPolarHBondContact O-CG 3.46Å; P331-L334 PolarHBondContact O-N 3.23Å; P331-T335 WeakPolarHBondContact O-CB 3.21Å; P331-T335 PolarHBondContact O-N 3.46Å; P331-T335 PolarHBondContact O-OG1 3.43Å
332	G	97.9	Very high	96.5	Very high	22 Å²	22	55 Å²	55	23%	0.227	32%	0.315	C	S	.	.	H	α-helix	trans	-60.9	-47.9	177.4	0	0	0	0	0	112.2	W328 G329 I330 T335 V336	W328-G332 PolarHBondContact O-N 3.46Å; W328-G332 VanDerWaalsContact O-N 3.11Å; G329-G332 PolarHBondContact O-N 2.87Å; I330-G332 VanDerWaalsContact C-N 3.34Å; I330-G332 PolarHBondContact O-N 3.43Å; G332-T335 PolarHBondContact O-N 3.17Å; G332-V336 WeakPolarHBondContact O-CG2 3.18Å; G332-V336 PolarHBondContact O-N 2.86Å
333	A	98	Very high	96.3	Very high	63 Å²	63	50 Å²	50	52%	0.521	30%	0.298	S	S	.	.	H	α-helix	trans	-62.4	-43.9	176.8	0	0	0	0	0	112.4	G329 I330 V336 M337	G329-A333 WeakPolarHBondContact O-CB 3.34Å; G329-A333 PolarHBondContact O-N 2.95Å; I330-A333 PolarHBondContact O-N 2.96Å; A333-V336 PolarHBondContact O-N 3.11Å; A333-M337 WeakPolarHBondContact O-CB 3.4Å; A333-M337 PolarHBondContact O-N 3.14Å
334	L	97.3	Very high	96.3	Very high	31 Å²	31	49 Å²	49	16%	0.162	29%	0.294	C	S	.	.	H	α-helix	trans	-63.9	-41.3	176.9	-68.5	173.5	0	0	0	112.2	Y286 I330 P331 M337 L338 F366 P370	Y286-L334 HydrophobicContact CE1-CB 3.8Å; I330-L334 HydrophobicContact CG2-CD1 4.11Å; I330-L334 WeakPolarHBondContact O-CG 3.33Å; I330-L334 PolarHBondContact O-N 2.93Å; I330-L334 VanDerWaalsContact O-N 3.07Å; P331-L334 PolarHBondContact O-N 3.23Å; L334-M337 HydrophobicContact CD2-CE 3.96Å; L334-M337 PolarHBondContact O-N 3.11Å; L334-L338 WeakPolarHBondContact O-CG 3.24Å; L334-L338 PolarHBondContact O-N 3.33Å; L334-F366 HydrophobicContact CD2-CD1 4.45Å; L334-P370 HydrophobicContact CD1-CG 4.4Å
335	T	97.5	Very high	96.2	Very high	10 Å²	10	47.4 Å²	47.4	6%	0.061	29%	0.286	C	S	.	.	H	α-helix	trans	-63.4	-46.9	176.9	-51.2	0	0	0	0	111	F282 M283 P331 G332 M337 L338 L339	F282-T335 HydrophobicContact CE1-CG2 4.35Å; M283-T335 HydrophobicContact CB-CG2 4.22Å; M283-T335 HydrophobicContact CG-CG2 3.99Å; P331-T335 WeakPolarHBondContact O-CB 3.21Å; P331-T335 PolarHBondContact O-N 3.46Å; P331-T335 PolarHBondContact O-OG1 3.43Å; G332-T335 PolarHBondContact O-N 3.17Å; T335-M337 VanDerWaalsContact C-N 3.33Å; T335-M337 PolarHBondContact O-N 3.28Å; T335-L338 PolarHBondContact O-N 2.66Å; T335-L339 HydrophobicContact CG2-CD1 4.49Å; T335-L339 WeakPolarHBondContact O-CG 3.4Å; T335-L339 PolarHBondContact O-N 3.37Å; T335-L339 VanDerWaalsContact O-N 3.09Å
336	V	97.4	Very high	96.2	Very high	95 Å²	95	43.3 Å²	43.3	58%	0.576	26%	0.261	S	S	*	.	H	α-helix	trans	-62.9	-39.1	177.5	170.9	0	0	0	0	111.5	G332 A333 L339 A340	G332-V336 WeakPolarHBondContact O-CG2 3.18Å; G332-V336 PolarHBondContact O-N 2.86Å; A333-V336 PolarHBondContact O-N 3.11Å; V336-L339 PolarHBondContact O-N 3.03Å; V336-A340 WeakPolarHBondContact O-CB 3.3Å; V336-A340 PolarHBondContact O-N 3.29Å
337	M	96.3	Very high	96.1	Very high	91 Å²	91	41.9 Å²	41.9	45%	0.448	25%	0.249	S	C	.	.	H	α-helix	trans	-63.8	-41	176.5	-173.7	158.3	69.1	0	0	112.2	A333 L334 T335 A340 L341 F366	A333-M337 WeakPolarHBondContact O-CB 3.4Å; A333-M337 PolarHBondContact O-N 3.14Å; L334-M337 HydrophobicContact CD2-CE 3.96Å; L334-M337 PolarHBondContact O-N 3.11Å; T335-M337 VanDerWaalsContact C-N 3.33Å; T335-M337 PolarHBondContact O-N 3.28Å; M337-A340 PolarHBondContact O-N 3.18Å; M337-L341 HydrophobicContact CG-CD1 3.92Å; M337-L341 WeakPolarHBondContact O-CB 3.49Å; M337-L341 VanDerWaalsContact O-CG 3.26Å; M337-L341 WeakPolarHBondContact O-CG 3.22Å; M337-L341 PolarHBondContact O-N 3.03Å; M337-F366 HydrophobicContact CB-CE1 4.26Å; M337-F366 HydrophobicContact CE-CD1 4.3Å; M337-F366 HydrophobicContact CE-CE1 3.37Å; M337-F366 HydrophobicContact CE-CZ 3.77Å; M337-F366 HydrophobicContact CG-CE1 3.91Å; M337-F366 HydrophobicContact CG-CZ 4.12Å; M337-F366 HydrophobicContact SD-CE1 4.36Å; M337-F366 HydrophobicContact SD-CZ 4.46Å
338	L	96	Very high	95.9	Very high	0 Å²	0	42 Å²	42	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-66.5	-37.9	176.2	-76.2	172.8	0	0	0	113.4	F282 Y286 L334 T335 L341 N342 K343 V355 F366	F282-L338 HydrophobicContact CE1-CB 4.32Å; F282-L338 HydrophobicContact CE2-CD1 4.09Å; F282-L338 HydrophobicContact CZ-CB 3.71Å; F282-L338 HydrophobicContact CZ-CD1 3.69Å; F282-L338 HydrophobicContact CZ-CG 4.34Å; Y286-L338 HydrophobicContact CD1-CD1 4.07Å; Y286-L338 HydrophobicContact CD2-CD1 4.14Å; Y286-L338 HydrophobicContact CE1-CD1 3.66Å; Y286-L338 HydrophobicContact CE2-CD1 3.73Å; Y286-L338 HydrophobicContact CG-CD1 4.3Å; Y286-L338 VanDerWaalsContact CZ-CD1 3.48Å; L334-L338 WeakPolarHBondContact O-CG 3.24Å; L334-L338 PolarHBondContact O-N 3.33Å; T335-L338 PolarHBondContact O-N 2.66Å; L338-L341 PolarHBondContact O-N 3.37Å; L338-N342 PolarHBondContact O-N 3.44Å; L338-N342 VanDerWaalsContact O-N 3.12Å; L338-K343 HydrophobicContact CD2-CB 3.74Å; L338-K343 PolarHBondContact O-N 2.98Å; L338-V355 HydrophobicContact CD1-CB 4.3Å; L338-V355 HydrophobicContact CD1-CG1 3.9Å; L338-V355 HydrophobicContact CD1-CG2 4.19Å; L338-V355 HydrophobicContact CD2-CG2 3.77Å; L338-F366 HydrophobicContact CD1-CB 4.17Å; L338-F366 HydrophobicContact CD1-CD1 3.84Å; L338-F366 HydrophobicContact CD1-CG 4.24Å; L338-F366 HydrophobicContact CD2-CB 4.07Å; L338-F366 HydrophobicContact CD2-CD1 3.35Å; L338-F366 HydrophobicContact CD2-CD2 3.88Å; L338-F366 HydrophobicContact CD2-CE1 3.57Å; L338-F366 HydrophobicContact CD2-CE2 4.1Å; L338-F366 HydrophobicContact CD2-CG 3.5Å; L338-F366 HydrophobicContact CD2-CZ 3.95Å; L338-F366 HydrophobicContact CG-CB 4.46Å; L338-F366 HydrophobicContact CG-CD1 3.4Å; L338-F366 HydrophobicContact CG-CE1 3.66Å; L338-F366 HydrophobicContact CG-CG 4.01Å; L338-F366 HydrophobicContact CG-CZ 4.5Å
339	L	95.4	Very high	95.8	Very high	43 Å²	43	38.3 Å²	38.3	23%	0.225	24%	0.236	C	C	.	.	H	α-helix	trans	-63.9	-45.8	172.8	-65.3	170.4	0	0	0	111.2	T279 F282 M283 T335 V336 L341 N342 V344	T279-L339 HydrophobicContact CG2-CD2 3.48Å; T279-L339 VanDerWaalsContact CG2-CD2 3.48Å; F282-L339 HydrophobicContact CD1-CD2 4.15Å; F282-L339 HydrophobicContact CE1-CD2 3.94Å; F282-L339 HydrophobicContact CE1-CG 4.3Å; M283-L339 HydrophobicContact CG-CD1 3.91Å; M283-L339 HydrophobicContact CG-CD2 4.07Å; M283-L339 HydrophobicContact CG-CG 4.42Å; M283-L339 HydrophobicContact SD-CD1 3.67Å; M283-L339 HydrophobicContact SD-CD2 4.42Å; T335-L339 HydrophobicContact CG2-CD1 4.49Å; T335-L339 WeakPolarHBondContact O-CG 3.4Å; T335-L339 PolarHBondContact O-N 3.37Å; T335-L339 VanDerWaalsContact O-N 3.09Å; V336-L339 PolarHBondContact O-N 3.03Å; L339-L341 VanDerWaalsContact C-N 3.27Å; L339-L341 PolarHBondContact O-N 2.93Å; L339-N342 PolarHBondContact O-N 2.98Å; L339-V344 HydrophobicContact CD2-CG2 4.19Å
340	A	94.1	Very high	95.7	Very high	87 Å²	87	36.6 Å²	36.6	72%	0.719	22%	0.218	S	C	*	.	H	α-helix	trans	-64.3	-30.4	178.6	0	0	0	0	0	113.2	V336 M337 N342	V336-A340 WeakPolarHBondContact O-CB 3.3Å; V336-A340 PolarHBondContact O-N 3.29Å; M337-A340 PolarHBondContact O-N 3.18Å; A340-N342 VanDerWaalsContact C-N 3.33Å
341	L	92.4	Very high	95.5	Very high	92 Å²	92	32.5 Å²	32.5	48%	0.482	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.4	1.2	174.1	-65.2	170.5	0	0	0	113.5	M337 L338 L339 K343 F366	M337-L341 HydrophobicContact CG-CD1 3.92Å; M337-L341 WeakPolarHBondContact O-CB 3.49Å; M337-L341 VanDerWaalsContact O-CG 3.26Å; M337-L341 WeakPolarHBondContact O-CG 3.22Å; M337-L341 PolarHBondContact O-N 3.03Å; L338-L341 PolarHBondContact O-N 3.37Å; L339-L341 VanDerWaalsContact C-N 3.27Å; L339-L341 PolarHBondContact O-N 2.93Å; L341-K343 HydrophobicContact CB-CG 3.85Å; L341-K343 WeakPolarHBondContact O-CG 3.5Å; L341-K343 PolarHBondContact O-N 3.44Å; L341-F366 HydrophobicContact CD1-CE2 4.34Å; L341-F366 HydrophobicContact CD1-CZ 3.65Å
342	N	92.1	Very high	95.4	Very high	40 Å²	40	32.5 Å²	32.5	21%	0.214	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.6	25.9	-177	-156.2	38.6	0	0	0	114.5	H168 G272 S273 H274 L338 L339 A340 V344	H168-N342 PolarHBondContact O-ND2 3.41Å; H168-N342 VanDerWaalsContact O-ND2 3.1Å; G272-N342 WeakPolarHBondContact CA-O 3.37Å; G272-N342 WeakPolarHBondContact CA-OD1 3.25Å; S273-N342 PolarHBondContact N-OD1 2.87Å; S273-N342 PolarHBondContact OG-OD1 2.9Å; S273-N342 VanDerWaalsContact OG-OD1 3.06Å; H274-N342 PolarHBondContact NE2-ND2 3.04Å; L338-N342 PolarHBondContact O-N 3.44Å; L338-N342 VanDerWaalsContact O-N 3.12Å; L339-N342 PolarHBondContact O-N 2.98Å; A340-N342 VanDerWaalsContact C-N 3.33Å; N342-V344 PolarHBondContact O-N 3.36Å; N342-V344 VanDerWaalsContact O-N 3.16Å
343	K	93.1	Very high	95.4	Very high	79 Å²	79	31.4 Å²	31.4	34%	0.343	19%	0.186	S	C	.	.			trans	-91	64.5	-175.4	-62.6	-60.3	-179.8	173	0	111.9	L338 L341 V355 D359	L338-K343 HydrophobicContact CD2-CB 3.74Å; L338-K343 PolarHBondContact O-N 2.98Å; L341-K343 HydrophobicContact CB-CG 3.85Å; L341-K343 WeakPolarHBondContact O-CG 3.5Å; L341-K343 PolarHBondContact O-N 3.44Å; K343-V355 HydrophobicContact CB-CG2 4.49Å; K343-D359 WeakPolarHBondContact CD-OD2 3.46Å; K343-D359 WeakPolarHBondContact CE-OD2 3.49Å; K343-D359 IonicContact NZ-OD2 2.87Å; K343-D359 PolarHBondContact NZ-OD2 2.71Å
344	V	95.1	Very high	95.3	Very high	1 Å²	1	29 Å²	29	1%	0.006	16%	0.164	C	C	.	.			trans	-118.5	132.7	175.3	-177.5	0	0	0	0	108.8	G272 F282 L339 N342 C353	G272-V344 PolarHBondContact N-O 2.88Å; F282-V344 HydrophobicContact CB-CG1 3.79Å; F282-V344 HydrophobicContact CD1-CB 4.46Å; F282-V344 HydrophobicContact CD1-CG1 4.08Å; F282-V344 HydrophobicContact CD1-CG2 3.61Å; F282-V344 HydrophobicContact CD2-CG1 4.34Å; F282-V344 HydrophobicContact CE1-CG2 3.74Å; F282-V344 HydrophobicContact CG-CB 4.48Å; F282-V344 HydrophobicContact CG-CG1 3.78Å; F282-V344 HydrophobicContact CG-CG2 4.08Å; F282-V344 HydrophobicContact CZ-CG2 4.3Å; L339-V344 HydrophobicContact CD2-CG2 4.19Å; N342-V344 PolarHBondContact O-N 3.36Å; N342-V344 VanDerWaalsContact O-N 3.16Å; V344-C353 HydrophobicContact CG1-CB 4.28Å
345	E	95.2	Very high	95.3	Very high	10 Å²	10	27.6 Å²	27.6	5%	0.047	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	139.2	-171.7	-61.3	168.8	118.1	0	0	111.7	V270 L271 C353 F354 V355 G356 L357 Y358 D359	V270-E345 CarbonylContact O-C 3.52Å; L271-E345 HydrophobicContact CD2-CB 4.38Å; L271-E345 HydrophobicContact CD2-CG 4.02Å; E345-C353 CarbonylContact O-C 3.58Å; E345-C353 WeakPolarHBondContact O-CA 3.01Å; E345-C353 WeakPolarHBondContact O-CB 3.33Å; E345-F354 PolarHBondContact N-O 3.21Å; E345-F354 PolarHBondContact O-N 3.41Å; E345-V355 VanDerWaalsContact OE2-C 3.31Å; E345-V355 VanDerWaalsContact OE2-CA 3.32Å; E345-V355 WeakPolarHBondContact OE2-CA 3.23Å; E345-G356 PolarHBondContact OE2-N 3.09Å; E345-L357 HydrophobicContact CB-CB 4.07Å; E345-L357 HydrophobicContact CB-CD1 3.95Å; E345-L357 HydrophobicContact CB-CG 4.31Å; E345-L357 PolarHBondContact OE2-N 3.44Å; E345-Y358 HydrophobicContact CB-CD2 4.25Å; E345-Y358 HydrophobicContact CG-CD2 4.37Å; E345-Y358 WeakPolarHBondContact OE1-CA 3.46Å; E345-Y358 WeakPolarHBondContact OE1-CB 3.24Å; E345-Y358 PolarHBondContact OE1-N 3.47Å; E345-D359 PolarHBondContact OE1-N 2.79Å
346	G	95.8	Very high	95.1	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	128.5	176.6	0	0	0	0	0	114.2	V270	V270-G346 PolarHBondContact O-N 2.97Å
347	D	95.9	Very high	94.9	Very high	6 Å²	6	24 Å²	24	3%	0.032	13%	0.134	C	C	.	.			trans	-94.9	98.3	172.7	-174.7	-13.7	0	0	0	110.2	I349 S350 G351 V352 L357 Y476	D347-I349 PolarHBondContact O-N 2.84Å; D347-I349 WeakPolarHBondContact OD1-CA 3.44Å; D347-I349 VanDerWaalsContact OD1-CB 3.24Å; D347-I349 WeakPolarHBondContact OD1-CB 3.46Å; D347-I349 PolarHBondContact OD1-N 2.87Å; D347-S350 PolarHBondContact O-N 3.29Å; D347-S350 PolarHBondContact OD1-N 3.31Å; D347-S350 WeakPolarHBondContact OD2-CB 3.11Å; D347-S350 PolarHBondContact OD2-OG 2.04Å; D347-G351 WeakPolarHBondContact O-CA 3.39Å; D347-G351 PolarHBondContact O-N 3.42Å; D347-V352 WeakPolarHBondContact CB-O 3.38Å; D347-V352 PolarHBondContact N-O 3.33Å; D347-L357 HydrophobicContact CB-CD1 3.77Å; D347-Y476 PolarHBondContact OD1-OH 3.15Å; D347-Y476 PolarHBondContact OD2-OH 3.39Å
348	N	93.7	Very high	94.7	Very high	2 Å²	2	21.1 Å²	21.1	1%	0.011	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-7.6	176.8	60.1	16.1	0	0	0	114.1	C182 N184 K196 N253 V269	C182-N348 WeakPolarHBondContact O-CB 3.39Å; C182-N348 PolarHBondContact O-ND2 2.82Å; N184-N348 PolarHBondContact ND2-OD1 2.97Å; K196-N348 WeakPolarHBondContact CE-O 3.48Å; K196-N348 PolarHBondContact NZ-O 3.26Å; N253-N348 PolarHBondContact OD1-O 3.14Å; V269-N348 HydrophobicContact CG1-CB 4.33Å
349	I	94.9	Very high	94.5	Very high	7 Å²	7	22.9 Å²	22.9	4%	0.036	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-47.5	171.5	-47.1	-180	0	0	0	109.7	F187 I192 A195 K196 I199 D347 F472 Y476	F187-I349 HydrophobicContact CD2-CD1 4.3Å; F187-I349 HydrophobicContact CE2-CD1 4.16Å; I192-I349 HydrophobicContact CD1-CB 4.3Å; I192-I349 HydrophobicContact CD1-CG1 3.87Å; I192-I349 HydrophobicContact CD1-CG2 4.18Å; A195-I349 HydrophobicContact CB-CG2 3.78Å; K196-I349 WeakPolarHBondContact CE-O 3.42Å; K196-I349 WeakPolarHBondContact CG-O 3.48Å; I199-I349 HydrophobicContact CD1-CG2 4.42Å; D347-I349 PolarHBondContact O-N 2.84Å; D347-I349 WeakPolarHBondContact OD1-CA 3.44Å; D347-I349 VanDerWaalsContact OD1-CB 3.24Å; D347-I349 WeakPolarHBondContact OD1-CB 3.46Å; D347-I349 PolarHBondContact OD1-N 2.87Å; I349-F472 HydrophobicContact CD1-CD1 3.61Å; I349-F472 HydrophobicContact CD1-CE1 4.05Å; I349-F472 HydrophobicContact CD1-CG 4.4Å; I349-Y476 HydrophobicContact CG2-CE2 4.14Å
350	S	95.3	Very high	94.3	Very high	3 Å²	3	22.5 Å²	22.5	2%	0.021	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103	-8.9	-174.4	73.7	0	0	0	0	115.9	D347 V352	D347-S350 PolarHBondContact O-N 3.29Å; D347-S350 PolarHBondContact OD1-N 3.31Å; D347-S350 WeakPolarHBondContact OD2-CB 3.11Å; D347-S350 PolarHBondContact OD2-OG 2.04Å; S350-V352 VanDerWaalsContact C-N 3.32Å; S350-V352 PolarHBondContact O-N 3.14Å; S350-V352 WeakPolarHBondContact OG-CG2 3.41Å
351	G	94.1	Very high	94.2	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	11%	0.112	C	C	.	.	S	Bend	trans	79.8	6.7	176.7	0	0	0	0	0	115.1	D347	D347-G351 WeakPolarHBondContact O-CA 3.39Å; D347-G351 PolarHBondContact O-N 3.42Å
352	V	96.5	Very high	94.3	Very high	0 Å²	0	18 Å²	18	0%	0	9%	0.091	C	C	.	.	S	Bend	trans	-111.8	-168	176.1	-51.6	0	0	0	0	110.5	I244 Y245 A256 L281 L285 D347 S350	I244-V352 HydrophobicContact CG2-CB 4.42Å; I244-V352 HydrophobicContact CG2-CG1 4.01Å; I244-V352 WeakPolarHBondContact O-CG1 3.42Å; Y245-V352 HydrophobicContact CD1-CG1 4.48Å; Y245-V352 HydrophobicContact CD1-CG2 4.26Å; Y245-V352 HydrophobicContact CE1-CG2 4Å; A256-V352 WeakPolarHBondContact CB-O 3.31Å; L281-V352 HydrophobicContact CB-CB 4.43Å; L281-V352 HydrophobicContact CD1-CB 4.35Å; L281-V352 HydrophobicContact CD1-CG1 4.42Å; L285-V352 HydrophobicContact CD2-CB 4.43Å; L285-V352 HydrophobicContact CD2-CG2 3.53Å; D347-V352 WeakPolarHBondContact CB-O 3.38Å; D347-V352 PolarHBondContact N-O 3.33Å; S350-V352 VanDerWaalsContact C-N 3.32Å; S350-V352 PolarHBondContact O-N 3.14Å; S350-V352 WeakPolarHBondContact OG-CG2 3.41Å
353	C	97	Very high	94.4	Very high	0 Å²	0	16.1 Å²	16.1	0%	0	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	146.8	171.5	-65.9	0	0	0	0	111.3	C278 F282 V344 E345	C278-C353 WeakPolarHBondContact CA-SG 3.41Å; C278-C353 HydrophobicContact CB-CB 4.13Å; C278-C353 WeakPolarHBondContact CB-SG 3.34Å; C278-C353 WeakPolarHBondContact O-CB 3.42Å; C278-C353 WeakPolarHBondContact SG-CB 3.24Å; C278-C353 CovalentContact SG-SG 2.02Å; C278-C353 PolarHBondContact SG-SG 2.89Å; F282-C353 WeakPolarHBondContact CA-O 3.34Å; F282-C353 HydrophobicContact CB-CB 3.95Å; V344-C353 HydrophobicContact CG1-CB 4.28Å; E345-C353 CarbonylContact O-C 3.58Å; E345-C353 WeakPolarHBondContact O-CA 3.01Å; E345-C353 WeakPolarHBondContact O-CB 3.33Å
354	F	97.2	Very high	94.6	Very high	12 Å²	12	16.4 Å²	16.4	5%	0.053	8%	0.08	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	-155.3	-178	-155	-115.7	0	0	0	110.7	L285 Y286 E345 L357 V367	L285-F354 HydrophobicContact CD2-CD2 3.83Å; L285-F354 HydrophobicContact CD2-CE2 4.42Å; L285-F354 HydrophobicContact CG-CD2 4.01Å; L285-F354 HydrophobicContact CG-CE2 4.17Å; Y286-F354 HydrophobicContact CD2-CE2 4.12Å; Y286-F354 HydrophobicContact CD2-CZ 4.2Å; E345-F354 PolarHBondContact N-O 3.21Å; E345-F354 PolarHBondContact O-N 3.41Å; F354-L357 HydrophobicContact CB-CD1 4.12Å; F354-L357 HydrophobicContact CB-CG 4.35Å; F354-V367 HydrophobicContact CE1-CG1 4.47Å; F354-V367 HydrophobicContact CE1-CG2 4.04Å
355	V	96.1	Very high	94.6	Very high	1 Å²	1	22.9 Å²	22.9	1%	0.006	11%	0.105	C	C	.	.	S	Bend	trans	-146.7	146.6	-179.2	59	0	0	0	0	110.2	F282 Y286 L338 K343 E345 A362 V367	F282-V355 HydrophobicContact CE2-CB 4.07Å; F282-V355 HydrophobicContact CE2-CG1 4.11Å; Y286-V355 HydrophobicContact CD2-CG1 3.58Å; Y286-V355 HydrophobicContact CE2-CG1 3.62Å; L338-V355 HydrophobicContact CD1-CB 4.3Å; L338-V355 HydrophobicContact CD1-CG1 3.9Å; L338-V355 HydrophobicContact CD1-CG2 4.19Å; L338-V355 HydrophobicContact CD2-CG2 3.77Å; K343-V355 HydrophobicContact CB-CG2 4.49Å; E345-V355 VanDerWaalsContact OE2-C 3.31Å; E345-V355 VanDerWaalsContact OE2-CA 3.32Å; E345-V355 WeakPolarHBondContact OE2-CA 3.23Å; V355-A362 HydrophobicContact CG2-CB 3.68Å; V355-V367 HydrophobicContact CG1-CG2 3.87Å; V355-V367 WeakPolarHBondContact O-CG2 3.39Å
356	G	93.8	Very high	94.7	Very high	3 Å²	3	23.4 Å²	23.4	3%	0.031	11%	0.107	C	C	.	.	S	Bend	trans	82.8	16.5	-174	0	0	0	0	0	113.8	E345	E345-G356 PolarHBondContact OE2-N 3.09Å
357	L	93.4	Very high	94.8	Very high	27 Å²	27	23.6 Å²	23.6	14%	0.141	11%	0.108	C	C	.	.	S	Bend	trans	-78.7	-38.5	-179.6	-62.8	178.6	0	0	0	111.5	E345 D347 F354 R438	E345-L357 HydrophobicContact CB-CB 4.07Å; E345-L357 HydrophobicContact CB-CD1 3.95Å; E345-L357 HydrophobicContact CB-CG 4.31Å; E345-L357 PolarHBondContact OE2-N 3.44Å; D347-L357 HydrophobicContact CB-CD1 3.77Å; F354-L357 HydrophobicContact CB-CD1 4.12Å; F354-L357 HydrophobicContact CB-CG 4.35Å; L357-R438 PolarHBondContact O-NH1 3.18Å; L357-R438 PolarHBondContact O-NH2 2.91Å
358	Y	91.2	Very high	94.8	Very high	31 Å²	31	24.2 Å²	24.2	12%	0.122	11%	0.112	C	C	.	.	S	Bend	trans	-127.8	-33.4	177	-50.6	-82.1	0	0	0	111.5	F172 P180 M185 V269 L271 E345 L360	F172-Y358 HydrophobicContact CE2-CD1 4.39Å; P180-Y358 HydrophobicContact CB-CD1 4.09Å; P180-Y358 HydrophobicContact CB-CE1 3.74Å; P180-Y358 HydrophobicContact CG-CD1 3.44Å; P180-Y358 VanDerWaalsContact CG-CD1 3.44Å; P180-Y358 HydrophobicContact CG-CD2 3.92Å; P180-Y358 HydrophobicContact CG-CE1 3.53Å; P180-Y358 HydrophobicContact CG-CE2 4.02Å; P180-Y358 HydrophobicContact CG-CG 3.66Å; M185-Y358 HydrophobicContact SD-CD1 4.34Å; M185-Y358 HydrophobicContact SD-CE1 4.01Å; V269-Y358 HydrophobicContact CG2-CE2 3.87Å; L271-Y358 HydrophobicContact CD2-CD2 4.42Å; E345-Y358 HydrophobicContact CB-CD2 4.25Å; E345-Y358 HydrophobicContact CG-CD2 4.37Å; E345-Y358 WeakPolarHBondContact OE1-CA 3.46Å; E345-Y358 WeakPolarHBondContact OE1-CB 3.24Å; E345-Y358 PolarHBondContact OE1-N 3.47Å; Y358-L360 PolarHBondContact O-N 3.34Å
359	D	91.3	Very high	94.9	Very high	37 Å²	37	26.1 Å²	26.1	20%	0.198	13%	0.128	C	C	.	.			trans	-81.4	112	174.7	-172.5	-35.9	0	0	0	112.7	K343 E345 D361 A362 L363	K343-D359 WeakPolarHBondContact CD-OD2 3.46Å; K343-D359 WeakPolarHBondContact CE-OD2 3.49Å; K343-D359 IonicContact NZ-OD2 2.87Å; K343-D359 PolarHBondContact NZ-OD2 2.71Å; E345-D359 PolarHBondContact OE1-N 2.79Å; D359-D361 WeakPolarHBondContact OD1-CA 3.46Å; D359-D361 PolarHBondContact OD1-N 2.89Å; D359-A362 HydrophobicContact CB-CB 3.74Å; D359-A362 PolarHBondContact OD1-N 2.91Å; D359-L363 PolarHBondContact O-N 3.49Å
360	L	91.7	Very high	95	Very high	35 Å²	35	27.3 Å²	27.3	18%	0.183	14%	0.135	C	C	.	.	H	α-helix	trans	-68.4	-29.6	179.1	-80.3	176.1	0	0	0	114.5	Y358 L363 R364 Q435 R438	Y358-L360 PolarHBondContact O-N 3.34Å; L360-L363 HydrophobicContact CD2-CD2 4.14Å; L360-R364 WeakPolarHBondContact O-CB 3.39Å; L360-R364 VanDerWaalsContact O-CD 3.29Å; L360-R364 WeakPolarHBondContact O-CD 3.29Å; L360-R364 WeakPolarHBondContact O-CG 3.36Å; L360-R364 PolarHBondContact O-N 3.35Å; L360-Q435 HydrophobicContact CD2-CG 4.18Å; L360-R438 HydrophobicContact CD1-CB 4.38Å; L360-R438 HydrophobicContact CD1-CG 4.34Å; L360-R438 HydrophobicContact CD2-CB 3.87Å; L360-R438 HydrophobicContact CD2-CG 3.91Å; L360-R438 HydrophobicContact CG-CB 4.5Å; L360-R438 HydrophobicContact CG-CG 4.21Å
361	D	92	Very high	95.1	Very high	80 Å²	80	27.5 Å²	27.5	43%	0.428	14%	0.136	S	C	.	.	H	α-helix	trans	-80.5	-35.6	177.9	-73.7	-38.3	0	0	0	111	D359 L363 R364 Y365	D359-D361 WeakPolarHBondContact OD1-CA 3.46Å; D359-D361 PolarHBondContact OD1-N 2.89Å; D361-L363 VanDerWaalsContact C-N 3.32Å; D361-L363 PolarHBondContact O-N 3.41Å; D361-R364 PolarHBondContact O-N 2.83Å; D361-R364 WeakPolarHBondContact OD1-CD 3.33Å; D361-R364 IonicContact OD1-CZ 2.78Å; D361-R364 IonicContact OD1-NE 2.96Å; D361-R364 IonicContact OD1-NH1 2.65Å; D361-R364 PolarHBondContact OD1-NH1 3Å; D361-Y365 HydrophobicContact CB-CD2 4.21Å; D361-Y365 HydrophobicContact CB-CE2 4.25Å; D361-Y365 WeakPolarHBondContact O-CD2 2.98Å; D361-Y365 PolarHBondContact O-N 2.85Å
362	A	94.4	Very high	95.2	Very high	4 Å²	4	29.5 Å²	29.5	3%	0.033	15%	0.15	C	C	.	.	H	α-helix	trans	-59.3	-44.4	167.8	0	0	0	0	0	111.1	V355 D359 F366	V355-A362 HydrophobicContact CG2-CB 3.68Å; D359-A362 HydrophobicContact CB-CB 3.74Å; D359-A362 PolarHBondContact OD1-N 2.91Å; A362-F366 WeakPolarHBondContact O-CB 3.21Å; A362-F366 PolarHBondContact O-N 2.96Å
363	L	95.5	Very high	95.2	Very high	1 Å²	1	34.1 Å²	34.1	1%	0.005	18%	0.178	C	C	.	.	I	π-helix	trans	-57	-52.2	173.3	-178.9	64.6	0	0	0	111.8	D359 L360 D361 V367 L368 Y431 Q435	D359-L363 PolarHBondContact O-N 3.49Å; L360-L363 HydrophobicContact CD2-CD2 4.14Å; D361-L363 VanDerWaalsContact C-N 3.32Å; D361-L363 PolarHBondContact O-N 3.41Å; L363-V367 HydrophobicContact CD1-CB 4.18Å; L363-V367 HydrophobicContact CD1-CG1 4.48Å; L363-V367 WeakPolarHBondContact O-CB 3.43Å; L363-V367 PolarHBondContact O-N 2.85Å; L363-L368 PolarHBondContact O-N 3.36Å; L363-Y431 HydrophobicContact CD1-CD1 3.81Å; L363-Y431 HydrophobicContact CD1-CE1 4.3Å; L363-Q435 HydrophobicContact CD2-CB 4.06Å; L363-Q435 HydrophobicContact CD2-CG 4.49Å
364	R	95.4	Very high	95.2	Very high	85 Å²	85	34.4 Å²	34.4	32%	0.321	18%	0.181	S	C	.	.	I	π-helix	trans	-58.1	-56.5	-179	-75.1	159.6	-174.4	155	2.1	112.2	L360 D361 A369	L360-R364 WeakPolarHBondContact O-CB 3.39Å; L360-R364 VanDerWaalsContact O-CD 3.29Å; L360-R364 WeakPolarHBondContact O-CD 3.29Å; L360-R364 WeakPolarHBondContact O-CG 3.36Å; L360-R364 PolarHBondContact O-N 3.35Å; D361-R364 PolarHBondContact O-N 2.83Å; D361-R364 WeakPolarHBondContact OD1-CD 3.33Å; D361-R364 IonicContact OD1-CZ 2.78Å; D361-R364 IonicContact OD1-NE 2.96Å; D361-R364 IonicContact OD1-NH1 2.65Å; D361-R364 PolarHBondContact OD1-NH1 3Å; R364-A369 WeakPolarHBondContact O-CB 3.36Å; R364-A369 PolarHBondContact O-N 3.48Å
365	Y	96.1	Very high	95.1	Very high	137 Å²	137	34 Å²	34	54%	0.537	18%	0.18	S	C	.	.	I	π-helix	trans	-84.4	-28.5	-168	-66	-66.6	0	0	0	114	D361 P370	D361-Y365 HydrophobicContact CB-CD2 4.21Å; D361-Y365 HydrophobicContact CB-CE2 4.25Å; D361-Y365 WeakPolarHBondContact O-CD2 2.98Å; D361-Y365 PolarHBondContact O-N 2.85Å; Y365-P370 WeakPolarHBondContact O-CD 3.22Å
366	F	97.1	Very high	95.2	Very high	20 Å²	20	38.5 Å²	38.5	9%	0.088	21%	0.207	C	C	.	.	I	π-helix	trans	-109.8	-18.6	-172.4	-64.6	-99.3	0	0	0	114.8	Y286 M290 L334 M337 L338 L341 A362	Y286-F366 PolarHBondContact OH-O 2.58Å; M290-F366 WeakPolarHBondContact CE-O 3.37Å; L334-F366 HydrophobicContact CD2-CD1 4.45Å; M337-F366 HydrophobicContact CB-CE1 4.26Å; M337-F366 HydrophobicContact CE-CD1 4.3Å; M337-F366 HydrophobicContact CE-CE1 3.37Å; M337-F366 HydrophobicContact CE-CZ 3.77Å; M337-F366 HydrophobicContact CG-CE1 3.91Å; M337-F366 HydrophobicContact CG-CZ 4.12Å; M337-F366 HydrophobicContact SD-CE1 4.36Å; M337-F366 HydrophobicContact SD-CZ 4.46Å; L338-F366 HydrophobicContact CD1-CB 4.17Å; L338-F366 HydrophobicContact CD1-CD1 3.84Å; L338-F366 HydrophobicContact CD1-CG 4.24Å; L338-F366 HydrophobicContact CD2-CB 4.07Å; L338-F366 HydrophobicContact CD2-CD1 3.35Å; L338-F366 HydrophobicContact CD2-CD2 3.88Å; L338-F366 HydrophobicContact CD2-CE1 3.57Å; L338-F366 HydrophobicContact CD2-CE2 4.1Å; L338-F366 HydrophobicContact CD2-CG 3.5Å; L338-F366 HydrophobicContact CD2-CZ 3.95Å; L338-F366 HydrophobicContact CG-CB 4.46Å; L338-F366 HydrophobicContact CG-CD1 3.4Å; L338-F366 HydrophobicContact CG-CE1 3.66Å; L338-F366 HydrophobicContact CG-CG 4.01Å; L338-F366 HydrophobicContact CG-CZ 4.5Å; L341-F366 HydrophobicContact CD1-CE2 4.34Å; L341-F366 HydrophobicContact CD1-CZ 3.65Å; A362-F366 WeakPolarHBondContact O-CB 3.21Å; A362-F366 PolarHBondContact O-N 2.96Å
367	V	97	Very high	95.3	Very high	4 Å²	4	41.1 Å²	41.1	2%	0.024	22%	0.222	C	C	.	.	I	π-helix	trans	-112.4	-56	175.8	-173.9	0	0	0	0	110.6	F354 V355 L363 L371 Y431	F354-V367 HydrophobicContact CE1-CG1 4.47Å; F354-V367 HydrophobicContact CE1-CG2 4.04Å; V355-V367 HydrophobicContact CG1-CG2 3.87Å; V355-V367 WeakPolarHBondContact O-CG2 3.39Å; L363-V367 HydrophobicContact CD1-CB 4.18Å; L363-V367 HydrophobicContact CD1-CG1 4.48Å; L363-V367 WeakPolarHBondContact O-CB 3.43Å; L363-V367 PolarHBondContact O-N 2.85Å; V367-L371 WeakPolarHBondContact O-CB 3.38Å; V367-L371 PolarHBondContact O-N 3.25Å; V367-Y431 HydrophobicContact CG1-CD1 4.29Å; V367-Y431 HydrophobicContact CG1-CD2 4.16Å; V367-Y431 HydrophobicContact CG1-CE1 3.95Å; V367-Y431 HydrophobicContact CG1-CE2 3.84Å; V367-Y431 HydrophobicContact CG1-CG 4.39Å
368	L	97.1	Very high	95.4	Very high	20 Å²	20	39.9 Å²	39.9	11%	0.105	22%	0.215	C	C	.	.	I	π-helix	trans	-71.4	-49.6	-172.6	-168.1	71.6	0	0	0	112.1	L363 L371 C372 L428 T432 Q435	L363-L368 PolarHBondContact O-N 3.36Å; L368-L371 PolarHBondContact O-N 3.48Å; L368-C372 WeakPolarHBondContact O-CB 3.29Å; L368-C372 PolarHBondContact O-N 3.47Å; L368-C372 PolarHBondContact O-SG 2.89Å; L368-C372 VanDerWaalsContact O-SG 3.32Å; L368-L428 HydrophobicContact CD1-CD1 3.52Å; L368-L428 HydrophobicContact CG-CD1 4.49Å; L368-T432 HydrophobicContact CD1-CG2 3.86Å; L368-T432 HydrophobicContact CD2-CG2 4.27Å; L368-Q435 VanDerWaalsContact CD2-OE1 3.24Å
369	A	96.5	Very high	95.6	Very high	42 Å²	42	41.4 Å²	41.4	35%	0.347	23%	0.225	S	C	.	.	H	α-helix	trans	-61.5	-45.3	-177.8	0	0	0	0	0	113.6	R364 L371 C372 V373	R364-A369 WeakPolarHBondContact O-CB 3.36Å; R364-A369 PolarHBondContact O-N 3.48Å; A369-L371 VanDerWaalsContact C-N 3.35Å; A369-L371 PolarHBondContact O-N 3.11Å; A369-C372 PolarHBondContact O-N 3.49Å; A369-V373 WeakPolarHBondContact O-CB 3.3Å; A369-V373 WeakPolarHBondContact O-CG2 3.03Å; A369-V373 PolarHBondContact O-N 2.9Å
370	P	96.5	Very high	95.8	Very high	31 Å²	31	45.4 Å²	45.4	20%	0.201	24%	0.241	C	C	.	.	H	α-helix	trans	-62.5	-38.1	173.9	-25.4	36.9	0	0	0	113.3	M290 L334 Y365 G374	M290-P370 HydrophobicContact CE-CB 4.49Å; M290-P370 HydrophobicContact SD-CB 3.97Å; L334-P370 HydrophobicContact CD1-CG 4.4Å; Y365-P370 WeakPolarHBondContact O-CD 3.22Å; P370-G374 PolarHBondContact O-N 2.9Å
371	L	96.3	Very high	95.9	Very high	7 Å²	7	44.7 Å²	44.7	4%	0.037	24%	0.237	C	C	.	.	H	α-helix	trans	-66.1	-46.6	176.1	-179.7	60.8	0	0	0	111.5	I293 V367 L368 A369 G374 V375 L424 L427 L428 Y431	I293-L371 HydrophobicContact CD1-CD1 4.25Å; V367-L371 WeakPolarHBondContact O-CB 3.38Å; V367-L371 PolarHBondContact O-N 3.25Å; L368-L371 PolarHBondContact O-N 3.48Å; A369-L371 VanDerWaalsContact C-N 3.35Å; A369-L371 PolarHBondContact O-N 3.11Å; L371-G374 PolarHBondContact O-N 3.37Å; L371-V375 HydrophobicContact CD1-CG2 4.1Å; L371-V375 WeakPolarHBondContact O-CB 3.43Å; L371-V375 VanDerWaalsContact O-CG2 3.32Å; L371-V375 WeakPolarHBondContact O-CG2 3.35Å; L371-V375 PolarHBondContact O-N 3.23Å; L371-L424 HydrophobicContact CD1-CB 4.5Å; L371-L424 HydrophobicContact CD1-CD2 3.96Å; L371-L427 HydrophobicContact CD2-CB 4.24Å; L371-L428 HydrophobicContact CD2-CB 4.03Å; L371-L428 HydrophobicContact CD2-CD1 4.41Å; L371-L428 HydrophobicContact CG-CB 4.4Å; L371-Y431 HydrophobicContact CD2-CD2 3.92Å; L371-Y431 HydrophobicContact CD2-CE2 4.36Å
372	C	97.3	Very high	96	Very high	43 Å²	43	41.2 Å²	41.2	29%	0.291	22%	0.219	S	C	.	.	H	α-helix	trans	-56.6	-51.9	174.3	-76.7	0	0	0	0	111.9	L368 A369 G374 V375 V376 L428	L368-C372 WeakPolarHBondContact O-CB 3.29Å; L368-C372 PolarHBondContact O-N 3.47Å; L368-C372 PolarHBondContact O-SG 2.89Å; L368-C372 VanDerWaalsContact O-SG 3.32Å; A369-C372 PolarHBondContact O-N 3.49Å; C372-G374 VanDerWaalsContact C-N 3.33Å; C372-G374 PolarHBondContact O-N 3.34Å; C372-V375 PolarHBondContact O-N 3Å; C372-V376 WeakPolarHBondContact O-CB 3.47Å; C372-V376 VanDerWaalsContact O-CG2 3.31Å; C372-V376 WeakPolarHBondContact O-CG2 3.36Å; C372-V376 PolarHBondContact O-N 2.88Å; C372-L428 WeakPolarHBondContact SG-CD1 3.46Å
373	V	96.8	Very high	95.9	Very high	96 Å²	96	46.1 Å²	46.1	58%	0.582	24%	0.244	S	C	*	.	H	α-helix	trans	-60.8	-44.6	179.4	170.4	0	0	0	0	110.6	A369 V377	A369-V373 WeakPolarHBondContact O-CB 3.3Å; A369-V373 WeakPolarHBondContact O-CG2 3.03Å; A369-V373 PolarHBondContact O-N 2.9Å; V373-V377 HydrophobicContact CG1-CG2 4.41Å; V373-V377 WeakPolarHBondContact O-CB 3.43Å; V373-V377 VanDerWaalsContact O-CG2 3.25Å; V373-V377 WeakPolarHBondContact O-CG2 3.45Å; V373-V377 PolarHBondContact O-N 2.94Å
374	G	95.7	Very high	95.8	Very high	6 Å²	6	47.2 Å²	47.2	6%	0.062	25%	0.253	C	S	.	.	H	α-helix	trans	-57.4	-54.3	175	0	0	0	0	0	112.1	W296 P370 L371 C372 V376 V377 G378	W296-G374 VanDerWaalsContact CZ3-O 3.32Å; W296-G374 WeakPolarHBondContact CZ3-O 3.38Å; P370-G374 PolarHBondContact O-N 2.9Å; L371-G374 PolarHBondContact O-N 3.37Å; C372-G374 VanDerWaalsContact C-N 3.33Å; C372-G374 PolarHBondContact O-N 3.34Å; G374-V376 PolarHBondContact O-N 3.31Å; G374-V377 PolarHBondContact O-N 3.14Å; G374-G378 PolarHBondContact O-N 2.87Å
375	V	96.3	Very high	95.5	Very high	5 Å²	5	43.1 Å²	43.1	3%	0.03	24%	0.237	C	C	.	.	H	α-helix	trans	-59.9	-46.3	-178.8	168.1	0	0	0	0	111.8	L371 C372 G378 L379 L421 L424 V425 L428	L371-V375 HydrophobicContact CD1-CG2 4.1Å; L371-V375 WeakPolarHBondContact O-CB 3.43Å; L371-V375 VanDerWaalsContact O-CG2 3.32Å; L371-V375 WeakPolarHBondContact O-CG2 3.35Å; L371-V375 PolarHBondContact O-N 3.23Å; C372-V375 PolarHBondContact O-N 3Å; V375-G378 PolarHBondContact O-N 2.94Å; V375-L379 HydrophobicContact CG1-CD1 3.69Å; V375-L379 HydrophobicContact CG1-CG 4.3Å; V375-L379 VanDerWaalsContact O-CB 3.25Å; V375-L379 WeakPolarHBondContact O-CB 3.43Å; V375-L379 VanDerWaalsContact O-CG 3.22Å; V375-L379 WeakPolarHBondContact O-CG 3.45Å; V375-L379 PolarHBondContact O-N 3.39Å; V375-L421 HydrophobicContact CG1-CD1 4.34Å; V375-L424 HydrophobicContact CG2-CB 3.81Å; V375-L424 HydrophobicContact CG2-CD1 4.15Å; V375-V425 HydrophobicContact CG1-CG2 4.21Å; V375-L428 HydrophobicContact CG1-CD2 4.33Å
376	V	97	Very high	95.2	Very high	95 Å²	95	40 Å²	40	58%	0.576	23%	0.229	S	C	*	.	H	α-helix	trans	-64.6	-44.7	179.8	171	0	0	0	0	111.8	C372 G374 F380	C372-V376 WeakPolarHBondContact O-CB 3.47Å; C372-V376 VanDerWaalsContact O-CG2 3.31Å; C372-V376 WeakPolarHBondContact O-CG2 3.36Å; C372-V376 PolarHBondContact O-N 2.88Å; G374-V376 PolarHBondContact O-N 3.31Å; V376-F380 WeakPolarHBondContact O-CB 3.46Å; V376-F380 PolarHBondContact O-N 3.22Å
377	V	96.8	Very high	94.9	Very high	58 Å²	58	43.8 Å²	43.8	35%	0.352	25%	0.254	S	S	.	.	H	α-helix	trans	-65.9	-44.2	177.7	171.7	0	0	0	0	111	V297 V373 G374 F380 L381	V297-V377 HydrophobicContact CG1-CG1 3.93Å; V373-V377 HydrophobicContact CG1-CG2 4.41Å; V373-V377 WeakPolarHBondContact O-CB 3.43Å; V373-V377 VanDerWaalsContact O-CG2 3.25Å; V373-V377 WeakPolarHBondContact O-CG2 3.45Å; V373-V377 PolarHBondContact O-N 2.94Å; G374-V377 PolarHBondContact O-N 3.14Å; V377-F380 PolarHBondContact O-N 2.99Å; V377-L381 HydrophobicContact CG1-CD1 3.77Å; V377-L381 HydrophobicContact CG1-CG 4.49Å; V377-L381 WeakPolarHBondContact O-CB 3.38Å; V377-L381 VanDerWaalsContact O-CG 3.28Å; V377-L381 WeakPolarHBondContact O-CG 3.47Å; V377-L381 PolarHBondContact O-N 3.3Å
378	G	94.9	Very high	94.3	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-64	-42.8	177.3	0	0	0	0	0	112.9	G374 V375 L381 I382	G374-G378 PolarHBondContact O-N 2.87Å; V375-G378 PolarHBondContact O-N 2.94Å; G378-L381 PolarHBondContact O-N 3.05Å; G378-I382 WeakPolarHBondContact O-CB 3.33Å; G378-I382 WeakPolarHBondContact O-CG1 3.43Å; G378-I382 PolarHBondContact O-N 3.45Å
379	L	95.4	Very high	93.5	Very high	63 Å²	63	45 Å²	45	33%	0.33	26%	0.262	S	S	.	.	H	α-helix	trans	-56.8	-50.3	172.7	-82.5	167.5	0	0	0	111.7	V375 L381 I382 L383 L421	V375-L379 HydrophobicContact CG1-CD1 3.69Å; V375-L379 HydrophobicContact CG1-CG 4.3Å; V375-L379 VanDerWaalsContact O-CB 3.25Å; V375-L379 WeakPolarHBondContact O-CB 3.43Å; V375-L379 VanDerWaalsContact O-CG 3.22Å; V375-L379 WeakPolarHBondContact O-CG 3.45Å; V375-L379 PolarHBondContact O-N 3.39Å; L379-L381 PolarHBondContact O-N 2.95Å; L379-I382 PolarHBondContact O-N 3.49Å; L379-L383 WeakPolarHBondContact O-CB 3.49Å; L379-L383 WeakPolarHBondContact O-CG 3.22Å; L379-L383 PolarHBondContact O-N 2.79Å; L379-L421 HydrophobicContact CD2-CD1 3.92Å; L379-L421 HydrophobicContact CD2-CD2 3.55Å; L379-L421 HydrophobicContact CD2-CG 4.34Å; L379-L421 HydrophobicContact CG-CD1 3.95Å; L379-L421 HydrophobicContact CG-CD2 4.45Å
380	F	96	Very high	92.8	Very high	122 Å²	122	46.9 Å²	46.9	54%	0.535	27%	0.267	S	S	.	.	H	α-helix	trans	-59.2	-45.4	179.2	175.1	-99.4	0	0	0	111.9	M3 V376 V377 L383 A384	M3-F380 HydrophobicContact CE-CZ 4.3Å; V376-F380 WeakPolarHBondContact O-CB 3.46Å; V376-F380 PolarHBondContact O-N 3.22Å; V377-F380 PolarHBondContact O-N 2.99Å; F380-L383 PolarHBondContact O-N 3.08Å; F380-A384 VanDerWaalsContact O-CB 3.26Å; F380-A384 WeakPolarHBondContact O-CB 3.35Å; F380-A384 PolarHBondContact O-N 2.68Å
381	L	94.5	Very high	92.1	Very high	20 Å²	20	51.2 Å²	51.2	11%	0.105	28%	0.284	C	S	.	.	H	α-helix	trans	-68.3	-38.1	178.6	-69.1	167.4	0	0	0	112.8	T300 I301 F304 V377 G378 L379 G385	T300-L381 WeakPolarHBondContact OG1-CD1 3.43Å; I301-L381 HydrophobicContact CB-CD1 4.38Å; I301-L381 HydrophobicContact CD1-CD1 4.5Å; I301-L381 HydrophobicContact CG1-CD1 3.42Å; I301-L381 VanDerWaalsContact CG1-CD1 3.42Å; F304-L381 HydrophobicContact CB-CB 4.43Å; F304-L381 HydrophobicContact CB-CD2 4.09Å; F304-L381 HydrophobicContact CD1-CD2 3.83Å; F304-L381 HydrophobicContact CG-CD2 3.97Å; V377-L381 HydrophobicContact CG1-CD1 3.77Å; V377-L381 HydrophobicContact CG1-CG 4.49Å; V377-L381 WeakPolarHBondContact O-CB 3.38Å; V377-L381 VanDerWaalsContact O-CG 3.28Å; V377-L381 WeakPolarHBondContact O-CG 3.47Å; V377-L381 PolarHBondContact O-N 3.3Å; G378-L381 PolarHBondContact O-N 3.05Å; L379-L381 PolarHBondContact O-N 2.95Å; L381-G385 PolarHBondContact O-N 2.69Å
382	I	92.9	Very high	90.9	Very high	7 Å²	7	52.1 Å²	52.1	4%	0.036	29%	0.29	C	S	.	.	H	α-helix	trans	-61.1	-50.6	173.7	-74.3	167.8	0	0	0	109.9	W296 T300 W303 G378 L379 G385 I386	W296-I382 HydrophobicContact CZ2-CD1 4.08Å; T300-I382 HydrophobicContact CG2-CD1 3.94Å; T300-I382 HydrophobicContact CG2-CG1 3.88Å; W303-I382 WeakPolarHBondContact CZ3-O 3.14Å; G378-I382 WeakPolarHBondContact O-CB 3.33Å; G378-I382 WeakPolarHBondContact O-CG1 3.43Å; G378-I382 PolarHBondContact O-N 3.45Å; L379-I382 PolarHBondContact O-N 3.49Å; I382-G385 PolarHBondContact O-N 2.74Å; I382-I386 HydrophobicContact CG2-CD1 3.94Å; I382-I386 VanDerWaalsContact O-CG1 3.31Å; I382-I386 WeakPolarHBondContact O-CG1 3.44Å; I382-I386 PolarHBondContact O-N 3.29Å
383	L	93.2	Very high	89.5	Confident	107 Å²	107	56.5 Å²	56.5	56%	0.56	30%	0.3	S	S	*	.	H	α-helix	trans	-62.1	-47.3	178.6	-69.6	170.2	0	0	0	111.9	L379 F380 G385 I386 V387	L379-L383 WeakPolarHBondContact O-CB 3.49Å; L379-L383 WeakPolarHBondContact O-CG 3.22Å; L379-L383 PolarHBondContact O-N 2.79Å; F380-L383 PolarHBondContact O-N 3.08Å; L383-G385 VanDerWaalsContact C-N 3.29Å; L383-G385 PolarHBondContact O-N 2.99Å; L383-I386 PolarHBondContact O-N 2.74Å; L383-V387 WeakPolarHBondContact O-CG2 3.4Å; L383-V387 PolarHBondContact O-N 3.44Å
384	A	92.6	Very high	88	Confident	23 Å²	23	59.4 Å²	59.4	19%	0.19	31%	0.307	C	S	.	.	H	α-helix	trans	-60.9	-36.8	178.3	0	0	0	0	0	112.5	F304 F380 S388	F304-A384 HydrophobicContact CD2-CB 3.91Å; F304-A384 HydrophobicContact CE2-CB 3.67Å; F304-A384 HydrophobicContact CZ-CB 4.49Å; F380-A384 VanDerWaalsContact O-CB 3.26Å; F380-A384 WeakPolarHBondContact O-CB 3.35Å; F380-A384 PolarHBondContact O-N 2.68Å; A384-S388 VanDerWaalsContact O-CB 3.3Å; A384-S388 WeakPolarHBondContact O-CB 3.21Å; A384-S388 PolarHBondContact O-N 3.12Å; A384-S388 PolarHBondContact O-OG 3.48Å
385	G	89.9	Confident	86.7	Confident	0 Å²	0	64.2 Å²	64.2	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-73.4	-35.2	175.2	0	0	0	0	0	113.7	W303 L381 I382 L383 S388 L389	W303-G385 VanDerWaalsContact CZ3-CA 3.47Å; L381-G385 PolarHBondContact O-N 2.69Å; I382-G385 PolarHBondContact O-N 2.74Å; L383-G385 VanDerWaalsContact C-N 3.29Å; L383-G385 PolarHBondContact O-N 2.99Å; G385-S388 PolarHBondContact O-N 3.14Å; G385-L389 WeakPolarHBondContact O-CB 3.44Å; G385-L389 VanDerWaalsContact O-CG 3.32Å; G385-L389 WeakPolarHBondContact O-CG 3.08Å; G385-L389 PolarHBondContact O-N 2.64Å
386	I	89.2	Confident	84.7	Confident	70 Å²	70	66.1 Å²	66.1	36%	0.359	35%	0.345	S	S	.	.	H	α-helix	trans	-62.6	-49.2	172.1	-68.7	169	0	0	0	110.2	W303 I382 L383 S388 L389 N390	W303-I386 HydrophobicContact CH2-CG1 4.02Å; I382-I386 HydrophobicContact CG2-CD1 3.94Å; I382-I386 VanDerWaalsContact O-CG1 3.31Å; I382-I386 WeakPolarHBondContact O-CG1 3.44Å; I382-I386 PolarHBondContact O-N 3.29Å; L383-I386 PolarHBondContact O-N 2.74Å; I386-S388 VanDerWaalsContact C-N 3.32Å; I386-S388 PolarHBondContact O-N 2.86Å; I386-L389 PolarHBondContact O-N 3.2Å; I386-N390 PolarHBondContact O-N 2.71Å
387	V	90.2	Very high	82.7	Confident	101 Å²	101	69.3 Å²	69.3	61%	0.612	35%	0.353	S	S	*	.	H	α-helix	trans	-59.2	-44.7	177.1	172.8	0	0	0	0	110.8	L383 L389 N390 H391	L383-V387 WeakPolarHBondContact O-CG2 3.4Å; L383-V387 PolarHBondContact O-N 3.44Å; V387-L389 PolarHBondContact O-N 2.89Å; V387-N390 PolarHBondContact O-N 2.96Å; V387-H391 PolarHBondContact O-N 3.2Å
388	S	85.4	Confident	80.7	Confident	26 Å²	26	75.9 Å²	75.9	18%	0.182	38%	0.38	C	S	.	.	H	α-helix	trans	-58.8	-47.2	175.9	-64	0	0	0	0	112.8	G308 A384 G385 I386 N390 H391 V392	G308-S388 WeakPolarHBondContact CA-OG 3.45Å; A384-S388 VanDerWaalsContact O-CB 3.3Å; A384-S388 WeakPolarHBondContact O-CB 3.21Å; A384-S388 PolarHBondContact O-N 3.12Å; A384-S388 PolarHBondContact O-OG 3.48Å; G385-S388 PolarHBondContact O-N 3.14Å; I386-S388 VanDerWaalsContact C-N 3.32Å; I386-S388 PolarHBondContact O-N 2.86Å; S388-N390 VanDerWaalsContact C-N 3.3Å; S388-N390 PolarHBondContact O-N 2.71Å; S388-H391 PolarHBondContact O-N 3.03Å; S388-V392 WeakPolarHBondContact O-CB 3.34Å; S388-V392 VanDerWaalsContact O-CG2 3.28Å; S388-V392 WeakPolarHBondContact O-CG2 3.38Å; S388-V392 PolarHBondContact O-N 2.95Å
389	L	80.6	Confident	78.9	Confident	22 Å²	22	79.3 Å²	79.3	12%	0.115	40%	0.398	C	S	.	.	H	α-helix	trans	-61.8	-37	177.5	-77.7	169.8	0	0	0	112.1	W303 A307 G385 I386 V387 R393 M410	W303-L389 HydrophobicContact CH2-CD1 4.18Å; W303-L389 HydrophobicContact CZ2-CD1 3.58Å; A307-L389 HydrophobicContact CB-CD2 4.39Å; A307-L389 HydrophobicContact CB-CG 4.08Å; G385-L389 WeakPolarHBondContact O-CB 3.44Å; G385-L389 VanDerWaalsContact O-CG 3.32Å; G385-L389 WeakPolarHBondContact O-CG 3.08Å; G385-L389 PolarHBondContact O-N 2.64Å; I386-L389 PolarHBondContact O-N 3.2Å; V387-L389 PolarHBondContact O-N 2.89Å; L389-R393 WeakPolarHBondContact O-CB 3.38Å; L389-R393 VanDerWaalsContact O-CG 3.23Å; L389-R393 WeakPolarHBondContact O-CG 3.38Å; L389-R393 PolarHBondContact O-N 3.39Å; L389-M410 HydrophobicContact CD2-CE 4.02Å
390	N	81.6	Confident	77.2	Confident	83 Å²	83	83.5 Å²	83.5	44%	0.444	42%	0.416	S	S	.	.	H	α-helix	trans	-69.9	-44.9	178.3	-70.9	-15.2	0	0	0	111.9	I386 V387 S388 V392 R393 Q394	I386-N390 PolarHBondContact O-N 2.71Å; V387-N390 PolarHBondContact O-N 2.96Å; S388-N390 VanDerWaalsContact C-N 3.3Å; S388-N390 PolarHBondContact O-N 2.71Å; N390-V392 PolarHBondContact O-N 2.96Å; N390-R393 WeakPolarHBondContact O-CB 3.08Å; N390-R393 PolarHBondContact O-N 2.96Å; N390-Q394 PolarHBondContact O-N 3.09Å; N390-Q394 VanDerWaalsContact O-N 3.13Å
391	H	80.9	Confident	75.4	Confident	121 Å²	121	87.7 Å²	87.7	56%	0.56	43%	0.428	S	S	*	.	H	α-helix	trans	-60.5	-44.1	173.7	-177.5	-97.7	0	0	0	111.8	V387 S388 R393 Q394 V395	V387-H391 PolarHBondContact O-N 3.2Å; S388-H391 PolarHBondContact O-N 3.03Å; H391-R393 VanDerWaalsContact C-N 3.3Å; H391-R393 PolarHBondContact O-N 3.12Å; H391-Q394 PolarHBondContact O-N 3.36Å; H391-V395 PolarHBondContact O-N 3.45Å
392	V	71.7	Confident	73.7	Confident	27 Å²	27	91.9 Å²	91.9	16%	0.164	45%	0.451	C	S	.	.	H	α-helix	trans	-66.8	-28.3	177.3	172.9	0	0	0	0	112.6	S388 N390 I396	S388-V392 WeakPolarHBondContact O-CB 3.34Å; S388-V392 VanDerWaalsContact O-CG2 3.28Å; S388-V392 WeakPolarHBondContact O-CG2 3.38Å; S388-V392 PolarHBondContact O-N 2.95Å; N390-V392 PolarHBondContact O-N 2.96Å; V392-I396 HydrophobicContact CG1-CD1 3.91Å; V392-I396 PolarHBondContact O-N 3.21Å
393	R	68.4	Low	72.4	Confident	135 Å²	135	94.4 Å²	94.4	51%	0.509	46%	0.462	S	S	.	.	H	α-helix	trans	-69	-38.7	171.2	-78.7	168.2	-179.1	-121	14.3	112.7	L389 N390 H391 I411	L389-R393 WeakPolarHBondContact O-CB 3.38Å; L389-R393 VanDerWaalsContact O-CG 3.23Å; L389-R393 WeakPolarHBondContact O-CG 3.38Å; L389-R393 PolarHBondContact O-N 3.39Å; N390-R393 WeakPolarHBondContact O-CB 3.08Å; N390-R393 PolarHBondContact O-N 2.96Å; H391-R393 VanDerWaalsContact C-N 3.3Å; H391-R393 PolarHBondContact O-N 3.12Å; R393-I411 VanDerWaalsContact NH2-CD1 3.3Å
394	Q	64.2	Low	71.2	Confident	157 Å²	157	93.9 Å²	93.9	73%	0.734	46%	0.457	S	S	*	.	H	α-helix	trans	-69.3	-35.1	-179.1	-72.9	172.7	-33.8	0	0	112.5	N390 H391	N390-Q394 PolarHBondContact O-N 3.09Å; N390-Q394 VanDerWaalsContact O-N 3.13Å; H391-Q394 PolarHBondContact O-N 3.36Å
395	V	68.1	Low	70.3	Confident	106 Å²	106	99.7 Å²	99.7	64%	0.642	48%	0.478	S	S	*	.	H	α-helix	trans	-89.8	-22.3	-173.5	179.6	0	0	0	0	113.9	H391	H391-V395 PolarHBondContact O-N 3.45Å
396	I	54.9	Low	69.3	Low	46 Å²	46	103.8 Å²	103.8	24%	0.236	50%	0.499	C	S	.	.			trans	-115.5	87	-171.2	-50	-175.3	0	0	0	112.7	V392 K407	V392-I396 HydrophobicContact CG1-CD1 3.91Å; V392-I396 PolarHBondContact O-N 3.21Å; I396-K407 PolarHBondContact O-NZ 3.05Å
397	Q	56	Low	68.6	Low	162 Å²	162	103 Å²	103	76%	0.757	49%	0.494	S	S	*	.			trans	-95.4	-15.1	167.1	-70.9	-176.8	-22.9	0	0	114.1
398	H	53.7	Low	68.1	Low	195 Å²	195	103.9 Å²	103.9	90%	0.903	49%	0.489	S	S	*	.	S	Bend	trans	-97.2	4.6	-163.9	-96.3	-71.4	0	0	0	118.2
399	D	57.4	Low	67.7	Low	72 Å²	72	105.3 Å²	105.3	39%	0.385	49%	0.492	S	S	.	.			trans	-141	94.2	171.3	172.2	24.2	0	0	0	108.9	Q403	D399-Q403 HydrophobicContact CB-CG 4.07Å; D399-Q403 VanDerWaalsContact O-CB 3.25Å; D399-Q403 WeakPolarHBondContact O-CB 3.49Å; D399-Q403 WeakPolarHBondContact O-CG 3.5Å; D399-Q403 VanDerWaalsContact OD2-CG 3.3Å; D399-Q403 WeakPolarHBondContact OD2-CG 3.42Å; D399-Q403 PolarHBondContact OD2-NE2 2.91Å
400	E	60.1	Low	67.7	Low	151 Å²	151	105 Å²	105	71%	0.706	49%	0.491	S	S	*	.			trans	-84.7	-54.2	-166.8	-59.5	-175.3	115.1	0	0	112.9	N402 Q403 E404	E400-N402 PolarHBondContact O-N 2.91Å; E400-Q403 PolarHBondContact O-N 3.16Å; E400-E404 WeakPolarHBondContact O-CB 3.39Å; E400-E404 WeakPolarHBondContact O-CG 3.26Å; E400-E404 PolarHBondContact O-N 2.86Å
401	R	58.2	Low	67.8	Low	210 Å²	210	104.1 Å²	104.1	79%	0.792	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.3	-27.3	-153.6	-152.5	176.7	-162.2	179.3	7.3	115.1
402	N	58.5	Low	68	Low	109 Å²	109	102.9 Å²	102.9	58%	0.583	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.2	-41.2	174.6	-74	-31.1	0	0	0	111.3	E400 E404 K405 L406	E400-N402 PolarHBondContact O-N 2.91Å; N402-E404 VanDerWaalsContact C-N 3.28Å; N402-E404 PolarHBondContact O-N 2.02Å; N402-K405 PolarHBondContact O-N 2.87Å; N402-L406 PolarHBondContact O-N 3.37Å
403	Q	64.9	Low	68.6	Low	59 Å²	59	101.7 Å²	101.7	28%	0.276	47%	0.468	S	S	.	.	H	α-helix	trans	-61.2	-35.7	177	-56.5	-60.3	-27.7	0	0	112.1	D399 E400 K405 L406 K407	D399-Q403 HydrophobicContact CB-CG 4.07Å; D399-Q403 VanDerWaalsContact O-CB 3.25Å; D399-Q403 WeakPolarHBondContact O-CB 3.49Å; D399-Q403 WeakPolarHBondContact O-CG 3.5Å; D399-Q403 VanDerWaalsContact OD2-CG 3.3Å; D399-Q403 WeakPolarHBondContact OD2-CG 3.42Å; D399-Q403 PolarHBondContact OD2-NE2 2.91Å; E400-Q403 PolarHBondContact O-N 3.16Å; Q403-K405 VanDerWaalsContact C-N 3.3Å; Q403-K405 PolarHBondContact O-N 2.82Å; Q403-L406 PolarHBondContact O-N 2.79Å; Q403-K407 HydrophobicContact CB-CD 4.34Å; Q403-K407 VanDerWaalsContact O-CB 3.29Å; Q403-K407 WeakPolarHBondContact O-CB 3.34Å; Q403-K407 WeakPolarHBondContact O-CG 3.42Å; Q403-K407 PolarHBondContact O-N 3.38Å
404	E	69.6	Low	69.5	Low	97 Å²	97	95.6 Å²	95.6	45%	0.453	45%	0.447	S	S	.	.	H	α-helix	trans	-52.7	-45.1	175.1	-95.1	-141.8	140.3	0	0	113.4	E400 N402 K408	E400-E404 WeakPolarHBondContact O-CB 3.39Å; E400-E404 WeakPolarHBondContact O-CG 3.26Å; E400-E404 PolarHBondContact O-N 2.86Å; N402-E404 VanDerWaalsContact C-N 3.28Å; N402-E404 PolarHBondContact O-N 2.02Å; E404-K408 VanDerWaalsContact O-CB 3.3Å; E404-K408 WeakPolarHBondContact O-CB 3.17Å; E404-K408 WeakPolarHBondContact O-CD 3.48Å; E404-K408 WeakPolarHBondContact O-CG 3.29Å; E404-K408 PolarHBondContact O-N 2.88Å; E404-K408 IonicContact OE1-NZ 2.64Å; E404-K408 PolarHBondContact OE1-NZ 3.49Å; E404-K408 IonicContact OE2-NZ 2.86Å; E404-K408 PolarHBondContact OE2-NZ 3.5Å
405	K	72.1	Confident	70.6	Confident	144 Å²	144	92 Å²	92	63%	0.626	44%	0.436	S	S	*	.	H	α-helix	trans	-67.5	-42.9	-176.8	-64.9	175.1	-174.5	167.8	0	110.5	N402 Q403 K408 F409	N402-K405 PolarHBondContact O-N 2.87Å; Q403-K405 VanDerWaalsContact C-N 3.3Å; Q403-K405 PolarHBondContact O-N 2.82Å; K405-K408 PolarHBondContact O-N 3.23Å; K405-F409 VanDerWaalsContact O-CB 3.29Å; K405-F409 WeakPolarHBondContact O-CB 3.36Å; K405-F409 PolarHBondContact O-N 3.27Å
406	L	68.6	Low	71.5	Confident	86 Å²	86	87.6 Å²	87.6	45%	0.45	41%	0.408	S	S	.	.	H	α-helix	trans	-64.9	-47.4	176.4	-176.4	57.6	0	0	0	111.2	N402 Q403 K408 F409 M410	N402-L406 PolarHBondContact O-N 3.37Å; Q403-L406 PolarHBondContact O-N 2.79Å; L406-K408 PolarHBondContact O-N 3.19Å; L406-F409 HydrophobicContact CD1-CD1 4.41Å; L406-F409 WeakPolarHBondContact O-CB 3.3Å; L406-F409 PolarHBondContact O-N 2.92Å; L406-M410 HydrophobicContact CD1-CG 4.21Å; L406-M410 HydrophobicContact CD1-SD 3.79Å; L406-M410 HydrophobicContact CD2-SD 4.48Å; L406-M410 HydrophobicContact CG-SD 3.64Å; L406-M410 WeakPolarHBondContact O-CG 2.95Å; L406-M410 PolarHBondContact O-N 3.1Å
407	K	74.6	Confident	73.1	Confident	55 Å²	55	85.4 Å²	85.4	24%	0.239	40%	0.397	C	S	.	.	H	α-helix	trans	-54.6	-51.5	173	-72.6	166.8	178.8	175.2	0	111	I396 Q403 F409 M410 I411	I396-K407 PolarHBondContact O-NZ 3.05Å; Q403-K407 HydrophobicContact CB-CD 4.34Å; Q403-K407 VanDerWaalsContact O-CB 3.29Å; Q403-K407 WeakPolarHBondContact O-CB 3.34Å; Q403-K407 WeakPolarHBondContact O-CG 3.42Å; Q403-K407 PolarHBondContact O-N 3.38Å; K407-F409 VanDerWaalsContact C-N 3.34Å; K407-F409 PolarHBondContact O-N 3.12Å; K407-M410 PolarHBondContact O-N 2.91Å; K407-I411 VanDerWaalsContact O-CD1 3.29Å; K407-I411 WeakPolarHBondContact O-CD1 3.21Å; K407-I411 WeakPolarHBondContact O-CG1 3.1Å; K407-I411 PolarHBondContact O-N 2.89Å
408	K	80.6	Confident	74.6	Confident	118 Å²	118	80 Å²	80	51%	0.513	38%	0.376	S	S	.	.	H	α-helix	trans	-61.4	-38.9	179	-73.7	165.1	-175.5	170.1	0	112.3	E404 K405 L406 R412	E404-K408 VanDerWaalsContact O-CB 3.3Å; E404-K408 WeakPolarHBondContact O-CB 3.17Å; E404-K408 WeakPolarHBondContact O-CD 3.48Å; E404-K408 WeakPolarHBondContact O-CG 3.29Å; E404-K408 PolarHBondContact O-N 2.88Å; E404-K408 IonicContact OE1-NZ 2.64Å; E404-K408 PolarHBondContact OE1-NZ 3.49Å; E404-K408 IonicContact OE2-NZ 2.86Å; E404-K408 PolarHBondContact OE2-NZ 3.5Å; K405-K408 PolarHBondContact O-N 3.23Å; L406-K408 PolarHBondContact O-N 3.19Å; K408-R412 PolarHBondContact O-N 2.76Å
409	F	77.9	Confident	76.3	Confident	57 Å²	57	75.9 Å²	75.9	25%	0.25	36%	0.36	C	S	.	.	H	α-helix	trans	-65.7	-47.1	174.9	171.7	-111.4	0	0	0	113	P227 E228 K405 L406 K407 I411 R412 I413 W489	P227-F409 HydrophobicContact CG-CE1 4.11Å; P227-F409 HydrophobicContact CG-CZ 4.38Å; E228-F409 HydrophobicContact CG-CE2 3.82Å; E228-F409 HydrophobicContact CG-CZ 3.68Å; E228-F409 WeakPolarHBondContact OE1-CE2 3.46Å; K405-F409 VanDerWaalsContact O-CB 3.29Å; K405-F409 WeakPolarHBondContact O-CB 3.36Å; K405-F409 PolarHBondContact O-N 3.27Å; L406-F409 HydrophobicContact CD1-CD1 4.41Å; L406-F409 WeakPolarHBondContact O-CB 3.3Å; L406-F409 PolarHBondContact O-N 2.92Å; K407-F409 VanDerWaalsContact C-N 3.34Å; K407-F409 PolarHBondContact O-N 3.12Å; F409-I411 PolarHBondContact O-N 2.85Å; F409-R412 VanDerWaalsContact O-CB 3.29Å; F409-R412 WeakPolarHBondContact O-CB 2.98Å; F409-R412 PolarHBondContact O-N 2.99Å; F409-R412 VanDerWaalsContact O-N 3.12Å; F409-I413 HydrophobicContact CD1-CD1 4.47Å; F409-I413 HydrophobicContact CE1-CD1 3.86Å; F409-I413 HydrophobicContact CE2-CD1 4.19Å; F409-I413 HydrophobicContact CZ-CD1 3.71Å; F409-I413 PolarHBondContact O-N 2.79Å; F409-W489 HydrophobicContact CE2-CH2 4.38Å; F409-W489 HydrophobicContact CE2-CZ2 4.19Å
410	M	79.4	Confident	77.8	Confident	16 Å²	16	72.6 Å²	72.6	8%	0.079	34%	0.343	C	S	.	.	H	α-helix	trans	-68	-35.6	-178.8	-65.4	161.7	78	0	0	112.5	W303 A306 A307 L389 L406 K407 R412 I413 G414	W303-M410 PolarHBondContact NE1-O 3.39Å; A306-M410 HydrophobicContact CB-CE 4.1Å; A306-M410 WeakPolarHBondContact O-CE 3.26Å; A307-M410 VanDerWaalsContact CA-CE 3.45Å; A307-M410 HydrophobicContact CB-CE 4.11Å; L389-M410 HydrophobicContact CD2-CE 4.02Å; L406-M410 HydrophobicContact CD1-CG 4.21Å; L406-M410 HydrophobicContact CD1-SD 3.79Å; L406-M410 HydrophobicContact CD2-SD 4.48Å; L406-M410 HydrophobicContact CG-SD 3.64Å; L406-M410 WeakPolarHBondContact O-CG 2.95Å; L406-M410 PolarHBondContact O-N 3.1Å; K407-M410 PolarHBondContact O-N 2.91Å; M410-R412 VanDerWaalsContact C-N 3.27Å; M410-R412 PolarHBondContact O-N 3.36Å; M410-I413 PolarHBondContact O-N 2.7Å; M410-G414 PolarHBondContact O-N 2.86Å
411	I	83.1	Confident	79.3	Confident	64 Å²	64	66.7 Å²	66.7	33%	0.328	32%	0.316	S	S	.	.	H	α-helix	trans	-58.2	-41.9	171.2	-66.9	158.7	0	0	0	110.3	R393 K407 F409 I413 G414 V415	R393-I411 VanDerWaalsContact NH2-CD1 3.3Å; K407-I411 VanDerWaalsContact O-CD1 3.29Å; K407-I411 WeakPolarHBondContact O-CD1 3.21Å; K407-I411 WeakPolarHBondContact O-CG1 3.1Å; K407-I411 PolarHBondContact O-N 2.89Å; F409-I411 PolarHBondContact O-N 2.85Å; I411-I413 PolarHBondContact O-N 3.08Å; I411-G414 PolarHBondContact O-N 2.85Å; I411-V415 HydrophobicContact CG2-CG2 4.31Å; I411-V415 WeakPolarHBondContact O-CG2 3.45Å; I411-V415 PolarHBondContact O-N 2.71Å
412	R	85.9	Confident	81	Confident	95 Å²	95	61.1 Å²	61.1	36%	0.358	31%	0.305	S	S	.	.	H	α-helix	trans	-61.3	-43.1	179.7	-159.7	-170	-178.6	-133.7	1.4	112.2	K408 F409 M410 F416 F488 W489	K408-R412 PolarHBondContact O-N 2.76Å; F409-R412 VanDerWaalsContact O-CB 3.29Å; F409-R412 WeakPolarHBondContact O-CB 2.98Å; F409-R412 PolarHBondContact O-N 2.99Å; F409-R412 VanDerWaalsContact O-N 3.12Å; M410-R412 VanDerWaalsContact C-N 3.27Å; M410-R412 PolarHBondContact O-N 3.36Å; R412-F416 WeakPolarHBondContact O-CB 3.27Å; R412-F416 PolarHBondContact O-N 2.88Å; R412-F488 PolarHBondContact NH2-O 3.49Å; R412-W489 HydrophobicContact CB-CH2 4.14Å; R412-W489 HydrophobicContact CB-CZ3 3.98Å; R412-W489 HydrophobicContact CG-CE3 4.39Å; R412-W489 HydrophobicContact CG-CH2 4.03Å; R412-W489 HydrophobicContact CG-CZ3 3.58Å; R412-W489 VanDerWaalsContact CZ-O 3.28Å; R412-W489 PolarHBondContact NH1-O 2.84Å; R412-W489 PolarHBondContact NH2-O 2.98Å
413	I	84.8	Confident	82.7	Confident	1 Å²	1	56.4 Å²	56.4	1%	0.005	28%	0.28	C	S	.	.	H	α-helix	trans	-67	-39.2	176.7	-59.6	175.9	0	0	0	110.9	P227 L299 W303 F409 M410 I411 F416 S417 W489	P227-I413 HydrophobicContact CB-CD1 4.45Å; P227-I413 HydrophobicContact CG-CD1 3.77Å; L299-I413 HydrophobicContact CD1-CG2 4.06Å; L299-I413 HydrophobicContact CG-CG2 4.48Å; W303-I413 HydrophobicContact CB-CG2 3.97Å; W303-I413 HydrophobicContact CG-CB 4.46Å; W303-I413 HydrophobicContact CG-CG2 3.88Å; F409-I413 HydrophobicContact CD1-CD1 4.47Å; F409-I413 HydrophobicContact CE1-CD1 3.86Å; F409-I413 HydrophobicContact CE2-CD1 4.19Å; F409-I413 HydrophobicContact CZ-CD1 3.71Å; F409-I413 PolarHBondContact O-N 2.79Å; M410-I413 PolarHBondContact O-N 2.7Å; I411-I413 PolarHBondContact O-N 3.08Å; I413-F416 PolarHBondContact O-N 3.34Å; I413-S417 WeakPolarHBondContact O-CB 3.4Å; I413-S417 PolarHBondContact O-N 3.11Å; I413-S417 PolarHBondContact O-OG 3.31Å; I413-W489 HydrophobicContact CB-CH2 4.48Å; I413-W489 HydrophobicContact CD1-CH2 4.37Å; I413-W489 HydrophobicContact CG1-CH2 3.41Å; I413-W489 VanDerWaalsContact CG1-CH2 3.41Å; I413-W489 HydrophobicContact CG1-CZ2 4.21Å; I413-W489 HydrophobicContact CG1-CZ3 3.9Å
414	G	86.3	Confident	84.1	Confident	7 Å²	7	53.7 Å²	53.7	7%	0.072	27%	0.267	C	S	.	.	H	α-helix	trans	-61.6	-50.2	176.4	0	0	0	0	0	111.9	M410 I411 F416 S417 C418	M410-G414 PolarHBondContact O-N 2.86Å; I411-G414 PolarHBondContact O-N 2.85Å; G414-F416 VanDerWaalsContact C-N 3.35Å; G414-F416 PolarHBondContact O-N 3.39Å; G414-S417 PolarHBondContact O-N 3.47Å; G414-S417 VanDerWaalsContact O-N 3.14Å; G414-C418 PolarHBondContact O-N 3.49Å; G414-C418 PolarHBondContact O-SG 3.03Å
415	V	87.9	Confident	85.3	Confident	83 Å²	83	52.2 Å²	52.2	50%	0.503	27%	0.265	S	S	.	.	H	α-helix	trans	-59	-44.1	175.8	172.3	0	0	0	0	111.5	I411 S417 C418 L419	I411-V415 HydrophobicContact CG2-CG2 4.31Å; I411-V415 WeakPolarHBondContact O-CG2 3.45Å; I411-V415 PolarHBondContact O-N 2.71Å; V415-S417 VanDerWaalsContact C-N 3.33Å; V415-S417 PolarHBondContact O-N 3.06Å; V415-C418 PolarHBondContact O-N 3.33Å; V415-L419 HydrophobicContact CG1-CD1 4.12Å; V415-L419 HydrophobicContact CG1-CG 4.46Å; V415-L419 WeakPolarHBondContact O-CG 3.05Å; V415-L419 PolarHBondContact O-N 3.15Å
416	F	87.6	Confident	86.5	Confident	13 Å²	13	47.4 Å²	47.4	6%	0.057	25%	0.248	C	C	.	.	H	α-helix	trans	-59.4	-43.1	175	-180	-90.1	0	0	0	112.1	I231 L299 R412 I413 G414 C418 L419 Y420 S485 W489	I231-F416 HydrophobicContact CD1-CD1 4.19Å; I231-F416 HydrophobicContact CD1-CE1 4.05Å; I231-F416 HydrophobicContact CD1-CZ 4.5Å; I231-F416 HydrophobicContact CG1-CE1 4Å; I231-F416 HydrophobicContact CG1-CZ 4.48Å; I231-F416 HydrophobicContact CG2-CE1 4.35Å; I231-F416 HydrophobicContact CG2-CZ 4Å; L299-F416 HydrophobicContact CD2-CD1 3.75Å; L299-F416 HydrophobicContact CD2-CE1 3.72Å; R412-F416 WeakPolarHBondContact O-CB 3.27Å; R412-F416 PolarHBondContact O-N 2.88Å; I413-F416 PolarHBondContact O-N 3.34Å; G414-F416 VanDerWaalsContact C-N 3.35Å; G414-F416 PolarHBondContact O-N 3.39Å; F416-C418 VanDerWaalsContact C-N 3.34Å; F416-C418 PolarHBondContact O-N 3.38Å; F416-L419 PolarHBondContact O-N 3.22Å; F416-Y420 PolarHBondContact O-N 2.86Å; F416-Y420 VanDerWaalsContact O-N 3.08Å; F416-S485 WeakPolarHBondContact CE2-O 3.29Å; F416-W489 HydrophobicContact CB-CE3 4.16Å; F416-W489 HydrophobicContact CB-CZ3 4.37Å; F416-W489 HydrophobicContact CD2-CB 4.21Å; F416-W489 HydrophobicContact CD2-CE3 4.15Å; F416-W489 HydrophobicContact CE2-CB 3.95Å; F416-W489 HydrophobicContact CG-CE3 4.14Å
417	S	88.3	Confident	87.8	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-66.7	-33.5	178.5	-53.8	0	0	0	0	112.6	W296 I413 G414 V415 Y420 L421	W296-S417 PolarHBondContact NE1-O 3.07Å; I413-S417 WeakPolarHBondContact O-CB 3.4Å; I413-S417 PolarHBondContact O-N 3.11Å; I413-S417 PolarHBondContact O-OG 3.31Å; G414-S417 PolarHBondContact O-N 3.47Å; G414-S417 VanDerWaalsContact O-N 3.14Å; V415-S417 VanDerWaalsContact C-N 3.33Å; V415-S417 PolarHBondContact O-N 3.06Å; S417-Y420 WeakPolarHBondContact O-CB 3.34Å; S417-L421 PolarHBondContact O-N 3.2Å
418	C	87.4	Confident	88.9	Confident	47 Å²	47	42.9 Å²	42.9	32%	0.318	23%	0.226	S	C	.	.	H	α-helix	trans	-75.1	-35.5	174.1	-63.8	0	0	0	0	113.1	G414 V415 F416 Y420 L421	G414-C418 PolarHBondContact O-N 3.49Å; G414-C418 PolarHBondContact O-SG 3.03Å; V415-C418 PolarHBondContact O-N 3.33Å; F416-C418 VanDerWaalsContact C-N 3.34Å; F416-C418 PolarHBondContact O-N 3.38Å; C418-Y420 VanDerWaalsContact C-N 3.25Å; C418-Y420 PolarHBondContact O-N 2.74Å; C418-L421 WeakPolarHBondContact O-CB 3.32Å; C418-L421 PolarHBondContact O-N 3.22Å
419	L	88.5	Confident	89.7	Confident	110 Å²	110	39.8 Å²	39.8	58%	0.576	22%	0.223	S	C	*	.	H	α-helix	trans	-63.4	-35.9	172.2	-73.2	169.6	0	0	0	111.3	V415 F416 P423	V415-L419 HydrophobicContact CG1-CD1 4.12Å; V415-L419 HydrophobicContact CG1-CG 4.46Å; V415-L419 WeakPolarHBondContact O-CG 3.05Å; V415-L419 PolarHBondContact O-N 3.15Å; F416-L419 PolarHBondContact O-N 3.22Å; L419-P423 WeakPolarHBondContact O-CD 3.35Å
420	Y	89	Confident	90.5	Very high	3 Å²	3	37.5 Å²	37.5	1%	0.012	21%	0.214	C	C	.	.	H	α-helix	trans	-68.2	-36	176	-164.2	-79.5	0	0	0	113.6	Y234 W296 F416 S417 C418 V422 P423 L424 V482	Y234-Y420 AromaticContact CD2-CE2 3.94Å; Y234-Y420 HydrophobicContact CD2-CE2 3.94Å; Y234-Y420 HydrophobicContact CE1-CE2 4.27Å; Y234-Y420 HydrophobicContact CE2-CD2 4.49Å; Y234-Y420 AromaticContact CE2-CE2 3.3Å; Y234-Y420 HydrophobicContact CE2-CE2 3.3Å; Y234-Y420 AromaticContact CE2-CZ 3.66Å; Y234-Y420 WeakPolarHBondContact CE2-OH 3.32Å; Y234-Y420 AromaticContact CZ-CE2 3.55Å; W296-Y420 HydrophobicContact CB-CD1 3.98Å; W296-Y420 HydrophobicContact CB-CE1 3.57Å; W296-Y420 AromaticContact CD1-CD1 3.1Å; W296-Y420 AromaticContact CD1-CE1 3.67Å; W296-Y420 AromaticContact CD1-CG 3.4Å; W296-Y420 AromaticContact CD2-CD1 3.77Å; W296-Y420 HydrophobicContact CD2-CD1 3.77Å; W296-Y420 AromaticContact CD2-CE1 3.99Å; W296-Y420 HydrophobicContact CD2-CE1 3.99Å; W296-Y420 AromaticContact CE2-CD1 3.79Å; W296-Y420 AromaticContact CG-CD1 3.34Å; W296-Y420 HydrophobicContact CG-CD1 3.34Å; W296-Y420 AromaticContact CG-CE1 3.44Å; W296-Y420 HydrophobicContact CG-CE1 3.44Å; W296-Y420 VanDerWaalsContact CG-CE1 3.44Å; W296-Y420 HydrophobicContact CG-CG 4.06Å; W296-Y420 AromaticContact NE1-CD1 3.36Å; W296-Y420 AromaticContact NE1-CG 3.73Å; F416-Y420 PolarHBondContact O-N 2.86Å; F416-Y420 VanDerWaalsContact O-N 3.08Å; S417-Y420 WeakPolarHBondContact O-CB 3.34Å; C418-Y420 VanDerWaalsContact C-N 3.25Å; C418-Y420 PolarHBondContact O-N 2.74Å; Y420-V422 PolarHBondContact O-N 3.48Å; Y420-P423 WeakPolarHBondContact O-CD 3.1Å; Y420-L424 HydrophobicContact CD1-CD1 3.81Å; Y420-L424 HydrophobicContact CD1-CG 3.94Å; Y420-L424 HydrophobicContact CE1-CD1 3.7Å; Y420-L424 HydrophobicContact CE1-CD2 3.96Å; Y420-L424 HydrophobicContact CE1-CG 3.75Å; Y420-V482 HydrophobicContact CE2-CG1 3.56Å; Y420-V482 WeakPolarHBondContact OH-CG1 3.36Å
421	L	92.3	Very high	91.3	Very high	26 Å²	26	38 Å²	38	14%	0.136	22%	0.215	C	C	.	.	H	α-helix	trans	-60	-33.9	179.1	174.1	68.2	0	0	0	112.3	W296 V375 L379 S417 C418 L424 V425	W296-L421 HydrophobicContact CH2-CD1 4.08Å; W296-L421 HydrophobicContact CZ2-CB 4.28Å; W296-L421 HydrophobicContact CZ2-CD1 4.11Å; V375-L421 HydrophobicContact CG1-CD1 4.34Å; L379-L421 HydrophobicContact CD2-CD1 3.92Å; L379-L421 HydrophobicContact CD2-CD2 3.55Å; L379-L421 HydrophobicContact CD2-CG 4.34Å; L379-L421 HydrophobicContact CG-CD1 3.95Å; L379-L421 HydrophobicContact CG-CD2 4.45Å; S417-L421 PolarHBondContact O-N 3.2Å; C418-L421 WeakPolarHBondContact O-CB 3.32Å; C418-L421 PolarHBondContact O-N 3.22Å; L421-L424 PolarHBondContact O-N 3.46Å; L421-V425 HydrophobicContact CD1-CG2 3.82Å; L421-V425 HydrophobicContact CG-CG2 4.13Å; L421-V425 WeakPolarHBondContact O-CG2 3.43Å; L421-V425 PolarHBondContact O-N 2.97Å
422	V	93.3	Very high	91.9	Very high	93 Å²	93	38 Å²	38	56%	0.564	22%	0.218	S	C	*	.	H	α-helix	trans	-60.2	-56.8	-176.3	170.7	0	0	0	0	111.8	Y420 L424 V425 T426	Y420-V422 PolarHBondContact O-N 3.48Å; V422-L424 VanDerWaalsContact C-N 3.31Å; V422-L424 PolarHBondContact O-N 3.45Å; V422-V425 PolarHBondContact O-N 3.49Å; V422-T426 PolarHBondContact O-N 3.1Å; V422-T426 PolarHBondContact O-OG1 2.96Å
423	P	94.6	Very high	92.4	Very high	11 Å²	11	37.4 Å²	37.4	7%	0.071	22%	0.217	C	C	.	.	H	α-helix	trans	-55.6	-37.5	172.4	-29.4	35.1	0	0	0	115.1	L419 Y420 T426 L427 M478 V482	L419-P423 WeakPolarHBondContact O-CD 3.35Å; Y420-P423 WeakPolarHBondContact O-CD 3.1Å; P423-T426 PolarHBondContact O-N 2.82Å; P423-L427 WeakPolarHBondContact O-CB 3.44Å; P423-L427 VanDerWaalsContact O-CG 3.26Å; P423-L427 WeakPolarHBondContact O-CG 3.29Å; P423-L427 PolarHBondContact O-N 3.35Å; P423-M478 HydrophobicContact CB-CB 4.2Å; P423-M478 HydrophobicContact CB-SD 4.05Å; P423-M478 HydrophobicContact CG-SD 4.2Å; P423-V482 HydrophobicContact CB-CG2 3.39Å; P423-V482 HydrophobicContact CG-CG2 3.91Å
424	L	94.3	Very high	92.8	Very high	1 Å²	1	37.6 Å²	37.6	1%	0.005	22%	0.217	C	C	.	.	H	α-helix	trans	-64.1	-40.8	177.8	-69.4	-175.6	0	0	0	112.4	I293 W296 L371 V375 Y420 L421 V422 L427 L428	I293-L424 HydrophobicContact CG1-CD2 4.46Å; W296-L424 HydrophobicContact CD2-CD1 3.71Å; W296-L424 HydrophobicContact CE3-CD1 3.38Å; W296-L424 HydrophobicContact CH2-CD1 3.66Å; W296-L424 HydrophobicContact CZ2-CD1 3.98Å; W296-L424 HydrophobicContact CZ3-CD1 3.35Å; L371-L424 HydrophobicContact CD1-CB 4.5Å; L371-L424 HydrophobicContact CD1-CD2 3.96Å; V375-L424 HydrophobicContact CG2-CB 3.81Å; V375-L424 HydrophobicContact CG2-CD1 4.15Å; Y420-L424 HydrophobicContact CD1-CD1 3.81Å; Y420-L424 HydrophobicContact CD1-CG 3.94Å; Y420-L424 HydrophobicContact CE1-CD1 3.7Å; Y420-L424 HydrophobicContact CE1-CD2 3.96Å; Y420-L424 HydrophobicContact CE1-CG 3.75Å; L421-L424 PolarHBondContact O-N 3.46Å; V422-L424 VanDerWaalsContact C-N 3.31Å; V422-L424 PolarHBondContact O-N 3.45Å; L424-L427 PolarHBondContact O-N 2.95Å; L424-L428 WeakPolarHBondContact O-CB 2.95Å; L424-L428 PolarHBondContact O-N 3.26Å
425	V	95.9	Very high	93.2	Very high	67 Å²	67	38.8 Å²	38.8	41%	0.406	22%	0.221	S	C	.	.	H	α-helix	trans	-69.2	-37.4	176.5	173.1	0	0	0	0	110.8	V375 L421 V422 L428 A429	V375-V425 HydrophobicContact CG1-CG2 4.21Å; L421-V425 HydrophobicContact CD1-CG2 3.82Å; L421-V425 HydrophobicContact CG-CG2 4.13Å; L421-V425 WeakPolarHBondContact O-CG2 3.43Å; L421-V425 PolarHBondContact O-N 2.97Å; V422-V425 PolarHBondContact O-N 3.49Å; V425-L428 PolarHBondContact O-N 3.38Å; V425-A429 PolarHBondContact O-N 2.8Å
426	T	96.6	Very high	93.4	Very high	42 Å²	42	38.9 Å²	38.9	26%	0.258	23%	0.225	S	C	.	.	H	α-helix	trans	-65.2	-43.3	173.1	-52.1	0	0	0	0	112	V422 P423 L428 A429 C430 V474 M478	V422-T426 PolarHBondContact O-N 3.1Å; V422-T426 PolarHBondContact O-OG1 2.96Å; P423-T426 PolarHBondContact O-N 2.82Å; T426-L428 VanDerWaalsContact C-N 3.32Å; T426-L428 PolarHBondContact O-N 3.48Å; T426-A429 WeakPolarHBondContact O-CB 3.02Å; T426-A429 PolarHBondContact O-N 3.39Å; T426-C430 PolarHBondContact O-N 3.46Å; T426-C430 PolarHBondContact O-SG 3.15Å; T426-C430 VanDerWaalsContact O-SG 3.35Å; T426-V474 HydrophobicContact CG2-CG1 3.67Å; T426-M478 HydrophobicContact CG2-CG 3.77Å; T426-M478 HydrophobicContact CG2-SD 4.41Å
427	L	96.3	Very high	93.6	Very high	12 Å²	12	40.7 Å²	40.7	6%	0.063	23%	0.234	C	C	.	.	H	α-helix	trans	-60.4	-42.4	174	-73.8	169	0	0	0	111.7	L371 P423 L424 A429 C430 Y431 K475 M478 T479	L371-L427 HydrophobicContact CD2-CB 4.24Å; P423-L427 WeakPolarHBondContact O-CB 3.44Å; P423-L427 VanDerWaalsContact O-CG 3.26Å; P423-L427 WeakPolarHBondContact O-CG 3.29Å; P423-L427 PolarHBondContact O-N 3.35Å; L424-L427 PolarHBondContact O-N 2.95Å; L427-A429 VanDerWaalsContact C-N 3.33Å; L427-A429 PolarHBondContact O-N 2.67Å; L427-C430 PolarHBondContact O-N 3.44Å; L427-Y431 HydrophobicContact CB-CE2 4.5Å; L427-Y431 WeakPolarHBondContact O-CD2 3.21Å; L427-Y431 PolarHBondContact O-N 3.41Å; L427-K475 HydrophobicContact CD2-CG 4.12Å; L427-K475 VanDerWaalsContact CD2-O 3.25Å; L427-K475 WeakPolarHBondContact CD2-O 3.32Å; L427-M478 HydrophobicContact CD1-CB 4.47Å; L427-M478 HydrophobicContact CD2-CB 3.96Å; L427-M478 HydrophobicContact CG-CB 3.87Å; L427-T479 WeakPolarHBondContact CD2-OG1 3.39Å
428	L	96.8	Very high	93.7	Very high	34 Å²	34	41 Å²	41	18%	0.178	24%	0.235	C	C	.	.	H	α-helix	trans	-60.9	-42.1	175.6	178	57.1	0	0	0	111.3	L368 L371 C372 V375 L424 V425 T426 Y431 T432	L368-L428 HydrophobicContact CD1-CD1 3.52Å; L368-L428 HydrophobicContact CG-CD1 4.49Å; L371-L428 HydrophobicContact CD2-CB 4.03Å; L371-L428 HydrophobicContact CD2-CD1 4.41Å; L371-L428 HydrophobicContact CG-CB 4.4Å; C372-L428 WeakPolarHBondContact SG-CD1 3.46Å; V375-L428 HydrophobicContact CG1-CD2 4.33Å; L424-L428 WeakPolarHBondContact O-CB 2.95Å; L424-L428 PolarHBondContact O-N 3.26Å; V425-L428 PolarHBondContact O-N 3.38Å; T426-L428 VanDerWaalsContact C-N 3.32Å; T426-L428 PolarHBondContact O-N 3.48Å; L428-Y431 PolarHBondContact O-N 3.02Å; L428-T432 HydrophobicContact CD1-CG2 4.18Å; L428-T432 WeakPolarHBondContact O-CG2 3.46Å; L428-T432 PolarHBondContact O-N 2.96Å; L428-T432 PolarHBondContact O-OG1 3.34Å; L428-T432 VanDerWaalsContact O-OG1 3.06Å
429	A	96.8	Very high	93.7	Very high	54 Å²	54	41.8 Å²	41.8	45%	0.446	24%	0.241	S	C	.	.	H	α-helix	trans	-64.7	-40.9	174.2	0	0	0	0	0	113	V425 T426 L427 T432 Y433	V425-A429 PolarHBondContact O-N 2.8Å; T426-A429 WeakPolarHBondContact O-CB 3.02Å; T426-A429 PolarHBondContact O-N 3.39Å; L427-A429 VanDerWaalsContact C-N 3.33Å; L427-A429 PolarHBondContact O-N 2.67Å; A429-T432 PolarHBondContact O-OG1 3.04Å; A429-Y433 VanDerWaalsContact O-CB 3.26Å; A429-Y433 WeakPolarHBondContact O-CB 3.46Å; A429-Y433 PolarHBondContact O-N 3.32Å
430	C	96.5	Very high	93.7	Very high	8 Å²	8	38.6 Å²	38.6	5%	0.054	23%	0.228	C	C	.	.	H	α-helix	trans	-60	-50.2	174	-68	0	0	0	0	111.4	T426 L427 Y433 E434 L471 K475	T426-C430 PolarHBondContact O-N 3.46Å; T426-C430 PolarHBondContact O-SG 3.15Å; T426-C430 VanDerWaalsContact O-SG 3.35Å; L427-C430 PolarHBondContact O-N 3.44Å; C430-Y433 PolarHBondContact O-N 3.28Å; C430-E434 WeakPolarHBondContact O-CG 3.44Å; C430-E434 PolarHBondContact O-N 2.88Å; C430-L471 HydrophobicContact CB-CD2 4.34Å; C430-K475 HydrophobicContact CB-CB 4.22Å
431	Y	96.3	Very high	93.8	Very high	27 Å²	27	38.5 Å²	38.5	11%	0.106	23%	0.228	C	C	.	.	H	α-helix	trans	-68	-36.2	-178.1	-72.3	-59.4	0	0	0	113.3	L363 V367 L371 L427 L428 Q435 K475	L363-Y431 HydrophobicContact CD1-CD1 3.81Å; L363-Y431 HydrophobicContact CD1-CE1 4.3Å; V367-Y431 HydrophobicContact CG1-CD1 4.29Å; V367-Y431 HydrophobicContact CG1-CD2 4.16Å; V367-Y431 HydrophobicContact CG1-CE1 3.95Å; V367-Y431 HydrophobicContact CG1-CE2 3.84Å; V367-Y431 HydrophobicContact CG1-CG 4.39Å; L371-Y431 HydrophobicContact CD2-CD2 3.92Å; L371-Y431 HydrophobicContact CD2-CE2 4.36Å; L427-Y431 HydrophobicContact CB-CE2 4.5Å; L427-Y431 WeakPolarHBondContact O-CD2 3.21Å; L427-Y431 PolarHBondContact O-N 3.41Å; L428-Y431 PolarHBondContact O-N 3.02Å; Y431-Q435 WeakPolarHBondContact O-CB 3.39Å; Y431-Q435 PolarHBondContact O-N 2.97Å; Y431-K475 HydrophobicContact CD1-CD 4.31Å; Y431-K475 HydrophobicContact CE1-CD 3.71Å
432	T	95.8	Very high	93.6	Very high	64 Å²	64	38 Å²	38	39%	0.393	23%	0.225	S	C	.	.	H	α-helix	trans	-69.4	-36.9	174.3	53.7	0	0	0	0	112.4	L368 L428 A429 Q435 S436	L368-T432 HydrophobicContact CD1-CG2 3.86Å; L368-T432 HydrophobicContact CD2-CG2 4.27Å; L428-T432 HydrophobicContact CD1-CG2 4.18Å; L428-T432 WeakPolarHBondContact O-CG2 3.46Å; L428-T432 PolarHBondContact O-N 2.96Å; L428-T432 PolarHBondContact O-OG1 3.34Å; L428-T432 VanDerWaalsContact O-OG1 3.06Å; A429-T432 PolarHBondContact O-OG1 3.04Å; T432-Q435 PolarHBondContact O-N 2.91Å; T432-S436 PolarHBondContact O-N 2.82Å; T432-S436 PolarHBondContact O-OG 2.78Å
433	Y	95.1	Very high	93.2	Very high	83 Å²	83	37.2 Å²	37.2	33%	0.325	22%	0.217	S	C	.	.	H	α-helix	trans	-66.8	-43.5	174.7	-178.1	-87.8	0	0	0	112.1	A429 C430 S436 H437 W441 L471	A429-Y433 VanDerWaalsContact O-CB 3.26Å; A429-Y433 WeakPolarHBondContact O-CB 3.46Å; A429-Y433 PolarHBondContact O-N 3.32Å; C430-Y433 PolarHBondContact O-N 3.28Å; Y433-S436 PolarHBondContact O-N 2.98Å; Y433-S436 PolarHBondContact O-OG 3.49Å; Y433-S436 VanDerWaalsContact O-OG 3.09Å; Y433-H437 AromaticContact CD2-CE1 3.46Å; Y433-H437 VanDerWaalsContact CD2-CE1 3.46Å; Y433-H437 WeakPolarHBondContact CD2-CE1 3.43Å; Y433-H437 AromaticContact CD2-ND1 3.68Å; Y433-H437 AromaticContact CE2-CE1 3.2Å; Y433-H437 WeakPolarHBondContact CE2-CE1 3.27Å; Y433-H437 AromaticContact CE2-ND1 3.62Å; Y433-H437 AromaticContact CE2-NE2 3.81Å; Y433-H437 AromaticContact CG-ND1 3.88Å; Y433-H437 AromaticContact CZ-CE1 3.71Å; Y433-H437 AromaticContact CZ-ND1 3.79Å; Y433-H437 PolarHBondContact O-N 3.4Å; Y433-H437 PolarHBondContact O-ND1 3.14Å; Y433-W441 HydrophobicContact CD1-CH2 4.13Å; Y433-W441 HydrophobicContact CD1-CZ2 4.18Å; Y433-W441 HydrophobicContact CE1-CH2 4.03Å; Y433-W441 AromaticContact CE1-CZ2 3.67Å; Y433-W441 HydrophobicContact CE1-CZ2 3.67Å; Y433-L471 HydrophobicContact CD1-CD1 3.25Å; Y433-L471 HydrophobicContact CD1-CD2 4.38Å; Y433-L471 HydrophobicContact CD1-CG 4.44Å; Y433-L471 HydrophobicContact CE1-CD1 3.68Å; Y433-L471 HydrophobicContact CG-CD1 3.8Å
434	E	93.8	Very high	92.8	Very high	4 Å²	4	36.8 Å²	36.8	2%	0.019	21%	0.214	C	C	.	.	H	α-helix	trans	-60	-46.1	172.6	-76.7	178.7	-123.4	0	0	111.3	C430 S436 R438 W441 L471 F472 K475	C430-E434 WeakPolarHBondContact O-CG 3.44Å; C430-E434 PolarHBondContact O-N 2.88Å; E434-S436 PolarHBondContact O-N 2.03Å; E434-R438 VanDerWaalsContact O-CB 3.27Å; E434-R438 WeakPolarHBondContact O-CB 3.37Å; E434-R438 PolarHBondContact O-N 3.34Å; E434-R438 IonicContact OE2-NH2 3.76Å; E434-W441 HydrophobicContact CB-CH2 4.41Å; E434-W441 HydrophobicContact CB-CZ3 4.28Å; E434-W441 HydrophobicContact CG-CH2 4.03Å; E434-W441 HydrophobicContact CG-CZ3 4.03Å; E434-L471 HydrophobicContact CG-CD2 3.85Å; E434-F472 HydrophobicContact CG-CZ 4.31Å; E434-K475 VanDerWaalsContact OE1-CD 3.31Å; E434-K475 WeakPolarHBondContact OE1-CD 3.48Å; E434-K475 VanDerWaalsContact OE1-CE 3.24Å; E434-K475 WeakPolarHBondContact OE1-CE 3.27Å; E434-K475 IonicContact OE1-NZ 2.76Å; E434-K475 PolarHBondContact OE1-NZ 3.31Å; E434-K475 IonicContact OE2-NZ 3.76Å; E434-K475 PolarHBondContact OE2-NZ 2.85Å
435	Q	94.1	Very high	92.6	Very high	33 Å²	33	37 Å²	37	15%	0.154	22%	0.215	C	C	.	.	H	α-helix	trans	-60.6	-41.6	178.6	-173.5	-172.5	-66.6	0	0	112.6	L360 L363 L368 Y431 T432	L360-Q435 HydrophobicContact CD2-CG 4.18Å; L363-Q435 HydrophobicContact CD2-CB 4.06Å; L363-Q435 HydrophobicContact CD2-CG 4.49Å; L368-Q435 VanDerWaalsContact CD2-OE1 3.24Å; Y431-Q435 WeakPolarHBondContact O-CB 3.39Å; Y431-Q435 PolarHBondContact O-N 2.97Å; T432-Q435 PolarHBondContact O-N 2.91Å
436	S	93.3	Very high	92.1	Very high	84 Å²	84	34.8 Å²	34.8	59%	0.587	20%	0.201	S	C	*	.	H	α-helix	trans	-74.4	-32.2	-175.3	58.4	0	0	0	0	113.5	T432 Y433 E434	T432-S436 PolarHBondContact O-N 2.82Å; T432-S436 PolarHBondContact O-OG 2.78Å; Y433-S436 PolarHBondContact O-N 2.98Å; Y433-S436 PolarHBondContact O-OG 3.49Å; Y433-S436 VanDerWaalsContact O-OG 3.09Å; E434-S436 PolarHBondContact O-N 2.03Å
437	H	92	Very high	91.6	Very high	52 Å²	52	34.5 Å²	34.5	24%	0.241	20%	0.197	C	C	.	.	H	α-helix	trans	-96.5	-12.1	-178.6	-62.8	81.1	0	0	0	113.9	Y433 S439 S440 W441	Y433-H437 AromaticContact CD2-CE1 3.46Å; Y433-H437 VanDerWaalsContact CD2-CE1 3.46Å; Y433-H437 WeakPolarHBondContact CD2-CE1 3.43Å; Y433-H437 AromaticContact CD2-ND1 3.68Å; Y433-H437 AromaticContact CE2-CE1 3.2Å; Y433-H437 WeakPolarHBondContact CE2-CE1 3.27Å; Y433-H437 AromaticContact CE2-ND1 3.62Å; Y433-H437 AromaticContact CE2-NE2 3.81Å; Y433-H437 AromaticContact CG-ND1 3.88Å; Y433-H437 AromaticContact CZ-CE1 3.71Å; Y433-H437 AromaticContact CZ-ND1 3.79Å; Y433-H437 PolarHBondContact O-N 3.4Å; Y433-H437 PolarHBondContact O-ND1 3.14Å; H437-S439 PolarHBondContact O-N 3.11Å; H437-S440 WeakPolarHBondContact O-CA 3.36Å; H437-S440 WeakPolarHBondContact O-CB 3.41Å; H437-S440 PolarHBondContact O-N 3.03Å; H437-W441 HydrophobicContact CB-CD2 4.16Å; H437-W441 VanDerWaalsContact CB-CE2 3.44Å; H437-W441 HydrophobicContact CB-CH2 4.15Å; H437-W441 HydrophobicContact CB-CZ2 3.43Å; H437-W441 VanDerWaalsContact CB-CZ2 3.43Å; H437-W441 PolarHBondContact O-N 3.1Å; H437-W441 VanDerWaalsContact O-N 3.13Å
438	R	90.2	Very high	91.1	Very high	6 Å²	6	37.3 Å²	37.3	2%	0.023	21%	0.212	C	C	.	.	H	α-helix	trans	-48	-52.7	-171.1	-174	60.4	67.3	83.2	-5.2	114.2	L357 L360 E434 S440 W441 E442	L357-R438 PolarHBondContact O-NH1 3.18Å; L357-R438 PolarHBondContact O-NH2 2.91Å; L360-R438 HydrophobicContact CD1-CB 4.38Å; L360-R438 HydrophobicContact CD1-CG 4.34Å; L360-R438 HydrophobicContact CD2-CB 3.87Å; L360-R438 HydrophobicContact CD2-CG 3.91Å; L360-R438 HydrophobicContact CG-CB 4.5Å; L360-R438 HydrophobicContact CG-CG 4.21Å; E434-R438 VanDerWaalsContact O-CB 3.27Å; E434-R438 WeakPolarHBondContact O-CB 3.37Å; E434-R438 PolarHBondContact O-N 3.34Å; E434-R438 IonicContact OE2-NH2 3.76Å; R438-S440 PolarHBondContact O-N 3.03Å; R438-W441 WeakPolarHBondContact O-CB 3.42Å; R438-W441 PolarHBondContact O-N 3.31Å; R438-W441 VanDerWaalsContact O-N 3.07Å; R438-E442 VanDerWaalsContact CD-OE1 3.26Å; R438-E442 WeakPolarHBondContact CD-OE1 3.25Å; R438-E442 HydrophobicContact CG-CG 4.37Å; R438-E442 WeakPolarHBondContact CG-OE1 3.48Å; R438-E442 WeakPolarHBondContact O-CG 3.24Å; R438-E442 PolarHBondContact O-N 2.8Å
439	S	86.2	Confident	90.5	Very high	64 Å²	64	39.1 Å²	39.1	45%	0.448	22%	0.217	S	C	.	.	H	α-helix	trans	-63.3	-30.1	-178.9	178.7	0	0	0	0	112.7	H437 N443	H437-S439 PolarHBondContact O-N 3.11Å; S439-N443 VanDerWaalsContact O-CB 3.27Å; S439-N443 WeakPolarHBondContact O-CB 3.42Å; S439-N443 PolarHBondContact O-N 2.01Å; S439-N443 PolarHBondContact O-ND2 2.8Å
440	S	88.4	Confident	89.8	Confident	42 Å²	42	36.8 Å²	36.8	29%	0.294	20%	0.197	S	C	.	.	H	α-helix	trans	-70.2	-38.4	173.9	-178.6	0	0	0	0	111.8	H437 R438 T444	H437-S440 WeakPolarHBondContact O-CA 3.36Å; H437-S440 WeakPolarHBondContact O-CB 3.41Å; H437-S440 PolarHBondContact O-N 3.03Å; R438-S440 PolarHBondContact O-N 3.03Å; S440-T444 VanDerWaalsContact O-CB 3.27Å; S440-T444 WeakPolarHBondContact O-CB 3.42Å; S440-T444 PolarHBondContact O-N 3.15Å; S440-T444 PolarHBondContact O-OG1 2.9Å
441	W	90.8	Very high	89.2	Confident	2 Å²	2	44.7 Å²	44.7	1%	0.008	23%	0.234	C	C	.	.	H	α-helix	trans	-69.9	-39.2	175.3	-55.7	-21.7	0	0	0	112.3	Y186 Y433 E434 H437 R438 T444 W445 P467 F472	Y186-W441 HydrophobicContact CD1-CB 4.16Å; Y186-W441 HydrophobicContact CE1-CB 3.66Å; Y433-W441 HydrophobicContact CD1-CH2 4.13Å; Y433-W441 HydrophobicContact CD1-CZ2 4.18Å; Y433-W441 HydrophobicContact CE1-CH2 4.03Å; Y433-W441 AromaticContact CE1-CZ2 3.67Å; Y433-W441 HydrophobicContact CE1-CZ2 3.67Å; E434-W441 HydrophobicContact CB-CH2 4.41Å; E434-W441 HydrophobicContact CB-CZ3 4.28Å; E434-W441 HydrophobicContact CG-CH2 4.03Å; E434-W441 HydrophobicContact CG-CZ3 4.03Å; H437-W441 HydrophobicContact CB-CD2 4.16Å; H437-W441 VanDerWaalsContact CB-CE2 3.44Å; H437-W441 HydrophobicContact CB-CH2 4.15Å; H437-W441 HydrophobicContact CB-CZ2 3.43Å; H437-W441 VanDerWaalsContact CB-CZ2 3.43Å; H437-W441 PolarHBondContact O-N 3.1Å; H437-W441 VanDerWaalsContact O-N 3.13Å; R438-W441 WeakPolarHBondContact O-CB 3.42Å; R438-W441 PolarHBondContact O-N 3.31Å; R438-W441 VanDerWaalsContact O-N 3.07Å; W441-T444 PolarHBondContact O-N 3.29Å; W441-W445 WeakPolarHBondContact O-CB 3.36Å; W441-W445 PolarHBondContact O-N 3.45Å; W441-P467 HydrophobicContact CD2-CB 3.93Å; W441-P467 HydrophobicContact CD2-CG 4.11Å; W441-P467 HydrophobicContact CE3-CB 4.1Å; W441-P467 HydrophobicContact CE3-CG 4.3Å; W441-P467 HydrophobicContact CG-CG 4.43Å; W441-P467 HydrophobicContact CH2-CB 3.91Å; W441-P467 HydrophobicContact CZ2-CB 3.71Å; W441-P467 HydrophobicContact CZ3-CB 4.09Å; W441-F472 HydrophobicContact CZ3-CE2 4.48Å; W441-F472 HydrophobicContact CZ3-CZ 4.25Å
442	E	88.3	Confident	88.6	Confident	16 Å²	16	48.7 Å²	48.7	8%	0.075	25%	0.253	C	S	.	.	H	α-helix	trans	-65.7	-46.8	175.9	-72.7	163.8	170.8	0	0	111.1	L173 R438 T444 W445 I446	L173-E442 HydrophobicContact CD2-CB 3.9Å; L173-E442 HydrophobicContact CD2-CG 3.95Å; R438-E442 VanDerWaalsContact CD-OE1 3.26Å; R438-E442 WeakPolarHBondContact CD-OE1 3.25Å; R438-E442 HydrophobicContact CG-CG 4.37Å; R438-E442 WeakPolarHBondContact CG-OE1 3.48Å; R438-E442 WeakPolarHBondContact O-CG 3.24Å; R438-E442 PolarHBondContact O-N 2.8Å; E442-T444 VanDerWaalsContact C-N 3.33Å; E442-T444 PolarHBondContact O-N 2.72Å; E442-W445 PolarHBondContact O-N 2.82Å; E442-I446 VanDerWaalsContact O-CG1 3.32Å; E442-I446 WeakPolarHBondContact O-CG1 3.38Å; E442-I446 PolarHBondContact O-N 2.71Å
443	N	85.3	Confident	87.9	Confident	75 Å²	75	45.9 Å²	45.9	40%	0.401	24%	0.235	S	C	.	.	H	α-helix	trans	-62.9	-38	174.2	-71	-27.7	0	0	0	112.4	S439 I446 N447	S439-N443 VanDerWaalsContact O-CB 3.27Å; S439-N443 WeakPolarHBondContact O-CB 3.42Å; S439-N443 PolarHBondContact O-N 2.01Å; S439-N443 PolarHBondContact O-ND2 2.8Å; N443-I446 PolarHBondContact O-N 2.83Å; N443-N447 PolarHBondContact O-N 3.06Å
444	T	87.3	Confident	87	Confident	2 Å²	2	45 Å²	45	1%	0.012	24%	0.241	C	C	.	.	H	α-helix	trans	-62.7	-44.9	173.6	-64.1	0	0	0	0	111	S440 W441 E442 N447 D448 L464 H465 R466	S440-T444 VanDerWaalsContact O-CB 3.27Å; S440-T444 WeakPolarHBondContact O-CB 3.42Å; S440-T444 PolarHBondContact O-N 3.15Å; S440-T444 PolarHBondContact O-OG1 2.9Å; W441-T444 PolarHBondContact O-N 3.29Å; E442-T444 VanDerWaalsContact C-N 3.33Å; E442-T444 PolarHBondContact O-N 2.72Å; T444-N447 PolarHBondContact O-N 2.96Å; T444-D448 VanDerWaalsContact O-CB 3.3Å; T444-D448 WeakPolarHBondContact O-CB 3.37Å; T444-D448 VanDerWaalsContact O-CG 3.32Å; T444-D448 PolarHBondContact O-N 3.45Å; T444-L464 HydrophobicContact CG2-CB 4.5Å; T444-L464 HydrophobicContact CG2-CD2 3.94Å; T444-H465 PolarHBondContact OG1-O 2.84Å; T444-R466 HydrophobicContact CG2-CG 3.85Å
445	W	89.1	Confident	86.4	Confident	7 Å²	7	45.2 Å²	45.2	3%	0.027	24%	0.243	C	C	.	.	H	α-helix	trans	-64.8	-40	176.4	176.2	82.4	0	0	0	112.9	F156 L162 F172 L173 P181 M185 W441 E442 D448 R449 Y453	F156-W445 HydrophobicContact CE2-CZ3 4.32Å; L162-W445 HydrophobicContact CD1-CH2 3.94Å; F172-W445 HydrophobicContact CE1-CH2 4.25Å; F172-W445 HydrophobicContact CE1-CZ3 4.05Å; F172-W445 HydrophobicContact CZ-CZ3 4.17Å; L173-W445 HydrophobicContact CD1-CZ3 4.45Å; P181-W445 HydrophobicContact CG-CZ2 4.03Å; M185-W445 HydrophobicContact CB-CG 4.09Å; M185-W445 HydrophobicContact CE-CB 4.27Å; M185-W445 HydrophobicContact CE-CD2 3.72Å; M185-W445 HydrophobicContact CE-CE3 3.8Å; M185-W445 HydrophobicContact CE-CG 3.92Å; M185-W445 HydrophobicContact CE-CZ3 4.46Å; M185-W445 HydrophobicContact CG-CD2 4.3Å; M185-W445 HydrophobicContact CG-CG 4.39Å; W441-W445 WeakPolarHBondContact O-CB 3.36Å; W441-W445 PolarHBondContact O-N 3.45Å; E442-W445 PolarHBondContact O-N 2.82Å; W445-D448 PolarHBondContact O-N 3.27Å; W445-R449 WeakPolarHBondContact O-CB 3.43Å; W445-R449 WeakPolarHBondContact O-CG 3.05Å; W445-R449 PolarHBondContact O-N 3Å; W445-R449 VanDerWaalsContact O-N 3.09Å; W445-Y453 HydrophobicContact CH2-CD2 4.37Å; W445-Y453 HydrophobicContact CH2-CE2 4.3Å; W445-Y453 HydrophobicContact CZ2-CD2 4.18Å; W445-Y453 AromaticContact CZ2-CE2 3.73Å; W445-Y453 HydrophobicContact CZ2-CE2 3.73Å
446	I	86.3	Confident	85.4	Confident	20 Å²	20	45.3 Å²	45.3	10%	0.103	25%	0.246	C	C	.	.	H	α-helix	trans	-58	-53.7	172.9	-66.4	164.7	0	0	0	109.2	F156 L173 E442 N443 D448 R449 C450 I455	F156-I446 HydrophobicContact CD2-CD1 4.09Å; F156-I446 HydrophobicContact CD2-CG1 4.2Å; L173-I446 HydrophobicContact CD1-CD1 4.09Å; L173-I446 HydrophobicContact CD1-CG1 4.28Å; E442-I446 VanDerWaalsContact O-CG1 3.32Å; E442-I446 WeakPolarHBondContact O-CG1 3.38Å; E442-I446 PolarHBondContact O-N 2.71Å; N443-I446 PolarHBondContact O-N 2.83Å; I446-D448 PolarHBondContact O-N 3.12Å; I446-R449 CarbonylContact O-C 3.54Å; I446-R449 PolarHBondContact O-N 3.33Å; I446-C450 WeakPolarHBondContact O-CA 3.05Å; I446-C450 WeakPolarHBondContact O-CB 3.45Å; I446-C450 PolarHBondContact O-N 2.98Å; I446-I455 HydrophobicContact CG2-CG2 4.05Å
447	N	84.7	Confident	84.4	Confident	36 Å²	36	43.9 Å²	43.9	19%	0.193	24%	0.235	C	C	.	.	H	α-helix	trans	-65	-36.7	-178.4	-76.1	-17.1	0	0	0	113	N443 T444 R449 C450 S458 T462	N443-N447 PolarHBondContact O-N 3.06Å; T444-N447 PolarHBondContact O-N 2.96Å; N447-R449 VanDerWaalsContact C-N 3.29Å; N447-R449 PolarHBondContact O-N 2.03Å; N447-C450 PolarHBondContact O-SG 2.74Å; N447-C450 VanDerWaalsContact O-SG 3.42Å; N447-S458 WeakPolarHBondContact OD1-CB 3.47Å; N447-S458 PolarHBondContact OD1-N 2.94Å; N447-S458 VanDerWaalsContact OD1-N 3.08Å; N447-T462 PolarHBondContact ND2-OG1 2.03Å
448	D	85.6	Confident	83.5	Confident	70 Å²	70	43.2 Å²	43.2	37%	0.374	24%	0.236	S	C	.	.	H	α-helix	trans	-65	-29.1	175.9	-83.1	-26.2	0	0	0	112.8	T444 W445 I446 R466	T444-D448 VanDerWaalsContact O-CB 3.3Å; T444-D448 WeakPolarHBondContact O-CB 3.37Å; T444-D448 VanDerWaalsContact O-CG 3.32Å; T444-D448 PolarHBondContact O-N 3.45Å; W445-D448 PolarHBondContact O-N 3.27Å; I446-D448 PolarHBondContact O-N 3.12Å; D448-R466 IonicContact OD1-CZ 3.97Å; D448-R466 IonicContact OD1-NH2 3.71Å; D448-R466 PolarHBondContact OD1-NH2 3.46Å; D448-R466 IonicContact OD2-CZ 3.99Å; D448-R466 VanDerWaalsContact OD2-CZ 3.27Å; D448-R466 IonicContact OD2-NE 2.61Å; D448-R466 PolarHBondContact OD2-NE 3.48Å; D448-R466 IonicContact OD2-NH2 2.7Å; D448-R466 PolarHBondContact OD2-NH2 3.17Å
449	R	85.8	Confident	82.3	Confident	72 Å²	72	49.6 Å²	49.6	27%	0.272	27%	0.266	S	S	.	.	H	α-helix	trans	-124.1	4.4	-169.2	-50.9	-62.5	-72.3	-76.5	-2.1	114.6	W445 I446 N447 Q451 E452 Y453	W445-R449 WeakPolarHBondContact O-CB 3.43Å; W445-R449 WeakPolarHBondContact O-CG 3.05Å; W445-R449 PolarHBondContact O-N 3Å; W445-R449 VanDerWaalsContact O-N 3.09Å; I446-R449 CarbonylContact O-C 3.54Å; I446-R449 PolarHBondContact O-N 3.33Å; N447-R449 VanDerWaalsContact C-N 3.29Å; N447-R449 PolarHBondContact O-N 2.03Å; R449-Q451 VanDerWaalsContact C-N 3.3Å; R449-Q451 PolarHBondContact O-N 3.35Å; R449-E452 IonicContact CZ-OE1 3.81Å; R449-E452 IonicContact CZ-OE2 3.95Å; R449-E452 IonicContact NE-OE1 3.03Å; R449-E452 IonicContact NE-OE2 3.85Å; R449-E452 PolarHBondContact NE-OE2 2.92Å; R449-E452 IonicContact NH2-OE1 2.84Å; R449-E452 PolarHBondContact NH2-OE1 3.26Å; R449-E452 IonicContact NH2-OE2 3.94Å; R449-E452 PolarHBondContact NH2-OE2 3.14Å; R449-E452 PolarHBondContact O-N 3.25Å; R449-E452 VanDerWaalsContact O-N 3.1Å; R449-Y453 HydrophobicContact CB-CD2 3.77Å; R449-Y453 HydrophobicContact CB-CE2 3.97Å; R449-Y453 PolarHBondContact O-N 3.11Å; R449-Y453 VanDerWaalsContact O-N 3.12Å
450	C	81.8	Confident	81.2	Confident	6 Å²	6	52.8 Å²	52.8	4%	0.041	27%	0.272	C	S	.	.	H	α-helix	trans	-58.4	-40	-174.2	59.4	0	0	0	0	112.7	I446 N447 S454 I455 C457	I446-C450 WeakPolarHBondContact O-CA 3.05Å; I446-C450 WeakPolarHBondContact O-CB 3.45Å; I446-C450 PolarHBondContact O-N 2.98Å; N447-C450 PolarHBondContact O-SG 2.74Å; N447-C450 VanDerWaalsContact O-SG 3.42Å; C450-S454 CarbonylContact O-C 3.57Å; C450-S454 VanDerWaalsContact O-CA 3.29Å; C450-S454 WeakPolarHBondContact O-CA 3.25Å; C450-S454 PolarHBondContact O-N 3.35Å; C450-I455 HydrophobicContact CB-CB 4.43Å; C450-I455 WeakPolarHBondContact CB-O 3.44Å; C450-I455 PolarHBondContact O-N 3.23Å; C450-C457 HydrophobicContact CB-CB 3.89Å; C450-C457 WeakPolarHBondContact CB-SG 3.28Å; C450-C457 WeakPolarHBondContact SG-CB 3.42Å; C450-C457 CovalentContact SG-SG 2.04Å; C450-C457 PolarHBondContact SG-SG 3.08Å
451	Q	82.9	Confident	79.6	Confident	174 Å²	174	56.1 Å²	56.1	81%	0.813	30%	0.302	S	S	*	.	H	α-helix	trans	-68.6	-34.9	177.5	-64.6	-176.3	-9.3	0	0	113.4	R449	R449-Q451 VanDerWaalsContact C-N 3.3Å; R449-Q451 PolarHBondContact O-N 3.35Å
452	E	84.1	Confident	78.1	Confident	110 Å²	110	58.7 Å²	58.7	51%	0.514	32%	0.318	S	S	.	.	H	α-helix	trans	-73.1	-40.9	-179	-175.5	-174.1	147	0	0	111.7	R449	R449-E452 IonicContact CZ-OE1 3.81Å; R449-E452 IonicContact CZ-OE2 3.95Å; R449-E452 IonicContact NE-OE1 3.03Å; R449-E452 IonicContact NE-OE2 3.85Å; R449-E452 PolarHBondContact NE-OE2 2.92Å; R449-E452 IonicContact NH2-OE1 2.84Å; R449-E452 PolarHBondContact NH2-OE1 3.26Å; R449-E452 IonicContact NH2-OE2 3.94Å; R449-E452 PolarHBondContact NH2-OE2 3.14Å; R449-E452 PolarHBondContact O-N 3.25Å; R449-E452 VanDerWaalsContact O-N 3.1Å
453	Y	80.6	Confident	76.9	Confident	6 Å²	6	65.6 Å²	65.6	2%	0.024	35%	0.35	C	S	.	.	H	α-helix	trans	-92.9	-0.6	179.4	-70.1	-66.3	0	0	0	114	P159 Q161 L162 W445 R449 I455	P159-Y453 WeakPolarHBondContact CB-O 3.22Å; P159-Y453 HydrophobicContact CG-CD1 4.3Å; P159-Y453 HydrophobicContact CG-CG 4.41Å; Q161-Y453 HydrophobicContact CB-CD1 4.24Å; Q161-Y453 HydrophobicContact CB-CE1 4.36Å; L162-Y453 HydrophobicContact CD1-CD1 4.46Å; L162-Y453 HydrophobicContact CD1-CE1 4.46Å; L162-Y453 HydrophobicContact CD2-CE1 4.26Å; L162-Y453 HydrophobicContact CG-CD1 4.38Å; L162-Y453 HydrophobicContact CG-CE1 4.22Å; W445-Y453 HydrophobicContact CH2-CD2 4.37Å; W445-Y453 HydrophobicContact CH2-CE2 4.3Å; W445-Y453 HydrophobicContact CZ2-CD2 4.18Å; W445-Y453 AromaticContact CZ2-CE2 3.73Å; W445-Y453 HydrophobicContact CZ2-CE2 3.73Å; R449-Y453 HydrophobicContact CB-CD2 3.77Å; R449-Y453 HydrophobicContact CB-CE2 3.97Å; R449-Y453 PolarHBondContact O-N 3.11Å; R449-Y453 VanDerWaalsContact O-N 3.12Å; Y453-I455 VanDerWaalsContact C-N 3.27Å; Y453-I455 HydrophobicContact CD2-CD1 4.43Å; Y453-I455 HydrophobicContact CG-CD1 4.3Å; Y453-I455 PolarHBondContact O-N 3.38Å
454	S	77.3	Confident	76.1	Confident	64 Å²	64	66.9 Å²	66.9	45%	0.448	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.1	36.4	-173.4	-54.9	0	0	0	0	114.2	C450	C450-S454 CarbonylContact O-C 3.57Å; C450-S454 VanDerWaalsContact O-CA 3.29Å; C450-S454 WeakPolarHBondContact O-CA 3.25Å; C450-S454 PolarHBondContact O-N 3.35Å
455	I	79.6	Confident	75.6	Confident	9 Å²	9	71.1 Å²	71.1	5%	0.046	38%	0.376	C	S	.	.	P	Polyproline II helix	trans	-87.1	147.5	174.1	-56.3	160.6	0	0	0	108.3	F156 P159 I446 C450 Y453 C457	F156-I455 HydrophobicContact CD2-CG2 4.22Å; F156-I455 HydrophobicContact CE2-CD1 3.92Å; F156-I455 HydrophobicContact CE2-CG2 4.5Å; P159-I455 HydrophobicContact CB-CG1 4.31Å; P159-I455 HydrophobicContact CG-CD1 4.27Å; P159-I455 HydrophobicContact CG-CG1 4.18Å; I446-I455 HydrophobicContact CG2-CG2 4.05Å; C450-I455 HydrophobicContact CB-CB 4.43Å; C450-I455 WeakPolarHBondContact CB-O 3.44Å; C450-I455 PolarHBondContact O-N 3.23Å; Y453-I455 VanDerWaalsContact C-N 3.27Å; Y453-I455 HydrophobicContact CD2-CD1 4.43Å; Y453-I455 HydrophobicContact CG-CD1 4.3Å; Y453-I455 PolarHBondContact O-N 3.38Å; I455-C457 PolarHBondContact O-N 2.77Å; I455-C457 VanDerWaalsContact O-N 3.14Å
456	P	72.9	Confident	75.4	Confident	35 Å²	35	77.1 Å²	77.1	23%	0.227	40%	0.399	C	S	.	.	P	Polyproline II helix	trans	-56.6	116.9	172.8	-27	36.2	0	0	0	112.9	L154	L154-P456 HydrophobicContact CB-CB 4.32Å; L154-P456 HydrophobicContact CB-CG 4.19Å
457	C	74	Confident	75.7	Confident	53 Å²	53	76.9 Å²	76.9	36%	0.358	40%	0.398	S	S	.	.	P	Polyproline II helix	trans	-74.3	134.7	175.6	-58.4	0	0	0	0	111.1	C450 I455	C450-C457 HydrophobicContact CB-CB 3.89Å; C450-C457 WeakPolarHBondContact CB-SG 3.28Å; C450-C457 WeakPolarHBondContact SG-CB 3.42Å; C450-C457 CovalentContact SG-SG 2.04Å; C450-C457 PolarHBondContact SG-SG 3.08Å; I455-C457 PolarHBondContact O-N 2.77Å; I455-C457 VanDerWaalsContact O-N 3.14Å
458	S	71.6	Confident	76	Confident	38 Å²	38	79.6 Å²	79.6	27%	0.266	41%	0.413	S	S	.	.	P	Polyproline II helix	trans	-83.8	120.4	173	-160	0	0	0	0	111	N447 K460	N447-S458 WeakPolarHBondContact OD1-CB 3.47Å; N447-S458 PolarHBondContact OD1-N 2.94Å; N447-S458 VanDerWaalsContact OD1-N 3.08Å; S458-K460 PolarHBondContact O-N 3.48Å
459	H	65.3	Low	76.4	Confident	141 Å²	141	77.4 Å²	77.4	65%	0.653	40%	0.401	S	S	*	.			trans	-77.3	1.7	177	-58.3	-87.4	0	0	0	114.2	K151	K151-H459 PolarHBondContact NZ-CD2 2.94Å; K151-H459 VanDerWaalsContact NZ-CD2 3.26Å; K151-H459 PolarHBondContact NZ-NE2 3.45Å
460	K	64.1	Low	76.8	Confident	131 Å²	131	77 Å²	77	57%	0.57	41%	0.41	S	S	*	.	S	Bend	trans	-75.2	129.1	174.1	-68.9	167.2	-178.6	165.4	0	108.2	D153 S458 T462	D153-K460 IonicContact OD2-NZ 2.64Å; D153-K460 PolarHBondContact OD2-NZ 3.5Å; S458-K460 PolarHBondContact O-N 3.48Å; K460-T462 VanDerWaalsContact C-N 3.31Å; K460-T462 PolarHBondContact O-N 2.9Å
461	A	55.1	Low	77.4	Confident	111 Å²	111	78.4 Å²	78.4	92%	0.917	42%	0.416	S	S	*	.			trans	-67.7	89.1	174.2	0	0	0	0	0	110.3
462	T	59.3	Low	78	Confident	57 Å²	57	70.8 Å²	70.8	35%	0.35	38%	0.38	S	S	.	.			trans	-80.9	130.1	172.8	49	0	0	0	0	110.2	N447 K460 L464	N447-T462 PolarHBondContact ND2-OG1 2.03Å; K460-T462 VanDerWaalsContact C-N 3.31Å; K460-T462 PolarHBondContact O-N 2.9Å; T462-L464 PolarHBondContact O-N 3.09Å; T462-L464 VanDerWaalsContact O-N 3.12Å
463	E	61.8	Low	78.6	Confident	161 Å²	161	66.6 Å²	66.6	75%	0.752	36%	0.362	S	S	*	.			trans	-49.6	115.6	162.7	-71.4	-77.7	125.4	0	0	109.6	H465	E463-H465 PolarHBondContact O-N 3.01Å
464	L	68.4	Low	79.4	Confident	102 Å²	102	68.8 Å²	68.8	53%	0.534	38%	0.375	S	S	.	.			trans	-78.5	65.2	-172.3	-69.5	169.7	0	0	0	112	T444 T462 R466	T444-L464 HydrophobicContact CG2-CB 4.5Å; T444-L464 HydrophobicContact CG2-CD2 3.94Å; T462-L464 PolarHBondContact O-N 3.09Å; T462-L464 VanDerWaalsContact O-N 3.12Å; L464-R466 PolarHBondContact O-N 3.04Å
465	H	78.3	Confident	80.3	Confident	90 Å²	90	66.1 Å²	66.1	42%	0.417	36%	0.356	S	S	.	.			trans	-72	122.5	174.5	-101.8	-82.3	0	0	0	111.2	T444 E463	T444-H465 PolarHBondContact OG1-O 2.84Å; E463-H465 PolarHBondContact O-N 3.01Å
466	R	84.7	Confident	81.2	Confident	134 Å²	134	66.1 Å²	66.1	51%	0.506	36%	0.355	S	S	.	.			trans	-115.4	154.2	169.3	-61.8	-168.9	-173.7	110.8	-1.1	109.9	T444 D448 L464	T444-R466 HydrophobicContact CG2-CG 3.85Å; D448-R466 IonicContact OD1-CZ 3.97Å; D448-R466 IonicContact OD1-NH2 3.71Å; D448-R466 PolarHBondContact OD1-NH2 3.46Å; D448-R466 IonicContact OD2-CZ 3.99Å; D448-R466 VanDerWaalsContact OD2-CZ 3.27Å; D448-R466 IonicContact OD2-NE 2.61Å; D448-R466 PolarHBondContact OD2-NE 3.48Å; D448-R466 IonicContact OD2-NH2 2.7Å; D448-R466 PolarHBondContact OD2-NH2 3.17Å; L464-R466 PolarHBondContact O-N 3.04Å
467	P	91.8	Very high	82.3	Confident	14 Å²	14	66.9 Å²	66.9	9%	0.091	36%	0.357	C	S	.	.			trans	-72.3	151.8	176.8	28.4	-33.6	0	0	0	112.5	Y186 F187 W441 F472	Y186-P467 HydrophobicContact CD1-CG 4.17Å; Y186-P467 HydrophobicContact CD2-CG 4.31Å; Y186-P467 HydrophobicContact CG-CG 3.76Å; F187-P467 HydrophobicContact CE1-CB 4.46Å; F187-P467 HydrophobicContact CE1-CG 4.09Å; F187-P467 WeakPolarHBondContact CE1-O 3.36Å; F187-P467 HydrophobicContact CZ-CB 4.08Å; F187-P467 HydrophobicContact CZ-CG 3.83Å; W441-P467 HydrophobicContact CD2-CB 3.93Å; W441-P467 HydrophobicContact CD2-CG 4.11Å; W441-P467 HydrophobicContact CE3-CB 4.1Å; W441-P467 HydrophobicContact CE3-CG 4.3Å; W441-P467 HydrophobicContact CG-CG 4.43Å; W441-P467 HydrophobicContact CH2-CB 3.91Å; W441-P467 HydrophobicContact CZ2-CB 3.71Å; W441-P467 HydrophobicContact CZ3-CB 4.09Å; P467-F472 HydrophobicContact CB-CE2 3.84Å
468	D	91.3	Very high	83.4	Confident	93 Å²	93	66.2 Å²	66.2	50%	0.497	35%	0.349	S	S	.	.			trans	-86.8	128.6	168.6	-172.2	-24.9	0	0	0	110.2	S470 L471	D468-S470 PolarHBondContact O-N 3.15Å; D468-S470 WeakPolarHBondContact OD1-CB 3.26Å; D468-S470 PolarHBondContact OD1-N 2.71Å; D468-S470 PolarHBondContact OD1-OG 3.45Å; D468-L471 PolarHBondContact O-N 3.1Å
469	L	93.9	Very high	84.5	Confident	25 Å²	25	64.7 Å²	64.7	13%	0.131	34%	0.339	C	S	.	.	H	α-helix	trans	-54.6	-35.6	175.6	-175.3	69.9	0	0	0	111.8	F187 D191 F194 A195 L471 F472 L473	F187-L469 HydrophobicContact CD1-CB 4.21Å; F187-L469 HydrophobicContact CD1-CD1 4.03Å; F187-L469 HydrophobicContact CD2-CD1 4.14Å; F187-L469 HydrophobicContact CE1-CB 3.9Å; F187-L469 HydrophobicContact CE1-CD1 4.16Å; F187-L469 HydrophobicContact CE2-CD1 4.26Å; F187-L469 HydrophobicContact CG-CD1 4.03Å; F187-L469 HydrophobicContact CZ-CB 4.44Å; F187-L469 HydrophobicContact CZ-CD1 4.26Å; D191-L469 HydrophobicContact CB-CD1 4.17Å; D191-L469 HydrophobicContact CB-CD2 3.85Å; F194-L469 HydrophobicContact CD1-CD2 4.33Å; A195-L469 HydrophobicContact CB-CD1 4.44Å; L469-L471 PolarHBondContact O-N 3.46Å; L469-F472 WeakPolarHBondContact O-CB 3.25Å; L469-F472 PolarHBondContact O-N 3.29Å; L469-L473 HydrophobicContact CD2-CD1 4.24Å; L469-L473 HydrophobicContact CG-CD1 4.07Å; L469-L473 HydrophobicContact CG-CG 4.21Å; L469-L473 WeakPolarHBondContact O-CG 3.37Å; L469-L473 PolarHBondContact O-N 2.95Å
470	S	94.4	Very high	86	Confident	64 Å²	64	58 Å²	58	45%	0.448	31%	0.308	S	S	.	.	H	α-helix	trans	-55.1	-36.3	-179.4	-49.6	0	0	0	0	112.3	D468 L473 V474	D468-S470 PolarHBondContact O-N 3.15Å; D468-S470 WeakPolarHBondContact OD1-CB 3.26Å; D468-S470 PolarHBondContact OD1-N 2.71Å; D468-S470 PolarHBondContact OD1-OG 3.45Å; S470-L473 PolarHBondContact O-N 3.15Å; S470-V474 WeakPolarHBondContact O-CB 3.41Å; S470-V474 VanDerWaalsContact O-CG2 3.28Å; S470-V474 WeakPolarHBondContact O-CG2 3.27Å; S470-V474 PolarHBondContact O-N 3.04Å
471	L	94.4	Very high	87.4	Confident	35 Å²	35	54.4 Å²	54.4	18%	0.183	30%	0.296	C	S	.	.	H	α-helix	trans	-68.4	-38.6	178.5	-176.5	139.7	0	0	0	112	C430 Y433 E434 D468 L469 V474 K475	C430-L471 HydrophobicContact CB-CD2 4.34Å; Y433-L471 HydrophobicContact CD1-CD1 3.25Å; Y433-L471 HydrophobicContact CD1-CD2 4.38Å; Y433-L471 HydrophobicContact CD1-CG 4.44Å; Y433-L471 HydrophobicContact CE1-CD1 3.68Å; Y433-L471 HydrophobicContact CG-CD1 3.8Å; E434-L471 HydrophobicContact CG-CD2 3.85Å; D468-L471 PolarHBondContact O-N 3.1Å; L469-L471 PolarHBondContact O-N 3.46Å; L471-V474 PolarHBondContact O-N 3.05Å; L471-K475 PolarHBondContact O-N 3.45Å
472	F	95.3	Very high	89.1	Confident	13 Å²	13	49.2 Å²	49.2	6%	0.057	25%	0.253	C	S	.	.	H	α-helix	trans	-68.8	-44	176.1	-72	-106	0	0	0	110.2	F187 I349 E434 W441 P467 L469 V474 K475 Y476	F187-F472 HydrophobicContact CE2-CD1 4.35Å; F187-F472 AromaticContact CE2-CD2 3.96Å; F187-F472 HydrophobicContact CE2-CD2 3.96Å; F187-F472 HydrophobicContact CE2-CE1 4.47Å; F187-F472 HydrophobicContact CE2-CE2 4.13Å; F187-F472 HydrophobicContact CE2-CG 4.1Å; F187-F472 HydrophobicContact CE2-CZ 4.37Å; F187-F472 AromaticContact CZ-CD2 3.68Å; F187-F472 HydrophobicContact CZ-CD2 3.68Å; F187-F472 AromaticContact CZ-CE2 3.85Å; F187-F472 HydrophobicContact CZ-CE2 3.85Å; F187-F472 HydrophobicContact CZ-CG 4.24Å; F187-F472 HydrophobicContact CZ-CZ 4.5Å; I349-F472 HydrophobicContact CD1-CD1 3.61Å; I349-F472 HydrophobicContact CD1-CE1 4.05Å; I349-F472 HydrophobicContact CD1-CG 4.4Å; E434-F472 HydrophobicContact CG-CZ 4.31Å; W441-F472 HydrophobicContact CZ3-CE2 4.48Å; W441-F472 HydrophobicContact CZ3-CZ 4.25Å; P467-F472 HydrophobicContact CB-CE2 3.84Å; L469-F472 WeakPolarHBondContact O-CB 3.25Å; L469-F472 PolarHBondContact O-N 3.29Å; F472-V474 VanDerWaalsContact C-N 3.32Å; F472-V474 PolarHBondContact O-N 2.99Å; F472-K475 WeakPolarHBondContact O-CB 3.31Å; F472-K475 PolarHBondContact O-N 3.25Å; F472-K475 VanDerWaalsContact O-N 3.11Å; F472-Y476 HydrophobicContact CB-CE2 4.35Å; F472-Y476 WeakPolarHBondContact O-CD2 3.4Å; F472-Y476 PolarHBondContact O-N 3.15Å
473	L	96.8	Very high	90.6	Very high	23 Å²	23	46.5 Å²	46.5	12%	0.12	24%	0.236	C	C	.	.	H	α-helix	trans	-58.2	-43.1	173.6	-61.9	173.1	0	0	0	111.6	F194 A195 F198 L469 S470 Y476 L477	F194-L473 HydrophobicContact CD1-CD1 4.32Å; F194-L473 HydrophobicContact CE1-CD1 3.78Å; A195-L473 HydrophobicContact CB-CD2 3.87Å; F198-L473 HydrophobicContact CB-CD2 4.27Å; F198-L473 HydrophobicContact CD1-CB 4.39Å; F198-L473 HydrophobicContact CD1-CD2 3.63Å; F198-L473 HydrophobicContact CE1-CB 4.07Å; F198-L473 HydrophobicContact CE1-CD2 4.19Å; F198-L473 HydrophobicContact CG-CD2 4.07Å; L469-L473 HydrophobicContact CD2-CD1 4.24Å; L469-L473 HydrophobicContact CG-CD1 4.07Å; L469-L473 HydrophobicContact CG-CG 4.21Å; L469-L473 WeakPolarHBondContact O-CG 3.37Å; L469-L473 PolarHBondContact O-N 2.95Å; S470-L473 PolarHBondContact O-N 3.15Å; L473-Y476 PolarHBondContact O-N 2.97Å; L473-L477 WeakPolarHBondContact O-CB 3.37Å; L473-L477 PolarHBondContact O-N 2.98Å
474	V	97.4	Very high	91.9	Very high	52 Å²	52	41 Å²	41	32%	0.315	21%	0.212	S	C	.	.	H	α-helix	trans	-62.8	-40.8	174	168.3	0	0	0	0	111.8	T426 S470 L471 F472 L477 M478	T426-V474 HydrophobicContact CG2-CG1 3.67Å; S470-V474 WeakPolarHBondContact O-CB 3.41Å; S470-V474 VanDerWaalsContact O-CG2 3.28Å; S470-V474 WeakPolarHBondContact O-CG2 3.27Å; S470-V474 PolarHBondContact O-N 3.04Å; L471-V474 PolarHBondContact O-N 3.05Å; F472-V474 VanDerWaalsContact C-N 3.32Å; F472-V474 PolarHBondContact O-N 2.99Å; V474-L477 PolarHBondContact O-N 3.01Å; V474-M478 HydrophobicContact CG1-CG 4.08Å; V474-M478 WeakPolarHBondContact O-CB 3.19Å; V474-M478 VanDerWaalsContact O-CG 3.24Å; V474-M478 WeakPolarHBondContact O-CG 3.4Å; V474-M478 PolarHBondContact O-N 3.39Å
475	K	96.6	Very high	92.9	Very high	8 Å²	8	37.1 Å²	37.1	4%	0.035	19%	0.193	C	C	.	.	H	α-helix	trans	-58.5	-52.2	175.4	177.3	175.2	60.7	-177	0	112	L427 C430 Y431 E434 L471 F472 T479	L427-K475 HydrophobicContact CD2-CG 4.12Å; L427-K475 VanDerWaalsContact CD2-O 3.25Å; L427-K475 WeakPolarHBondContact CD2-O 3.32Å; C430-K475 HydrophobicContact CB-CB 4.22Å; Y431-K475 HydrophobicContact CD1-CD 4.31Å; Y431-K475 HydrophobicContact CE1-CD 3.71Å; E434-K475 VanDerWaalsContact OE1-CD 3.31Å; E434-K475 WeakPolarHBondContact OE1-CD 3.48Å; E434-K475 VanDerWaalsContact OE1-CE 3.24Å; E434-K475 WeakPolarHBondContact OE1-CE 3.27Å; E434-K475 IonicContact OE1-NZ 2.76Å; E434-K475 PolarHBondContact OE1-NZ 3.31Å; E434-K475 IonicContact OE2-NZ 3.76Å; E434-K475 PolarHBondContact OE2-NZ 2.85Å; L471-K475 PolarHBondContact O-N 3.45Å; F472-K475 WeakPolarHBondContact O-CB 3.31Å; F472-K475 PolarHBondContact O-N 3.25Å; F472-K475 VanDerWaalsContact O-N 3.11Å; K475-T479 PolarHBondContact O-N 3.38Å; K475-T479 VanDerWaalsContact O-N 3.1Å; K475-T479 PolarHBondContact O-OG1 2.95Å
476	Y	97.3	Very high	93.2	Very high	8 Å²	8	32.9 Å²	32.9	3%	0.031	17%	0.173	C	C	.	.	H	α-helix	trans	-68.4	-37.6	178.3	-60	-75.4	0	0	0	112	I199 Y245 D347 I349 F472 L473 T479 L480	I199-Y476 HydrophobicContact CD1-CD1 4.05Å; I199-Y476 HydrophobicContact CD1-CD2 3.5Å; I199-Y476 HydrophobicContact CD1-CE1 4.31Å; I199-Y476 HydrophobicContact CD1-CE2 3.84Å; I199-Y476 HydrophobicContact CD1-CG 3.65Å; I199-Y476 HydrophobicContact CG1-CD1 4.47Å; I199-Y476 HydrophobicContact CG1-CD2 4.02Å; I199-Y476 HydrophobicContact CG1-CG 3.86Å; Y245-Y476 AromaticContact CE1-CD1 3.98Å; Y245-Y476 HydrophobicContact CE1-CD1 3.98Å; Y245-Y476 HydrophobicContact CE1-CE1 4.09Å; D347-Y476 PolarHBondContact OD1-OH 3.15Å; D347-Y476 PolarHBondContact OD2-OH 3.39Å; I349-Y476 HydrophobicContact CG2-CE2 4.14Å; F472-Y476 HydrophobicContact CB-CE2 4.35Å; F472-Y476 WeakPolarHBondContact O-CD2 3.4Å; F472-Y476 PolarHBondContact O-N 3.15Å; L473-Y476 PolarHBondContact O-N 2.97Å; Y476-T479 WeakPolarHBondContact O-CB 3.31Å; Y476-T479 PolarHBondContact O-N 3.23Å; Y476-L480 WeakPolarHBondContact O-CG 3.29Å; Y476-L480 PolarHBondContact O-N 3.44Å; Y476-L480 VanDerWaalsContact O-N 3.12Å
477	L	97	Very high	93.2	Very high	51 Å²	51	28.1 Å²	28.1	27%	0.267	16%	0.159	S	C	.	.	H	α-helix	trans	-60.2	-49.1	176	-179.8	66	0	0	0	111.5	F198 L473 V474 T479 L480 V481	F198-L477 HydrophobicContact CE1-CB 4.07Å; F198-L477 HydrophobicContact CZ-CB 4.04Å; F198-L477 HydrophobicContact CZ-CD1 4.01Å; F198-L477 HydrophobicContact CZ-CD2 4.31Å; F198-L477 HydrophobicContact CZ-CG 4.34Å; L473-L477 WeakPolarHBondContact O-CB 3.37Å; L473-L477 PolarHBondContact O-N 2.98Å; V474-L477 PolarHBondContact O-N 3.01Å; L477-T479 VanDerWaalsContact C-N 3.29Å; L477-T479 PolarHBondContact O-N 2.79Å; L477-L480 PolarHBondContact O-N 2.79Å; L477-L480 VanDerWaalsContact O-N 3.08Å; L477-V481 HydrophobicContact CD1-CG2 3.58Å; L477-V481 HydrophobicContact CG-CG2 3.84Å; L477-V481 WeakPolarHBondContact O-CB 3.36Å; L477-V481 VanDerWaalsContact O-CG2 3.29Å; L477-V481 WeakPolarHBondContact O-CG2 2.87Å; L477-V481 PolarHBondContact O-N 2.84Å
478	M	96.3	Very high	92.8	Very high	39 Å²	39	34.6 Å²	34.6	19%	0.192	19%	0.186	C	C	.	.	H	α-helix	trans	-66	-33.3	179.5	-67.8	-63	154	0	0	111.9	P423 T426 L427 V474 L480 V482	P423-M478 HydrophobicContact CB-CB 4.2Å; P423-M478 HydrophobicContact CB-SD 4.05Å; P423-M478 HydrophobicContact CG-SD 4.2Å; T426-M478 HydrophobicContact CG2-CG 3.77Å; T426-M478 HydrophobicContact CG2-SD 4.41Å; L427-M478 HydrophobicContact CD1-CB 4.47Å; L427-M478 HydrophobicContact CD2-CB 3.96Å; L427-M478 HydrophobicContact CG-CB 3.87Å; V474-M478 HydrophobicContact CG1-CG 4.08Å; V474-M478 WeakPolarHBondContact O-CB 3.19Å; V474-M478 VanDerWaalsContact O-CG 3.24Å; V474-M478 WeakPolarHBondContact O-CG 3.4Å; V474-M478 PolarHBondContact O-N 3.39Å; M478-L480 VanDerWaalsContact C-N 3.27Å; M478-L480 PolarHBondContact O-N 2.89Å; M478-V482 WeakPolarHBondContact O-CG2 3.34Å; M478-V482 PolarHBondContact O-N 3.49Å
479	T	95.8	Very high	92.4	Very high	7 Å²	7	30.4 Å²	30.4	4%	0.043	16%	0.164	C	C	.	.	H	α-helix	trans	-61.2	-34.1	171.9	-56	0	0	0	0	112.2	Y238 V241 Y245 L427 K475 Y476 L477	Y238-T479 WeakPolarHBondContact CD1-O 3.14Å; Y238-T479 WeakPolarHBondContact CE1-O 3.41Å; V241-T479 HydrophobicContact CG1-CG2 4.21Å; Y245-T479 HydrophobicContact CE2-CG2 4.11Å; L427-T479 WeakPolarHBondContact CD2-OG1 3.39Å; K475-T479 PolarHBondContact O-N 3.38Å; K475-T479 VanDerWaalsContact O-N 3.1Å; K475-T479 PolarHBondContact O-OG1 2.95Å; Y476-T479 WeakPolarHBondContact O-CB 3.31Å; Y476-T479 PolarHBondContact O-N 3.23Å; L477-T479 VanDerWaalsContact C-N 3.29Å; L477-T479 PolarHBondContact O-N 2.79Å
480	L	95.8	Very high	91.9	Very high	1 Å²	1	29.4 Å²	29.4	1%	0.005	16%	0.158	C	C	.	.	H	α-helix	trans	-96.2	-36.9	-176.1	-67.8	168	0	0	0	113.9	C202 C206 Y245 Y476 L477 M478 V482 G483	C202-L480 HydrophobicContact CB-CB 4.42Å; C202-L480 HydrophobicContact CB-CD1 3.61Å; C206-L480 HydrophobicContact CB-CB 4.23Å; C206-L480 HydrophobicContact CB-CD2 4.09Å; C206-L480 PolarHBondContact SG-O 2.04Å; C206-L480 VanDerWaalsContact SG-O 3.34Å; Y245-L480 HydrophobicContact CD2-CD2 4.05Å; Y476-L480 WeakPolarHBondContact O-CG 3.29Å; Y476-L480 PolarHBondContact O-N 3.44Å; Y476-L480 VanDerWaalsContact O-N 3.12Å; L477-L480 PolarHBondContact O-N 2.79Å; L477-L480 VanDerWaalsContact O-N 3.08Å; M478-L480 VanDerWaalsContact C-N 3.27Å; M478-L480 PolarHBondContact O-N 2.89Å; L480-V482 PolarHBondContact O-N 3.34Å; L480-G483 PolarHBondContact O-N 2.94Å
481	V	94.1	Very high	91.4	Very high	54 Å²	54	29.3 Å²	29.3	33%	0.327	16%	0.158	S	C	.	.	H	α-helix	trans	-58.7	-33.3	175.8	163.8	0	0	0	0	111.7	L477 G483 I484 S485	L477-V481 HydrophobicContact CD1-CG2 3.58Å; L477-V481 HydrophobicContact CG-CG2 3.84Å; L477-V481 WeakPolarHBondContact O-CB 3.36Å; L477-V481 VanDerWaalsContact O-CG2 3.29Å; L477-V481 WeakPolarHBondContact O-CG2 2.87Å; L477-V481 PolarHBondContact O-N 2.84Å; V481-G483 VanDerWaalsContact C-N 3.3Å; V481-G483 PolarHBondContact O-N 2.85Å; V481-I484 WeakPolarHBondContact O-CB 3.37Å; V481-I484 PolarHBondContact O-N 2.91Å; V481-I484 VanDerWaalsContact O-N 3.08Å; V481-S485 PolarHBondContact O-N 3.06Å
482	V	90.8	Very high	90.9	Very high	2 Å²	2	29.4 Å²	29.4	1%	0.012	16%	0.161	C	C	.	.	H	α-helix	trans	-45.9	-54	168.2	157.1	0	0	0	0	110.8	Y234 Y238 Y420 P423 M478 L480 I484 S485	Y234-V482 HydrophobicContact CE2-CG1 3.95Å; Y234-V482 WeakPolarHBondContact OH-CG1 3.45Å; Y234-V482 PolarHBondContact OH-O 3.23Å; Y238-V482 HydrophobicContact CD1-CB 4.46Å; Y238-V482 HydrophobicContact CD1-CG1 3.82Å; Y238-V482 HydrophobicContact CD2-CG1 4.18Å; Y238-V482 HydrophobicContact CE1-CB 4.1Å; Y238-V482 HydrophobicContact CE1-CG1 3.42Å; Y238-V482 VanDerWaalsContact CE1-CG1 3.42Å; Y238-V482 HydrophobicContact CE2-CG1 3.8Å; Y238-V482 HydrophobicContact CG-CG1 4.18Å; Y238-V482 VanDerWaalsContact CZ-CG1 3.4Å; Y420-V482 HydrophobicContact CE2-CG1 3.56Å; Y420-V482 WeakPolarHBondContact OH-CG1 3.36Å; P423-V482 HydrophobicContact CB-CG2 3.39Å; P423-V482 HydrophobicContact CG-CG2 3.91Å; M478-V482 WeakPolarHBondContact O-CG2 3.34Å; M478-V482 PolarHBondContact O-N 3.49Å; L480-V482 PolarHBondContact O-N 3.34Å; V482-I484 VanDerWaalsContact C-N 3.28Å; V482-I484 PolarHBondContact O-N 3.09Å; V482-S485 WeakPolarHBondContact O-CB 3.44Å; V482-S485 PolarHBondContact O-N 3.28Å; V482-S485 PolarHBondContact O-OG 3.2Å
483	G	89.8	Confident	90.3	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-58.5	-35.1	179.5	0	0	0	0	0	114.5	T210 Y234 L480 V481 S485 A486	T210-G483 WeakPolarHBondContact CG2-O 3.31Å; Y234-G483 WeakPolarHBondContact OH-CA 3.25Å; Y234-G483 PolarHBondContact OH-N 2.89Å; L480-G483 PolarHBondContact O-N 2.94Å; V481-G483 VanDerWaalsContact C-N 3.3Å; V481-G483 PolarHBondContact O-N 2.85Å; G483-S485 VanDerWaalsContact C-N 3.26Å; G483-S485 PolarHBondContact O-N 3.03Å; G483-A486 PolarHBondContact O-N 3.24Å
484	I	90.3	Very high	89.6	Confident	47 Å²	47	41.5 Å²	41.5	24%	0.241	21%	0.213	C	C	.	.	H	α-helix	trans	-67.2	-28.2	179.5	-54.1	175.1	0	0	0	111.2	I205 C206 A209 V481 V482 A486 V487 F488	I205-I484 HydrophobicContact CG2-CD1 3.77Å; I205-I484 HydrophobicContact CG2-CG1 4.46Å; C206-I484 HydrophobicContact CB-CG1 4.39Å; A209-I484 HydrophobicContact CB-CB 4.46Å; A209-I484 HydrophobicContact CB-CG1 4.28Å; A209-I484 HydrophobicContact CB-CG2 4.41Å; V481-I484 WeakPolarHBondContact O-CB 3.37Å; V481-I484 PolarHBondContact O-N 2.91Å; V481-I484 VanDerWaalsContact O-N 3.08Å; V482-I484 VanDerWaalsContact C-N 3.28Å; V482-I484 PolarHBondContact O-N 3.09Å; I484-A486 PolarHBondContact O-N 3.27Å; I484-A486 VanDerWaalsContact O-N 3.11Å; I484-V487 PolarHBondContact O-N 3.06Å; I484-V487 VanDerWaalsContact O-N 3.12Å; I484-F488 HydrophobicContact CG2-CE2 4.48Å
485	S	88.2	Confident	88.9	Confident	20 Å²	20	39.2 Å²	39.2	14%	0.14	20%	0.199	C	C	.	.	H	α-helix	trans	-54.1	-34.8	179.7	72.4	0	0	0	0	113.3	F416 V481 V482 G483 V487 F488	F416-S485 WeakPolarHBondContact CE2-O 3.29Å; V481-S485 PolarHBondContact O-N 3.06Å; V482-S485 WeakPolarHBondContact O-CB 3.44Å; V482-S485 PolarHBondContact O-N 3.28Å; V482-S485 PolarHBondContact O-OG 3.2Å; G483-S485 VanDerWaalsContact C-N 3.26Å; G483-S485 PolarHBondContact O-N 3.03Å; S485-V487 PolarHBondContact O-N 3.42Å; S485-F488 WeakPolarHBondContact O-CB 3.49Å; S485-F488 PolarHBondContact O-N 3.33Å
486	A	85.2	Confident	88.3	Confident	0 Å²	0	43 Å²	43	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-58.8	-30.7	-178.6	0	0	0	0	0	113.6	T213 Y234 A235 G483 I484 F488 W489 V490	T213-A486 HydrophobicContact CG2-CB 3.7Å; Y234-A486 HydrophobicContact CE1-CB 4.16Å; A235-A486 HydrophobicContact CB-CB 4.11Å; G483-A486 PolarHBondContact O-N 3.24Å; I484-A486 PolarHBondContact O-N 3.27Å; I484-A486 VanDerWaalsContact O-N 3.11Å; A486-F488 VanDerWaalsContact C-N 3.27Å; A486-F488 PolarHBondContact O-N 2.87Å; A486-W489 WeakPolarHBondContact O-CB 3.38Å; A486-W489 PolarHBondContact O-N 2.97Å; A486-V490 PolarHBondContact O-N 3.34Å
487	V	85.6	Confident	87.7	Confident	34 Å²	34	45.5 Å²	45.5	21%	0.206	24%	0.244	C	C	.	.	H	α-helix	trans	-64.1	-34.3	178.4	176.9	0	0	0	0	111.1	A209 F212 I484 S485 W489 V490 S491	A209-V487 HydrophobicContact CB-CG2 3.53Å; A209-V487 VanDerWaalsContact O-CG2 3.23Å; A209-V487 WeakPolarHBondContact O-CG2 3.44Å; F212-V487 HydrophobicContact CD1-CG1 4.5Å; I484-V487 PolarHBondContact O-N 3.06Å; I484-V487 VanDerWaalsContact O-N 3.12Å; S485-V487 PolarHBondContact O-N 3.42Å; V487-W489 VanDerWaalsContact C-N 3.27Å; V487-W489 PolarHBondContact O-N 2.9Å; V487-V490 PolarHBondContact O-N 3.11Å; V487-S491 WeakPolarHBondContact O-CB 3.19Å; V487-S491 PolarHBondContact O-N 3.37Å; V487-S491 PolarHBondContact O-OG 3.15Å
488	F	82.8	Confident	87.1	Confident	151 Å²	151	45.7 Å²	45.7	66%	0.662	24%	0.244	S	C	*	.	H	α-helix	trans	-68.5	-26.5	175.7	-61.5	-92.6	0	0	0	112.3	R412 I484 S485 A486	R412-F488 PolarHBondContact NH2-O 3.49Å; I484-F488 HydrophobicContact CG2-CE2 4.48Å; S485-F488 WeakPolarHBondContact O-CB 3.49Å; S485-F488 PolarHBondContact O-N 3.33Å; A486-F488 VanDerWaalsContact C-N 3.27Å; A486-F488 PolarHBondContact O-N 2.87Å
489	W	82.6	Confident	86.7	Confident	5 Å²	5	45.5 Å²	45.5	2%	0.019	24%	0.241	C	C	.	.	H	α-helix	trans	-70.5	-47.5	171.8	-172	-100.5	0	0	0	111.9	E228 I231 F409 R412 I413 F416 A486 V487	E228-W489 HydrophobicContact CG-CZ2 3.83Å; E228-W489 WeakPolarHBondContact OE2-CZ2 3.44Å; E228-W489 PolarHBondContact OE2-NE1 3.02Å; I231-W489 HydrophobicContact CD1-CD2 3.58Å; I231-W489 HydrophobicContact CD1-CE3 4.01Å; I231-W489 HydrophobicContact CD1-CG 3.77Å; I231-W489 HydrophobicContact CD1-CZ2 4.45Å; I231-W489 HydrophobicContact CG2-CB 4.26Å; I231-W489 HydrophobicContact CG2-CG 4.21Å; F409-W489 HydrophobicContact CE2-CH2 4.38Å; F409-W489 HydrophobicContact CE2-CZ2 4.19Å; R412-W489 HydrophobicContact CB-CH2 4.14Å; R412-W489 HydrophobicContact CB-CZ3 3.98Å; R412-W489 HydrophobicContact CG-CE3 4.39Å; R412-W489 HydrophobicContact CG-CH2 4.03Å; R412-W489 HydrophobicContact CG-CZ3 3.58Å; R412-W489 VanDerWaalsContact CZ-O 3.28Å; R412-W489 PolarHBondContact NH1-O 2.84Å; R412-W489 PolarHBondContact NH2-O 2.98Å; I413-W489 HydrophobicContact CB-CH2 4.48Å; I413-W489 HydrophobicContact CD1-CH2 4.37Å; I413-W489 HydrophobicContact CG1-CH2 3.41Å; I413-W489 VanDerWaalsContact CG1-CH2 3.41Å; I413-W489 HydrophobicContact CG1-CZ2 4.21Å; I413-W489 HydrophobicContact CG1-CZ3 3.9Å; F416-W489 HydrophobicContact CB-CE3 4.16Å; F416-W489 HydrophobicContact CB-CZ3 4.37Å; F416-W489 HydrophobicContact CD2-CB 4.21Å; F416-W489 HydrophobicContact CD2-CE3 4.15Å; F416-W489 HydrophobicContact CE2-CB 3.95Å; F416-W489 HydrophobicContact CG-CE3 4.14Å; A486-W489 WeakPolarHBondContact O-CB 3.38Å; A486-W489 PolarHBondContact O-N 2.97Å; V487-W489 VanDerWaalsContact C-N 3.27Å; V487-W489 PolarHBondContact O-N 2.9Å
490	V	84.4	Confident	86.1	Confident	3 Å²	3	47.3 Å²	47.3	2%	0.018	26%	0.256	C	S	.	.	H	α-helix	trans	-82	-27.4	-172.1	173.2	0	0	0	0	112.8	F212 T213 T216 F224 A486 V487 S492 T495	F212-V490 HydrophobicContact CE1-CG1 4.43Å; T213-V490 HydrophobicContact CG2-CB 4.47Å; T213-V490 HydrophobicContact CG2-CG2 3.57Å; T216-V490 HydrophobicContact CG2-CG1 3.44Å; T216-V490 VanDerWaalsContact CG2-CG1 3.44Å; F224-V490 HydrophobicContact CE1-CG2 4.36Å; F224-V490 HydrophobicContact CZ-CG2 4.29Å; A486-V490 PolarHBondContact O-N 3.34Å; V487-V490 PolarHBondContact O-N 3.11Å; V490-S492 PolarHBondContact O-N 2.9Å; V490-S492 VanDerWaalsContact O-N 3.17Å; V490-S492 PolarHBondContact O-OG 2.95Å; V490-T495 HydrophobicContact CG1-CG2 4.12Å; V490-T495 WeakPolarHBondContact O-CB 3.4Å; V490-T495 PolarHBondContact O-OG1 3.02Å
491	S	82.7	Confident	85.5	Confident	62 Å²	62	53.6 Å²	53.6	43%	0.434	28%	0.281	S	S	.	.			trans	-57.9	115.9	175.7	-69.6	0	0	0	0	111.9	V487	V487-S491 WeakPolarHBondContact O-CB 3.19Å; V487-S491 PolarHBondContact O-N 3.37Å; V487-S491 PolarHBondContact O-OG 3.15Å
492	S	83.6	Confident	85.1	Confident	38 Å²	38	54.7 Å²	54.7	27%	0.266	28%	0.281	S	S	.	.	S	Bend	trans	-168.3	157.2	-177.9	58.2	0	0	0	0	111.2	R223 V490 K494 T495 C496	R223-S492 PolarHBondContact NH2-OG 3.01Å; V490-S492 PolarHBondContact O-N 2.9Å; V490-S492 VanDerWaalsContact O-N 3.17Å; V490-S492 PolarHBondContact O-OG 2.95Å; S492-K494 PolarHBondContact O-N 3.31Å; S492-T495 WeakPolarHBondContact O-CB 3.03Å; S492-T495 PolarHBondContact O-N 3.23Å; S492-T495 WeakPolarHBondContact OG-CB 3.44Å; S492-T495 PolarHBondContact OG-N 3.22Å; S492-T495 PolarHBondContact OG-OG1 2.86Å; S492-C496 PolarHBondContact O-N 2.99Å; S492-C496 VanDerWaalsContact O-N 3.12Å; S492-C496 PolarHBondContact O-SG 3.47Å
493	K	82.9	Confident	84.7	Confident	197 Å²	197	60.5 Å²	60.5	86%	0.857	31%	0.307	S	S	*	.	H	α-helix	trans	-55.6	-36.1	175.6	-64.8	-173.6	179.5	-176.7	0	112.6	C496 S497	K493-C496 PolarHBondContact O-N 3.03Å; K493-S497 PolarHBondContact O-N 2.68Å; K493-S497 VanDerWaalsContact O-N 3.09Å; K493-S497 PolarHBondContact O-OG 2.71Å
494	K	82.2	Confident	84.3	Confident	93 Å²	93	67.6 Å²	67.6	40%	0.404	34%	0.338	S	S	.	.	H	α-helix	trans	-63	-46	174.1	-169	-174.6	-179.5	-165.1	0	111.5	D220 S492 C496 S497 E498	D220-K494 WeakPolarHBondContact OD2-CE 3.49Å; D220-K494 IonicContact OD2-NZ 2.85Å; D220-K494 PolarHBondContact OD2-NZ 2.88Å; S492-K494 PolarHBondContact O-N 3.31Å; K494-C496 VanDerWaalsContact C-N 3.3Å; K494-C496 PolarHBondContact O-N 3.48Å; K494-S497 WeakPolarHBondContact CA-OG 3.15Å; K494-S497 PolarHBondContact O-N 3.13Å; K494-S497 VanDerWaalsContact O-N 3.07Å; K494-S497 PolarHBondContact O-OG 2.88Å; K494-E498 WeakPolarHBondContact CE-OE1 3.27Å; K494-E498 HydrophobicContact CG-CG 4.15Å; K494-E498 IonicContact NZ-OE1 2.71Å; K494-E498 WeakPolarHBondContact O-CG 3.35Å; K494-E498 PolarHBondContact O-N 2.93Å
495	T	83.6	Confident	83.7	Confident	3 Å²	3	72.2 Å²	72.2	2%	0.018	35%	0.352	C	S	.	.	H	α-helix	trans	-56.8	-45.6	176.9	-63.1	0	0	0	0	111.2	F212 T216 R223 V490 S492 S497 E498 W499	F212-T495 HydrophobicContact CZ-CG2 3.93Å; T216-T495 HydrophobicContact CG2-CG2 3.74Å; R223-T495 PolarHBondContact NH1-OG1 3.4Å; R223-T495 PolarHBondContact NH2-OG1 3.38Å; V490-T495 HydrophobicContact CG1-CG2 4.12Å; V490-T495 WeakPolarHBondContact O-CB 3.4Å; V490-T495 PolarHBondContact O-OG1 3.02Å; S492-T495 WeakPolarHBondContact O-CB 3.03Å; S492-T495 PolarHBondContact O-N 3.23Å; S492-T495 WeakPolarHBondContact OG-CB 3.44Å; S492-T495 PolarHBondContact OG-N 3.22Å; S492-T495 PolarHBondContact OG-OG1 2.86Å; T495-S497 VanDerWaalsContact C-N 3.32Å; T495-S497 PolarHBondContact O-N 2.89Å; T495-E498 PolarHBondContact O-N 3.07Å; T495-W499 VanDerWaalsContact O-CD1 3.29Å; T495-W499 PolarHBondContact O-N 3.23Å
496	C	84.5	Confident	82.8	Confident	87 Å²	87	74.8 Å²	74.8	59%	0.588	36%	0.364	S	S	*	.	H	α-helix	trans	-60	-39.4	175.3	-55.9	0	0	0	0	112.7	S492 K493 K494 A500	S492-C496 PolarHBondContact O-N 2.99Å; S492-C496 VanDerWaalsContact O-N 3.12Å; S492-C496 PolarHBondContact O-SG 3.47Å; K493-C496 PolarHBondContact O-N 3.03Å; K494-C496 VanDerWaalsContact C-N 3.3Å; K494-C496 PolarHBondContact O-N 3.48Å; C496-A500 WeakPolarHBondContact O-CB 3.13Å; C496-A500 PolarHBondContact O-N 3.09Å
497	S	83.4	Confident	81.9	Confident	62 Å²	62	85.3 Å²	85.3	43%	0.434	40%	0.404	S	S	.	.	H	α-helix	trans	-72.4	-38.3	177.4	58.3	0	0	0	0	113.7	K493 K494 T495 A500 Y501	K493-S497 PolarHBondContact O-N 2.68Å; K493-S497 VanDerWaalsContact O-N 3.09Å; K493-S497 PolarHBondContact O-OG 2.71Å; K494-S497 WeakPolarHBondContact CA-OG 3.15Å; K494-S497 PolarHBondContact O-N 3.13Å; K494-S497 VanDerWaalsContact O-N 3.07Å; K494-S497 PolarHBondContact O-OG 2.88Å; T495-S497 VanDerWaalsContact C-N 3.32Å; T495-S497 PolarHBondContact O-N 2.89Å; S497-A500 PolarHBondContact O-N 3.3Å; S497-Y501 VanDerWaalsContact O-CB 3.31Å; S497-Y501 WeakPolarHBondContact O-CB 3.37Å; S497-Y501 PolarHBondContact O-N 3.34Å
498	E	84.9	Confident	80.4	Confident	54 Å²	54	91.6 Å²	91.6	25%	0.252	43%	0.429	S	S	.	.	H	α-helix	trans	-67	-44.8	176.4	-61.1	-49.6	151.5	0	0	111.4	I219 K494 T495 Y501 F502	I219-E498 HydrophobicContact CG2-CB 4.17Å; K494-E498 WeakPolarHBondContact CE-OE1 3.27Å; K494-E498 HydrophobicContact CG-CG 4.15Å; K494-E498 IonicContact NZ-OE1 2.71Å; K494-E498 WeakPolarHBondContact O-CG 3.35Å; K494-E498 PolarHBondContact O-N 2.93Å; T495-E498 PolarHBondContact O-N 3.07Å; E498-Y501 PolarHBondContact O-N 2.64Å; E498-F502 WeakPolarHBondContact O-CB 3.3Å; E498-F502 PolarHBondContact O-N 3.08Å
499	W	86.8	Confident	79	Confident	36 Å²	36	91.3 Å²	91.3	14%	0.136	42%	0.423	C	S	.	.	H	α-helix	trans	-63.8	-42.4	174.3	-82.2	99	0	0	0	111.8	F212 L215 T216 I219 T495 Y501 F502 F503	F212-W499 AromaticContact CD2-CZ2 3.81Å; F212-W499 HydrophobicContact CD2-CZ2 3.81Å; F212-W499 HydrophobicContact CE2-CD2 4.37Å; F212-W499 AromaticContact CE2-CE2 3.62Å; F212-W499 AromaticContact CE2-CZ2 3.86Å; F212-W499 HydrophobicContact CE2-CZ2 3.86Å; F212-W499 AromaticContact CE2-NE1 3.42Å; F212-W499 AromaticContact CZ-NE1 3.87Å; L215-W499 HydrophobicContact CB-CH2 3.79Å; L215-W499 HydrophobicContact CB-CZ2 3.82Å; L215-W499 HydrophobicContact CD1-CH2 4.19Å; T216-W499 PolarHBondContact OG1-NE1 3.5Å; I219-W499 HydrophobicContact CD1-CD2 3.68Å; I219-W499 HydrophobicContact CD1-CE3 3.79Å; I219-W499 HydrophobicContact CD1-CG 4.37Å; I219-W499 HydrophobicContact CD1-CH2 3.93Å; I219-W499 HydrophobicContact CD1-CZ2 3.78Å; I219-W499 HydrophobicContact CD1-CZ3 3.92Å; T495-W499 VanDerWaalsContact O-CD1 3.29Å; T495-W499 PolarHBondContact O-N 3.23Å; W499-Y501 VanDerWaalsContact C-N 3.3Å; W499-Y501 PolarHBondContact O-N 2.67Å; W499-F502 HydrophobicContact CE3-CD1 4.42Å; W499-F502 PolarHBondContact O-N 3.24Å; W499-F503 HydrophobicContact CB-CE2 4.48Å; W499-F503 HydrophobicContact CD2-CE2 4.44Å; W499-F503 HydrophobicContact CE3-CD2 4.3Å; W499-F503 AromaticContact CE3-CE2 3.51Å; W499-F503 HydrophobicContact CE3-CE2 3.51Å; W499-F503 AromaticContact CE3-CZ 3.75Å; W499-F503 HydrophobicContact CE3-CZ 3.75Å; W499-F503 HydrophobicContact CZ3-CE2 4.14Å; W499-F503 AromaticContact CZ3-CZ 3.88Å; W499-F503 HydrophobicContact CZ3-CZ 3.88Å; W499-F503 WeakPolarHBondContact O-CD2 3.45Å; W499-F503 PolarHBondContact O-N 3.27Å
500	A	84.6	Confident	77.6	Confident	44 Å²	44	95.5 Å²	95.5	36%	0.364	45%	0.446	S	S	.	.	H	α-helix	trans	-64.1	-34.2	175	0	0	0	0	0	112.5	C496 S497 K504	C496-A500 WeakPolarHBondContact O-CB 3.13Å; C496-A500 PolarHBondContact O-N 3.09Å; S497-A500 PolarHBondContact O-N 3.3Å; A500-K504 WeakPolarHBondContact O-CB 3.17Å; A500-K504 WeakPolarHBondContact O-CD 3.44Å; A500-K504 WeakPolarHBondContact O-CG 3.28Å; A500-K504 PolarHBondContact O-N 2.84Å
501	Y	83.3	Confident	76.3	Confident	134 Å²	134	100.1 Å²	100.1	53%	0.525	48%	0.476	S	S	.	.	H	α-helix	trans	-69.4	-44.6	172.1	174.6	-96.1	0	0	0	111.5	S497 E498 W499 K504 R505	S497-Y501 VanDerWaalsContact O-CB 3.31Å; S497-Y501 WeakPolarHBondContact O-CB 3.37Å; S497-Y501 PolarHBondContact O-N 3.34Å; E498-Y501 PolarHBondContact O-N 2.64Å; W499-Y501 VanDerWaalsContact C-N 3.3Å; W499-Y501 PolarHBondContact O-N 2.67Å; Y501-K504 CarbonylContact O-C 3.21Å; Y501-K504 PolarHBondContact O-N 3.16Å; Y501-R505 HydrophobicContact CE1-CB 4.49Å; Y501-R505 WeakPolarHBondContact O-CB 3.27Å; Y501-R505 PolarHBondContact O-N 3.46Å; Y501-R505 PolarHBondContact OH-NH1 2.95Å
502	F	84.1	Confident	75.1	Confident	76 Å²	76	102.9 Å²	102.9	33%	0.333	49%	0.485	S	S	.	.	H	α-helix	trans	-59	-50.9	177	-179.6	-101.3	0	0	0	111.7	I219 E498 W499 R505 N506	I219-F502 HydrophobicContact CD1-CD1 4.35Å; I219-F502 HydrophobicContact CD1-CG 4.25Å; I219-F502 HydrophobicContact CG1-CD2 4.38Å; E498-F502 WeakPolarHBondContact O-CB 3.3Å; E498-F502 PolarHBondContact O-N 3.08Å; W499-F502 HydrophobicContact CE3-CD1 4.42Å; W499-F502 PolarHBondContact O-N 3.24Å; F502-R505 PolarHBondContact O-N 3.08Å; F502-N506 WeakPolarHBondContact CE1-ND2 3.44Å; F502-N506 VanDerWaalsContact CZ-ND2 3.33Å; F502-N506 WeakPolarHBondContact CZ-ND2 3.41Å; F502-N506 PolarHBondContact O-N 3.5Å
503	F	83.9	Confident	74	Confident	124 Å²	124	103.6 Å²	103.6	54%	0.544	49%	0.489	S	S	.	.	H	α-helix	trans	-63.3	-42.3	175.3	-71.8	-58	0	0	0	112.3	W499 R505 N506 R507	W499-F503 HydrophobicContact CB-CE2 4.48Å; W499-F503 HydrophobicContact CD2-CE2 4.44Å; W499-F503 HydrophobicContact CE3-CD2 4.3Å; W499-F503 AromaticContact CE3-CE2 3.51Å; W499-F503 HydrophobicContact CE3-CE2 3.51Å; W499-F503 AromaticContact CE3-CZ 3.75Å; W499-F503 HydrophobicContact CE3-CZ 3.75Å; W499-F503 HydrophobicContact CZ3-CE2 4.14Å; W499-F503 AromaticContact CZ3-CZ 3.88Å; W499-F503 HydrophobicContact CZ3-CZ 3.88Å; W499-F503 WeakPolarHBondContact O-CD2 3.45Å; W499-F503 PolarHBondContact O-N 3.27Å; F503-R505 VanDerWaalsContact C-N 3.31Å; F503-R505 PolarHBondContact O-N 3.1Å; F503-N506 PolarHBondContact O-N 3.31Å; F503-R507 VanDerWaalsContact O-CB 3.28Å; F503-R507 WeakPolarHBondContact O-CB 3.4Å; F503-R507 PolarHBondContact O-N 3.34Å
504	K	81.6	Confident	73	Confident	150 Å²	150	98 Å²	98	65%	0.652	47%	0.466	S	S	*	.	H	α-helix	trans	-67.1	-28.7	175.3	-76	174.3	-179.2	179.6	0	113.3	A500 Y501 K508	A500-K504 WeakPolarHBondContact O-CB 3.17Å; A500-K504 WeakPolarHBondContact O-CD 3.44Å; A500-K504 WeakPolarHBondContact O-CG 3.28Å; A500-K504 PolarHBondContact O-N 2.84Å; Y501-K504 CarbonylContact O-C 3.21Å; Y501-K504 PolarHBondContact O-N 3.16Å; K504-K508 VanDerWaalsContact O-CB 3.32Å; K504-K508 WeakPolarHBondContact O-CB 3.07Å; K504-K508 VanDerWaalsContact O-CG 3.31Å; K504-K508 WeakPolarHBondContact O-CG 3.45Å; K504-K508 PolarHBondContact O-N 3.48Å; K504-K508 VanDerWaalsContact O-N 3.11Å
505	R	76.8	Confident	71.8	Confident	143 Å²	143	96.7 Å²	96.7	54%	0.54	47%	0.469	S	S	.	.	H	α-helix	trans	-72.8	-47.5	175.7	178.2	172.1	174.8	149.4	-6.3	110.3	Y501 F502 F503 K508 R509	Y501-R505 HydrophobicContact CE1-CB 4.49Å; Y501-R505 WeakPolarHBondContact O-CB 3.27Å; Y501-R505 PolarHBondContact O-N 3.46Å; Y501-R505 PolarHBondContact OH-NH1 2.95Å; F502-R505 PolarHBondContact O-N 3.08Å; F503-R505 VanDerWaalsContact C-N 3.31Å; F503-R505 PolarHBondContact O-N 3.1Å; R505-K508 CarbonylContact O-C 3.59Å; R505-K508 PolarHBondContact O-N 2.73Å; R505-K508 VanDerWaalsContact O-N 3.14Å; R505-R509 PolarHBondContact O-N 3.38Å; R505-R509 VanDerWaalsContact O-N 3.11Å
506	N	69.4	Low	70.9	Confident	75 Å²	75	104.8 Å²	104.8	40%	0.401	50%	0.499	S	S	.	.	H	α-helix	trans	-65.6	-39.4	176.2	-65.7	-7.3	0	0	0	111.2	F502 F503 K508 R509	F502-N506 WeakPolarHBondContact CE1-ND2 3.44Å; F502-N506 VanDerWaalsContact CZ-ND2 3.33Å; F502-N506 WeakPolarHBondContact CZ-ND2 3.41Å; F502-N506 PolarHBondContact O-N 3.5Å; F503-N506 PolarHBondContact O-N 3.31Å; N506-K508 PolarHBondContact O-N 3.32Å; N506-R509 VanDerWaalsContact O-CB 3.31Å; N506-R509 WeakPolarHBondContact O-CB 3.05Å; N506-R509 PolarHBondContact O-N 3.13Å
507	R	65.4	Low	69.9	Low	220 Å²	220	108.3 Å²	108.3	83%	0.83	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.8	4.7	173.6	-143.2	-169.8	90.9	170.5	10.6	115	F503	F503-R507 VanDerWaalsContact O-CB 3.28Å; F503-R507 WeakPolarHBondContact O-CB 3.4Å; F503-R507 PolarHBondContact O-N 3.34Å
508	K	55.2	Low	68.9	Low	166 Å²	166	109.8 Å²	109.8	72%	0.722	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.2	-2.3	162.3	-82.9	-172.1	172.5	-164.4	0	111.9	K504 R505 N506 D510	K504-K508 VanDerWaalsContact O-CB 3.32Å; K504-K508 WeakPolarHBondContact O-CB 3.07Å; K504-K508 VanDerWaalsContact O-CG 3.31Å; K504-K508 WeakPolarHBondContact O-CG 3.45Å; K504-K508 PolarHBondContact O-N 3.48Å; K504-K508 VanDerWaalsContact O-N 3.11Å; R505-K508 CarbonylContact O-C 3.59Å; R505-K508 PolarHBondContact O-N 2.73Å; R505-K508 VanDerWaalsContact O-N 3.14Å; N506-K508 PolarHBondContact O-N 3.32Å; K508-D510 PolarHBondContact O-N 3.37Å
509	R	52.6	Low	67.9	Low	146 Å²	146	112.5 Å²	112.5	55%	0.551	52%	0.522	S	S	*	.			trans	-91.1	48.3	179.6	-151.6	175.2	-165.5	-176	0.3	110.4	R505 N506 E514	R505-R509 PolarHBondContact O-N 3.38Å; R505-R509 VanDerWaalsContact O-N 3.11Å; N506-R509 VanDerWaalsContact O-CB 3.31Å; N506-R509 WeakPolarHBondContact O-CB 3.05Å; N506-R509 PolarHBondContact O-N 3.13Å; R509-E514 WeakPolarHBondContact CG-OE2 3.19Å; R509-E514 IonicContact CZ-OE1 3.65Å; R509-E514 IonicContact CZ-OE2 2.7Å; R509-E514 IonicContact NE-OE1 2.75Å; R509-E514 PolarHBondContact NE-OE1 3.38Å; R509-E514 IonicContact NE-OE2 2.82Å; R509-E514 PolarHBondContact NE-OE2 3.26Å; R509-E514 IonicContact NH2-OE1 3.27Å; R509-E514 PolarHBondContact NH2-OE1 2.97Å; R509-E514 IonicContact NH2-OE2 2.68Å
510	D	54	Low	67.1	Low	93 Å²	93	117 Å²	117	50%	0.497	54%	0.544	S	S	.	.			trans	-58.5	126.2	170.5	-66.2	-55.5	0	0	0	107.7	K508 I512 S513 E514	K508-D510 PolarHBondContact O-N 3.37Å; D510-I512 PolarHBondContact O-N 3.35Å; D510-I512 VanDerWaalsContact O-N 3.1Å; D510-S513 WeakPolarHBondContact O-CA 3.38Å; D510-S513 WeakPolarHBondContact O-CB 3.1Å; D510-S513 PolarHBondContact O-N 2.68Å; D510-S513 PolarHBondContact O-OG 3.4Å; D510-E514 PolarHBondContact O-N 3.11Å
511	P	56.7	Low	66.1	Low	100 Å²	100	119.2 Å²	119.2	65%	0.649	55%	0.547	S	S	*	.	H	α-helix	trans	-59.8	-27.5	-178.8	22.6	-32.6	0	0	0	111.5	S513 S515	P511-S513 VanDerWaalsContact C-N 3.32Å; P511-S513 PolarHBondContact O-N 2.04Å; P511-S515 WeakPolarHBondContact O-CB 3.5Å; P511-S515 PolarHBondContact O-N 2.84Å; P511-S515 PolarHBondContact O-OG 2.75Å
512	I	58.2	Low	65.1	Low	120 Å²	120	115.1 Å²	115.1	62%	0.615	54%	0.538	S	S	*	.	H	α-helix	trans	-61.7	-37.7	172.3	-57.8	174.1	0	0	0	111.4	D510 R516	D510-I512 PolarHBondContact O-N 3.35Å; D510-I512 VanDerWaalsContact O-N 3.1Å; I512-R516 WeakPolarHBondContact O-CB 3.42Å; I512-R516 PolarHBondContact O-N 3.04Å
513	S	59.1	Low	64	Low	52 Å²	52	115 Å²	115	36%	0.364	55%	0.546	S	S	.	.	H	α-helix	trans	-73.5	-42.2	-178.2	74	0	0	0	0	112.6	D510 P511 R516 R517	D510-S513 WeakPolarHBondContact O-CA 3.38Å; D510-S513 WeakPolarHBondContact O-CB 3.1Å; D510-S513 PolarHBondContact O-N 2.68Å; D510-S513 PolarHBondContact O-OG 3.4Å; P511-S513 VanDerWaalsContact C-N 3.32Å; P511-S513 PolarHBondContact O-N 2.04Å; S513-R516 PolarHBondContact O-N 3.48Å; S513-R517 PolarHBondContact O-N 2.87Å
514	E	62.5	Low	63.3	Low	80 Å²	80	115 Å²	115	37%	0.374	55%	0.547	S	S	.	.	H	α-helix	trans	-72.4	-38.8	177.9	-144.2	154.8	160.9	0	0	110	R509 D510 R516 R517 V518	R509-E514 WeakPolarHBondContact CG-OE2 3.19Å; R509-E514 IonicContact CZ-OE1 3.65Å; R509-E514 IonicContact CZ-OE2 2.7Å; R509-E514 IonicContact NE-OE1 2.75Å; R509-E514 PolarHBondContact NE-OE1 3.38Å; R509-E514 IonicContact NE-OE2 2.82Å; R509-E514 PolarHBondContact NE-OE2 3.26Å; R509-E514 IonicContact NH2-OE1 3.27Å; R509-E514 PolarHBondContact NH2-OE1 2.97Å; R509-E514 IonicContact NH2-OE2 2.68Å; D510-E514 PolarHBondContact O-N 3.11Å; E514-R516 PolarHBondContact O-N 3.44Å; E514-R517 PolarHBondContact O-N 3.42Å; E514-V518 WeakPolarHBondContact O-CG2 3.18Å; E514-V518 PolarHBondContact O-N 3.2Å
515	S	57.5	Low	62.5	Low	65 Å²	65	114.1 Å²	114.1	46%	0.455	54%	0.544	S	S	.	.	H	α-helix	trans	-58.7	-45.6	169.2	-57.4	0	0	0	0	112.4	P511 R517 V518 L519	P511-S515 WeakPolarHBondContact O-CB 3.5Å; P511-S515 PolarHBondContact O-N 2.84Å; P511-S515 PolarHBondContact O-OG 2.75Å; S515-R517 VanDerWaalsContact C-N 3.3Å; S515-R517 PolarHBondContact O-N 2.83Å; S515-V518 PolarHBondContact O-N 3.21Å; S515-L519 PolarHBondContact O-N 2.58Å
516	R	64.1	Low	61.7	Low	174 Å²	174	114 Å²	114	66%	0.657	55%	0.547	S	S	*	.	H	α-helix	trans	-65.7	-32.9	179.4	-163.5	-179.7	-65.1	-158.4	0.8	111.6	I512 S513 E514 Q520	I512-R516 WeakPolarHBondContact O-CB 3.42Å; I512-R516 PolarHBondContact O-N 3.04Å; S513-R516 PolarHBondContact O-N 3.48Å; E514-R516 PolarHBondContact O-N 3.44Å; R516-Q520 WeakPolarHBondContact O-CB 3.06Å; R516-Q520 PolarHBondContact O-N 3.23Å
517	R	63.7	Low	61.4	Low	161 Å²	161	116.5 Å²	116.5	61%	0.608	56%	0.56	S	S	*	*	H	α-helix	trans	-65.3	-45.7	170.6	-108.3	-168.9	70.6	-164.8	-2.5	112.6	S513 E514 S515 L519 Q520 E521	S513-R517 PolarHBondContact O-N 2.87Å; E514-R517 PolarHBondContact O-N 3.42Å; S515-R517 VanDerWaalsContact C-N 3.3Å; S515-R517 PolarHBondContact O-N 2.83Å; R517-L519 VanDerWaalsContact C-N 3.33Å; R517-L519 PolarHBondContact O-N 3.26Å; R517-Q520 WeakPolarHBondContact O-CB 3.5Å; R517-Q520 PolarHBondContact O-N 2.99Å; R517-Q520 VanDerWaalsContact O-N 3.15Å; R517-E521 IonicContact CZ-OE1 3.54Å; R517-E521 IonicContact NE-OE1 3.38Å; R517-E521 PolarHBondContact NE-OE1 2.88Å; R517-E521 IonicContact NH2-OE1 2.74Å; R517-E521 PolarHBondContact NH2-OE1 3.11Å; R517-E521 IonicContact NH2-OE2 3.95Å; R517-E521 WeakPolarHBondContact O-CB 3.4Å; R517-E521 WeakPolarHBondContact O-CG 3.38Å; R517-E521 PolarHBondContact O-N 2.04Å
518	V	63.2	Low	61.2	Low	92 Å²	92	112.4 Å²	112.4	56%	0.558	55%	0.549	S	S	*	.	H	α-helix	trans	-64.2	-37	178.2	174.1	0	0	0	0	111.8	E514 S515 S522	E514-V518 WeakPolarHBondContact O-CG2 3.18Å; E514-V518 PolarHBondContact O-N 3.2Å; S515-V518 PolarHBondContact O-N 3.21Å; V518-S522 WeakPolarHBondContact O-CB 3.27Å; V518-S522 PolarHBondContact O-N 3.04Å; V518-S522 PolarHBondContact O-OG 2.84Å
519	L	62.9	Low	61.2	Low	112 Å²	112	109.9 Å²	109.9	59%	0.586	54%	0.539	S	S	*	.	H	α-helix	trans	-65.3	-41	170.4	-95.8	139.1	0	0	0	112.8	S515 R517 S522 C523	S515-L519 PolarHBondContact O-N 2.58Å; R517-L519 VanDerWaalsContact C-N 3.33Å; R517-L519 PolarHBondContact O-N 3.26Å; L519-S522 WeakPolarHBondContact CA-OG 3.48Å; L519-S522 PolarHBondContact O-OG 3.14Å; L519-C523 WeakPolarHBondContact O-CB 3.47Å; L519-C523 PolarHBondContact O-N 2.04Å; L519-C523 PolarHBondContact O-SG 3.05Å; L519-C523 VanDerWaalsContact O-SG 3.39Å
520	Q	69.5	Low	61.2	Low	130 Å²	130	108.5 Å²	108.5	61%	0.607	54%	0.543	S	S	*	.	H	α-helix	trans	-63.6	-48.4	175.7	-165.2	96.4	9.5	0	0	111.5	R516 R517 S522 C523 E524	R516-Q520 WeakPolarHBondContact O-CB 3.06Å; R516-Q520 PolarHBondContact O-N 3.23Å; R517-Q520 WeakPolarHBondContact O-CB 3.5Å; R517-Q520 PolarHBondContact O-N 2.99Å; R517-Q520 VanDerWaalsContact O-N 3.15Å; Q520-S522 VanDerWaalsContact C-N 3.34Å; Q520-S522 PolarHBondContact O-N 2.84Å; Q520-C523 PolarHBondContact O-N 3.45Å; Q520-E524 PolarHBondContact O-N 3.48Å
521	E	65.3	Low	61.2	Low	91 Å²	91	107.3 Å²	107.3	43%	0.425	54%	0.541	S	S	.	.	H	α-helix	trans	-66.2	-34.1	-177.7	-72.4	169.1	-156.2	0	0	112.1	R517 F525	R517-E521 IonicContact CZ-OE1 3.54Å; R517-E521 IonicContact NE-OE1 3.38Å; R517-E521 PolarHBondContact NE-OE1 2.88Å; R517-E521 IonicContact NH2-OE1 2.74Å; R517-E521 PolarHBondContact NH2-OE1 3.11Å; R517-E521 IonicContact NH2-OE2 3.95Å; R517-E521 WeakPolarHBondContact O-CB 3.4Å; R517-E521 WeakPolarHBondContact O-CG 3.38Å; R517-E521 PolarHBondContact O-N 2.04Å; E521-F525 PolarHBondContact O-N 3.26Å; E521-F525 VanDerWaalsContact O-N 3.15Å
522	S	60.7	Low	60.9	Low	48 Å²	48	111.2 Å²	111.2	34%	0.336	54%	0.543	S	S	.	.	H	α-helix	trans	-75.4	-38.8	173.7	51.5	0	0	0	0	113.2	V518 L519 Q520 F525 F526	V518-S522 WeakPolarHBondContact O-CB 3.27Å; V518-S522 PolarHBondContact O-N 3.04Å; V518-S522 PolarHBondContact O-OG 2.84Å; L519-S522 WeakPolarHBondContact CA-OG 3.48Å; L519-S522 PolarHBondContact O-OG 3.14Å; Q520-S522 VanDerWaalsContact C-N 3.34Å; Q520-S522 PolarHBondContact O-N 2.84Å; S522-F525 WeakPolarHBondContact O-CB 3.29Å; S522-F525 PolarHBondContact O-N 3.38Å; S522-F526 VanDerWaalsContact O-CD2 3.27Å; S522-F526 WeakPolarHBondContact O-CD2 3.49Å; S522-F526 PolarHBondContact O-N 2.87Å; S522-F526 VanDerWaalsContact O-N 3.1Å
523	C	62.2	Low	60.5	Low	72 Å²	72	110.2 Å²	110.2	49%	0.486	54%	0.543	S	S	.	.	H	α-helix	trans	-61.2	-42.7	171.7	-79.3	0	0	0	0	112.5	L519 Q520 F525 F526 L527	L519-C523 WeakPolarHBondContact O-CB 3.47Å; L519-C523 PolarHBondContact O-N 2.04Å; L519-C523 PolarHBondContact O-SG 3.05Å; L519-C523 VanDerWaalsContact O-SG 3.39Å; Q520-C523 PolarHBondContact O-N 3.45Å; C523-F525 VanDerWaalsContact C-N 3.32Å; C523-F525 PolarHBondContact O-N 3.01Å; C523-F526 PolarHBondContact O-N 3.28Å; C523-L527 WeakPolarHBondContact O-CG 3.38Å; C523-L527 PolarHBondContact O-N 3.28Å; C523-L527 VanDerWaalsContact O-N 3.15Å
524	E	69.6	Low	59.9	Low	125 Å²	125	116 Å²	116	58%	0.584	56%	0.564	S	S	*	*	H	α-helix	trans	-59.8	-42.5	172.3	-77.6	-157.1	142	0	0	111.9	Q520 F526 L527 K528	Q520-E524 PolarHBondContact O-N 3.48Å; E524-F526 PolarHBondContact O-N 3.29Å; E524-L527 PolarHBondContact O-N 3.1Å; E524-K528 WeakPolarHBondContact O-CB 3.4Å; E524-K528 PolarHBondContact O-N 3.43Å
525	F	64.8	Low	59.3	Low	132 Å²	132	120.5 Å²	120.5	58%	0.579	59%	0.585	S	S	*	*	H	α-helix	trans	-58.8	-48.3	179.3	-173.8	-94.7	0	0	0	112	E521 S522 C523 K528 H529	E521-F525 PolarHBondContact O-N 3.26Å; E521-F525 VanDerWaalsContact O-N 3.15Å; S522-F525 WeakPolarHBondContact O-CB 3.29Å; S522-F525 PolarHBondContact O-N 3.38Å; C523-F525 VanDerWaalsContact C-N 3.32Å; C523-F525 PolarHBondContact O-N 3.01Å; F525-K528 PolarHBondContact O-N 2.92Å; F525-H529 WeakPolarHBondContact O-CB 3.36Å; F525-H529 PolarHBondContact O-N 3.35Å
526	F	58.5	Low	58.7	Low	139 Å²	139	126.6 Å²	126.6	61%	0.61	60%	0.603	S	S	*	*	H	α-helix	trans	-66.6	-40.8	179.5	-78	-69.6	0	0	0	113.4	S522 C523 E524 K528 H529 N530	S522-F526 VanDerWaalsContact O-CD2 3.27Å; S522-F526 WeakPolarHBondContact O-CD2 3.49Å; S522-F526 PolarHBondContact O-N 2.87Å; S522-F526 VanDerWaalsContact O-N 3.1Å; C523-F526 PolarHBondContact O-N 3.28Å; E524-F526 PolarHBondContact O-N 3.29Å; F526-K528 VanDerWaalsContact C-N 3.35Å; F526-K528 PolarHBondContact O-N 3.22Å; F526-H529 PolarHBondContact O-N 3.36Å; F526-N530 PolarHBondContact O-N 3.03Å
527	L	63.7	Low	57.8	Low	129 Å²	129	127.5 Å²	127.5	68%	0.675	61%	0.612	S	S	*	*	H	α-helix	trans	-63	-41.3	175.4	-72.7	168.4	0	0	0	111.8	C523 E524 H529 S531	C523-L527 WeakPolarHBondContact O-CG 3.38Å; C523-L527 PolarHBondContact O-N 3.28Å; C523-L527 VanDerWaalsContact O-N 3.15Å; E524-L527 PolarHBondContact O-N 3.1Å; L527-H529 VanDerWaalsContact C-N 3.29Å; L527-H529 PolarHBondContact O-N 3.03Å; L527-S531 PolarHBondContact O-N 3.5Å; L527-S531 PolarHBondContact O-OG 2.86Å
528	K	60.8	Low	56.4	Low	134 Å²	134	129 Å²	129	58%	0.583	62%	0.623	S	S	*	*	H	α-helix	trans	-72.1	-21.4	178.7	-160	169.3	-165.5	165.5	0	113.1	E524 F525 F526 S531 R532	E524-K528 WeakPolarHBondContact O-CB 3.4Å; E524-K528 PolarHBondContact O-N 3.43Å; F525-K528 PolarHBondContact O-N 2.92Å; F526-K528 VanDerWaalsContact C-N 3.35Å; F526-K528 PolarHBondContact O-N 3.22Å; K528-S531 PolarHBondContact O-OG 2.91Å; K528-R532 WeakPolarHBondContact O-CD 3.33Å; K528-R532 WeakPolarHBondContact O-CG 3.1Å
529	H	56.1	Low	55.2	Low	113 Å²	113	133.4 Å²	133.4	52%	0.523	64%	0.636	S	S	.	*	H	α-helix	trans	-85	-40.6	174.5	-147.1	-58.7	0	0	0	112.9	F525 F526 L527 R532	F525-H529 WeakPolarHBondContact O-CB 3.36Å; F525-H529 PolarHBondContact O-N 3.35Å; F526-H529 PolarHBondContact O-N 3.36Å; L527-H529 VanDerWaalsContact C-N 3.29Å; L527-H529 PolarHBondContact O-N 3.03Å; H529-R532 PolarHBondContact O-N 3.17Å
530	N	52.1	Low	53.6	Low	117 Å²	117	137.6 Å²	137.6	63%	0.626	65%	0.646	S	S	*	*	H	α-helix	trans	-66.7	-44.8	178.8	-94.8	-50.4	0	0	0	113	F526 R532 V533	F526-N530 PolarHBondContact O-N 3.03Å; N530-R532 PolarHBondContact O-N 3.29Å; N530-V533 PolarHBondContact O-N 3.03Å
531	S	54.3	Low	51.7	Low	67 Å²	67	140.3 Å²	140.3	47%	0.469	66%	0.656	S	S	.	*	H	α-helix	trans	-57.1	-30.4	177.5	45.4	0	0	0	0	113.6	L527 K528 V533	L527-S531 PolarHBondContact O-N 3.5Å; L527-S531 PolarHBondContact O-OG 2.86Å; K528-S531 PolarHBondContact O-OG 2.91Å; S531-V533 VanDerWaalsContact C-N 3.34Å; S531-V533 PolarHBondContact O-N 3.26Å
532	R	50.3	Low	50.8	Low	182 Å²	182	140 Å²	140	69%	0.687	66%	0.662	S	S	*	*	H	α-helix	trans	-74.5	-17.4	177.5	-75.3	177.6	166.3	-170.6	-5.7	114.6	K528 H529 N530	K528-R532 WeakPolarHBondContact O-CD 3.33Å; K528-R532 WeakPolarHBondContact O-CG 3.1Å; H529-R532 PolarHBondContact O-N 3.17Å; N530-R532 PolarHBondContact O-N 3.29Å
533	V	49.4	Very low	49.3	Very low	100 Å²	100	143.8 Å²	143.8	61%	0.606	68%	0.683	S	S	*	*	H	α-helix	trans	-80.2	-35.8	-177.1	178	0	0	0	0	112	N530 S531	N530-V533 PolarHBondContact O-N 3.03Å; S531-V533 VanDerWaalsContact C-N 3.34Å; S531-V533 PolarHBondContact O-N 3.26Å
534	Q	46.2	Very low	47.9	Very low	174 Å²	174	145.7 Å²	145.7	81%	0.813	70%	0.697	S	S	*	*	H	α-helix	trans	-74.3	-30.1	-174.9	-64.7	-162.2	1.4	0	0	114	K536	Q534-K536 VanDerWaalsContact C-N 3.26Å; Q534-K536 PolarHBondContact O-N 2.99Å; Q534-K536 VanDerWaalsContact O-N 3.15Å
535	H	49.6	Very low	46.2	Very low	174 Å²	174	147.1 Å²	147.1	81%	0.806	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76	4.2	-173.9	-82.1	-75.6	0	0	0	116.3
536	K	45.6	Very low	44.6	Very low	193 Å²	193	149.9 Å²	149.9	84%	0.839	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.7	34.1	-176.8	-84.8	-166.3	171	-172.4	0	115.7	Q534	Q534-K536 VanDerWaalsContact C-N 3.26Å; Q534-K536 PolarHBondContact O-N 2.99Å; Q534-K536 VanDerWaalsContact O-N 3.15Å
537	K	45.2	Very low	43.3	Very low	193 Å²	193	150.9 Å²	150.9	84%	0.839	73%	0.726	S	S	*	*			trans	-133.8	82.3	170.4	-77.3	-171.1	175.9	179.8	0	114.2
538	K	35.2	Very low	41.8	Very low	193 Å²	193	152.4 Å²	152.4	84%	0.839	73%	0.727	S	S	*	*			trans	-178.6	159.4	139.8	-104.6	168.6	-177.9	179.4	0	113.2
539	H	36.5	Very low	40.3	Very low	183 Å²	183	152.8 Å²	152.8	85%	0.847	74%	0.74	S	S	*	*			trans	81	99.1	173	-59.6	-74	0	0	0	119.4
540	Y	29.6	Very low	39.4	Very low	200 Å²	200	153.9 Å²	153.9	78%	0.784	75%	0.749	S	S	*	*			trans	-156	138.6	153.6	174.7	-98.5	0	0	0	110.7
541	K	30.9	Very low	38.7	Very low	188 Å²	188	153.3 Å²	153.3	82%	0.817	75%	0.754	S	S	*	*			trans	174.5	154.3	162	-105.1	-175.4	177.7	-174.9	0	108.7
542	P	44.9	Very low	37.9	Very low	85 Å²	85	159.5 Å²	159.5	55%	0.552	77%	0.773	S	S	*	*			cis	-139.5	-162.6	-44.3	36.2	-15.6	0	0	0	113.2
543	T	29.3	Very low	37.3	Very low	126 Å²	126	154.8 Å²	154.8	77%	0.773	77%	0.767	S	S	*	*			trans	79.3	147.4	177.8	76.7	0	0	0	0	115.4
544	S	33.1	Very low	36.7	Very low	112 Å²	112	158.5 Å²	158.5	78%	0.783	78%	0.78	S	S	*	*			cis	-132.3	-169.1	7.8	-165.3	0	0	0	0	113.6
545	H	34.1	Very low	36.2	Very low	156 Å²	156	153 Å²	153	72%	0.722	77%	0.769	S	S	*	*			trans	-97.4	154.4	-149.1	-68.4	-89.9	0	0	0	120.3
546	K	32.1	Very low	35.5	Very low	190 Å²	190	150.9 Å²	150.9	83%	0.826	77%	0.769	S	S	*	*			trans	66.4	156.6	144.6	-77.4	174.2	179.8	-180	0	117.9
547	L	30.8	Very low	35.1	Very low	159 Å²	159	146.2 Å²	146.2	83%	0.832	76%	0.761	S	S	*	*			cis	-140.5	-165.3	11.8	-131.9	158.8	0	0	0	112.4
548	K	31	Very low	34.6	Very low	161 Å²	161	143.5 Å²	143.5	70%	0.7	76%	0.761	S	S	*	*			trans	-155	140.9	-159.5	169.7	-164.3	176.8	-173.1	0	113	I550	K548-I550 VanDerWaalsContact CE-CD1 3.47Å
549	V	30.4	Very low	34.4	Very low	142 Å²	142	138.3 Å²	138.3	86%	0.861	75%	0.754	S	S	*	*			trans	-143.4	150.4	162.7	179.8	0	0	0	0	111.3
550	I	36.5	Very low	34.2	Very low	136 Å²	136	137.6 Å²	137.6	70%	0.697	75%	0.754	S	S	*	*			trans	-149.4	144.6	-176.9	-63.2	173.6	0	0	0	110.1	K548	K548-I550 VanDerWaalsContact CE-CD1 3.47Å
551	S	37.4	Very low	34.3	Very low	106 Å²	106	133.1 Å²	133.1	74%	0.741	75%	0.752	S	S	*	*			trans	-174.9	164.4	157.1	58.2	0	0	0	0	110.4
552	K	37.7	Very low	35.1	Very low	197 Å²	197	130.1 Å²	130.1	86%	0.857	75%	0.752	S	S	*	*			cis	-172.4	172.9	-20.8	-104.6	-167.2	171.6	-172.9	0	107
553	S	37.3	Very low	34.4	Very low	82 Å²	82	130.2 Å²	130.2	57%	0.573	76%	0.76	S	S	*	*			cis	179.7	150.7	-42.9	56.9	0	0	0	0	111
554	M	38.1	Very low	34.5	Very low	179 Å²	179	129.1 Å²	129.1	88%	0.882	76%	0.757	S	S	*	*			trans	80.5	150.9	167.1	-50.3	-94.5	-76	0	0	117.6
555	G	34.8	Very low	34.3	Very low	57 Å²	57	129.6 Å²	129.6	59%	0.588	76%	0.756	S	S	*	*			cis	159.6	161.2	-13	0	0	0	0	0	115.8
556	T	34.9	Very low	34.2	Very low	131 Å²	131	127.8 Å²	127.8	80%	0.804	76%	0.756	S	S	*	*			trans	64.7	149.5	158.8	47.3	0	0	0	0	119.9
557	S	37.3	Very low	34.3	Very low	94 Å²	94	126 Å²	126	66%	0.657	75%	0.75	S	S	*	*			cis	-166.9	154.9	-5.8	-96.5	0	0	0	0	113.6
558	T	35.2	Very low	34.3	Very low	137 Å²	137	127.1 Å²	127.1	84%	0.84	75%	0.751	S	S	*	*			trans	41.1	157.5	145	58.6	0	0	0	0	124.6
559	A	30.7	Very low	34.2	Very low	83 Å²	83	122.4 Å²	122.4	69%	0.686	75%	0.748	S	S	*	*			cis	179.6	174.1	-25	0	0	0	0	0	111.3
560	I	32.2	Very low	34.2	Very low	168 Å²	168	121.5 Å²	121.5	86%	0.862	75%	0.748	S	S	*	*			trans	86	141.5	160.5	-58.2	171.8	0	0	0	118.8
561	S	31.5	Very low	33.8	Very low	106 Å²	106	120.2 Å²	120.2	74%	0.741	75%	0.751	S	S	*	*			trans	-127	176.2	176.3	-39.1	0	0	0	0	109.4
562	P	47.9	Very low	33.5	Very low	125 Å²	125	119.4 Å²	119.4	81%	0.812	75%	0.751	S	S	*	*				-159.5	-175.2	68.4	43.3	-21	0	0	0	118.8
563	A	30.8	Very low	33	Very low	87 Å²	87	120.1 Å²	120.1	72%	0.719	76%	0.755	S	S	*	*			trans	89.7	118.4	143.5	0	0	0	0	0	123.6
564	S	30.3	Very low	32.5	Very low	103 Å²	103	119.5 Å²	119.5	72%	0.72	76%	0.761	S	S	*	*			trans	67.5	100.8	133.7	61.6	0	0	0	0	124.2
565	T	29.9	Very low	32.1	Very low	123 Å²	123	118 Å²	118	76%	0.755	76%	0.757	S	S	*	*				64.7	127.2	124.1	55.9	0	0	0	0	124
566	T	32.1	Very low	32	Very low	118 Å²	118	122.5 Å²	122.5	72%	0.724	76%	0.762	S	S	*	*			trans	66.7	153.5	148.8	44	0	0	0	0	118.6
567	H	32.8	Very low	31.8	Very low	151 Å²	151	123.6 Å²	123.6	70%	0.699	76%	0.758	S	S	*	*			cis	-152.3	151.9	5.1	-127.9	-57.5	0	0	0	110.5
568	Q	31.3	Very low	31.2	Very low	184 Å²	184	125.2 Å²	125.2	86%	0.86	76%	0.759	S	S	*	*			trans	62.5	162	160.1	-68.5	164.8	-4.3	0	0	117.1
569	G	29	Very low	30.9	Very low	62 Å²	62	126.8 Å²	126.8	64%	0.639	76%	0.756	S	S	*	*			cis	163.9	151.4	-9.8	0	0	0	0	0	112.3
570	S	30.3	Very low	30.7	Very low	122 Å²	122	127.4 Å²	127.4	85%	0.853	76%	0.761	S	S	*	*			trans	65.6	135.1	175.7	-52.9	0	0	0	0	116.6
571	S	29	Very low	30.5	Very low	110 Å²	110	131.7 Å²	131.7	77%	0.769	77%	0.767	S	S	*	*			cis	102.8	102.7	15.5	80.5	0	0	0	0	116.4
572	A	30.8	Very low	30.2	Very low	89 Å²	89	130 Å²	130	74%	0.736	77%	0.766	S	S	*	*			trans	-161.4	131.8	153.8	0	0	0	0	0	106.9
573	F	26.3	Very low	29.2	Very low	212 Å²	212	129.5 Å²	129.5	93%	0.93	77%	0.765	S	S	*	*				58.5	128.7	71	-69.4	-68.1	0	0	0	113.5
574	G	27.6	Very low	29	Very low	69 Å²	69	132.4 Å²	132.4	71%	0.711	77%	0.768	S	S	*	*			cis	-171	-171	2.2	0	0	0	0	0	114.6
575	N	30.2	Very low	28.9	Very low	148 Å²	148	131.7 Å²	131.7	79%	0.791	76%	0.763	S	S	*	*			trans	-71.7	156.9	-171.8	-49.4	-23.9	0	0	0	114.6
576	H	32.3	Very low	28.8	Very low	150 Å²	150	133.9 Å²	133.9	69%	0.694	77%	0.765	S	S	*	*				172.8	141.6	106.8	-103.1	-96	0	0	0	114.2
577	E	29.6	Very low	28.6	Very low	155 Å²	155	133.9 Å²	133.9	72%	0.724	77%	0.765	S	S	*	*			trans	50	164.2	141	-72.6	-178.1	106.3	0	0	123.6
578	L	26.6	Very low	28.3	Very low	127 Å²	127	132.6 Å²	132.6	67%	0.665	77%	0.772	S	S	*	*			cis	-165.1	155.3	-36	-162.2	68.3	0	0	0	110.4
579	H	28.5	Very low	28.2	Very low	170 Å²	170	128 Å²	128	79%	0.787	77%	0.766	S	S	*	*			trans	41.4	119.7	158.9	-77.3	-41.1	0	0	0	123.5
580	A	26.7	Very low	28.1	Very low	96 Å²	96	136.9 Å²	136.9	79%	0.793	78%	0.78	S	S	*	*				162.6	109.4	112.6	0	0	0	0	0	110.3
581	R	27.3	Very low	28.1	Very low	259 Å²	259	139.9 Å²	139.9	98%	0.977	78%	0.781	S	S	*	*				82.3	112.8	64.6	-166.9	-174.4	-160.5	-169.5	7.1	114.2
582	G	26	Very low	28	Very low	70 Å²	70	143.5 Å²	143.5	72%	0.722	79%	0.785	S	S	*	*			trans	-179.5	136.3	163.7	0	0	0	0	0	115.2
583	S	25.7	Very low	28.1	Very low	115 Å²	115	145.9 Å²	145.9	80%	0.804	79%	0.785	S	S	*	*			trans	65.6	136.4	156.9	-143.3	0	0	0	0	119.6
584	L	27.8	Very low	28.2	Very low	148 Å²	148	142.6 Å²	142.6	78%	0.775	78%	0.777	S	S	*	*			cis	-172.6	162.8	-27.5	-117.1	164.9	0	0	0	108.5
585	S	27.6	Very low	28.2	Very low	88 Å²	88	151.5 Å²	151.5	62%	0.615	79%	0.789	S	S	*	*			trans	34.6	148.7	147.9	62.7	0	0	0	0	123
586	E	28	Very low	28	Very low	168 Å²	168	148.1 Å²	148.1	79%	0.785	79%	0.789	S	S	*	*			cis	-168.7	173.8	-5.3	-115.8	-178.5	125.9	0	0	111.7
587	T	27.3	Very low	27.8	Very low	119 Å²	119	146 Å²	146	73%	0.73	80%	0.798	S	S	*	*			trans	15	135.8	155.2	64.5	0	0	0	0	121.9
588	S	26	Very low	27.7	Very low	123 Å²	123	144.3 Å²	144.3	86%	0.86	80%	0.803	S	S	*	*				175.8	164	94.5	-166.4	0	0	0	0	112
589	A	28.9	Very low	27.7	Very low	87 Å²	87	142 Å²	142	72%	0.719	81%	0.809	S	S	*	*			trans	-134.1	154.6	-177.7	0	0	0	0	0	112.3
590	R	27.6	Very low	27.7	Very low	250 Å²	250	145.4 Å²	145.4	94%	0.943	82%	0.815	S	S	*	*			trans	-168.4	147.1	146.9	-117.7	170.4	174.9	138.7	0.3	114.2
591	E	30.6	Very low	27.7	Very low	184 Å²	184	145.9 Å²	145.9	86%	0.86	81%	0.813	S	S	*	*			trans	-86.1	168.6	164.2	-59.4	169.8	105.9	0	0	110.9
592	H	27.6	Very low	27.9	Very low	187 Å²	187	138.1 Å²	138.1	87%	0.866	80%	0.798	S	S	*	*			trans	-149.1	150.2	153	-141.9	-80.2	0	0	0	113.1
593	L	31	Very low	28.1	Very low	139 Å²	139	146.2 Å²	146.2	73%	0.728	81%	0.807	S	S	*	*			trans	-106.8	159.4	-172.4	-82.2	159.1	0	0	0	114.2
594	D	30.1	Very low	28.3	Very low	142 Å²	142	150.6 Å²	150.6	76%	0.759	81%	0.806	S	S	*	*			trans	43.5	128.3	147.9	-69.9	-32.7	0	0	0	122.9
595	R	27.6	Very low	28.3	Very low	257 Å²	257	150.2 Å²	150.2	97%	0.97	80%	0.8	S	S	*	*				-168.2	159.7	118	-110.1	168	170.6	153	-2.3	113
596	G	25.3	Very low	28.3	Very low	77 Å²	77	156.9 Å²	156.9	79%	0.794	81%	0.812	S	S	*	*			trans	-150.8	160.2	177	0	0	0	0	0	114.4
597	A	28	Very low	28.4	Very low	106 Å²	106	156.9 Å²	156.9	88%	0.876	81%	0.812	S	S	*	*			trans	-174.9	168.8	177.5	0	0	0	0	0	109.1
598	S	27	Very low	28.4	Very low	119 Å²	119	162.7 Å²	162.7	83%	0.832	82%	0.82	S	S	*	*			cis	-174	128.1	-33.9	178.8	0	0	0	0	109.7
599	G	26.9	Very low	28.6	Very low	77 Å²	77	165.7 Å²	165.7	79%	0.794	82%	0.821	S	S	*	*			trans	67.3	-177	166.7	0	0	0	0	0	117.6
600	R	29.1	Very low	28.6	Very low	243 Å²	243	171.8 Å²	171.8	92%	0.917	83%	0.825	S	S	*	*			cis	-166.2	165.8	-24.3	-169.1	170.3	-177.9	-178.5	1.3	109.3
601	S	26.7	Very low	28.7	Very low	106 Å²	106	167.6 Å²	167.6	74%	0.741	82%	0.816	S	S	*	*			trans	77.4	155.4	167.3	-94.4	0	0	0	0	118.6
602	S	31.6	Very low	28.6	Very low	96 Å²	96	162.5 Å²	162.5	67%	0.671	81%	0.813	S	S	*	*			cis	176.1	133.1	-30.1	53.3	0	0	0	0	111
603	R	28.9	Very low	28.6	Very low	239 Å²	239	157.2 Å²	157.2	90%	0.902	81%	0.809	S	S	*	*			trans	171.1	130.3	136.3	-102.3	175.7	164.2	157.1	-4.7	114.4
604	R	30.2	Very low	28.5	Very low	207 Å²	207	157.3 Å²	157.3	78%	0.781	81%	0.806	S	S	*	*				21.9	145.1	121.6	-86.5	-170.3	158	146.4	-1.1	120
605	E	29.1	Very low	28.6	Very low	141 Å²	141	159.3 Å²	159.3	66%	0.659	80%	0.803	S	S	*	*			cis	-174.1	164.1	-3	-154.3	158.9	-123.3	0	0	111.3
606	R	27.5	Very low	28.7	Very low	228 Å²	228	157.5 Å²	157.5	86%	0.86	80%	0.796	S	S	*	*			trans	122.5	143.8	153.8	-71.5	-167.2	166.2	-164.8	-5.3	118.5
607	E	29.6	Very low	28.9	Very low	167 Å²	167	158.2 Å²	158.2	78%	0.78	79%	0.788	S	S	*	*			trans	-97	166.6	-177.9	-32.7	103.5	126.2	0	0	113.3
608	R	27.9	Very low	29	Very low	242 Å²	242	163.3 Å²	163.3	91%	0.913	79%	0.791	S	S	*	*				-170	143.8	106.8	-102	174.9	-178.1	-168.1	-1.5	113
609	E	30.1	Very low	29	Very low	185 Å²	185	161.3 Å²	161.3	86%	0.864	79%	0.789	S	S	*	*			trans	-94.7	161.4	175.4	-58	173.5	118	0	0	111.6
610	R	27.5	Very low	29.1	Very low	215 Å²	215	161.5 Å²	161.5	81%	0.811	79%	0.791	S	S	*	*				-168.9	128.1	123.8	-99.1	-172.4	163.1	146.3	4.1	109
611	E	31.3	Very low	29.1	Very low	163 Å²	163	155.8 Å²	155.8	76%	0.762	79%	0.788	S	S	*	*				57.2	131.4	82.9	-59.6	-172	113.1	0	0	113.7
612	G	27.4	Very low	29.3	Very low	76 Å²	76	155.5 Å²	155.5	78%	0.784	79%	0.786	S	S	*	*			cis	165.7	166.8	-4.9	0	0	0	0	0	113.8
613	G	27.8	Very low	29.1	Very low	76 Å²	76	155.9 Å²	155.9	78%	0.784	79%	0.789	S	S	*	*			trans	72.4	170	168.2	0	0	0	0	0	117.5
614	E	29.3	Very low	29.1	Very low	142 Å²	142	153.6 Å²	153.6	66%	0.664	79%	0.786	S	S	*	*			cis	-166.9	162.1	-33.6	-133.3	-160.4	133.1	0	0	110.3
615	R	31.4	Very low	28.9	Very low	184 Å²	184	149.8 Å²	149.8	69%	0.694	79%	0.785	S	S	*	*			trans	71.6	129.2	149.5	-72.9	171.6	-169.8	166	20.9	123.7
616	R	30	Very low	28.7	Very low	218 Å²	218	148.3 Å²	148.3	82%	0.823	79%	0.79	S	S	*	*			trans	74.3	102.8	130.9	-75.4	-175.6	164.8	176.5	-3.9	120
617	S	30.3	Very low	28.7	Very low	92 Å²	92	143.2 Å²	143.2	64%	0.643	79%	0.79	S	S	*	*				82.4	144.1	69	74.4	0	0	0	0	116.3
618	K	29.1	Very low	28.6	Very low	214 Å²	214	144.9 Å²	144.9	93%	0.93	79%	0.788	S	S	*	*			trans	79.1	145.7	-177.8	-55.9	-177.9	176.5	-176.4	0	114.5
619	G	27.9	Very low	28.5	Very low	77 Å²	77	138.9 Å²	138.9	79%	0.794	78%	0.784	S	S	*	*			cis	153.5	126.4	-12.3	0	0	0	0	0	114.1
620	G	27.9	Very low	28.6	Very low	80 Å²	80	136.7 Å²	136.7	83%	0.825	77%	0.774	S	S	*	*			trans	73.3	175	-177.9	0	0	0	0	0	113.8
621	S	30.2	Very low	28.7	Very low	124 Å²	124	131.4 Å²	131.4	87%	0.867	77%	0.769	S	S	*	*			cis	-155.5	175.6	-15.3	-162.7	0	0	0	0	110.8
622	S	30.3	Very low	28.6	Very low	99 Å²	99	131.3 Å²	131.3	69%	0.692	77%	0.771	S	S	*	*			trans	-44.7	165.5	-179.3	178.8	0	0	0	0	118
623	S	28.3	Very low	28.7	Very low	105 Å²	105	133.1 Å²	133.1	73%	0.734	76%	0.763	S	S	*	*			trans	90.9	147.7	153.1	-51.5	0	0	0	0	116.2
624	K	27	Very low	28.9	Very low	191 Å²	191	140.3 Å²	140.3	83%	0.83	77%	0.766	S	S	*	*			cis	172.5	147.3	-27.7	-130.9	-170.3	176.3	-178	0	104.7
625	V	26.6	Very low	29.1	Very low	127 Å²	127	140 Å²	140	77%	0.77	77%	0.773	S	S	*	*			trans	78.4	116.6	150	175.5	0	0	0	0	120.6
626	S	24.7	Very low	29	Very low	110 Å²	110	135.2 Å²	135.2	77%	0.769	77%	0.773	S	S	*	*			trans	69.3	117.5	139.9	-160.5	0	0	0	0	123
627	S	28.2	Very low	29.1	Very low	121 Å²	121	131.7 Å²	131.7	85%	0.846	77%	0.771	S	S	*	*				-144.7	143	108.6	60.2	0	0	0	0	110.6
628	R	26.9	Very low	29	Very low	201 Å²	201	130.4 Å²	130.4	76%	0.758	77%	0.772	S	S	*	*			trans	-148.9	122.9	-179.1	171.7	-174.1	174.3	-177.5	-1.8	110.7	E630	R628-E630 IonicContact CZ-OE1 2.66Å; R628-E630 IonicContact NE-OE1 3.11Å; R628-E630 PolarHBondContact NE-OE1 2.72Å; R628-E630 IonicContact NH2-OE1 2.96Å; R628-E630 PolarHBondContact NH2-OE1 2.69Å
629	S	26.8	Very low	29	Very low	116 Å²	116	129.6 Å²	129.6	81%	0.811	76%	0.763	S	S	*	*			trans	-158.4	134.7	155.7	-67.2	0	0	0	0	105.4
630	E	31.1	Very low	29	Very low	140 Å²	140	133.2 Å²	133.2	65%	0.654	76%	0.761	S	S	*	*			cis	69.3	142.8	33.3	-62.3	-180	-165	0	0	113.6	R628	R628-E630 IonicContact CZ-OE1 2.66Å; R628-E630 IonicContact NE-OE1 3.11Å; R628-E630 PolarHBondContact NE-OE1 2.72Å; R628-E630 IonicContact NH2-OE1 2.96Å; R628-E630 PolarHBondContact NH2-OE1 2.69Å
631	S	30.9	Very low	29	Very low	103 Å²	103	135.9 Å²	135.9	72%	0.72	76%	0.762	S	S	*	*			cis	-152.8	173.9	26.2	67.3	0	0	0	0	114.2
632	M	28.3	Very low	30.2	Very low	161 Å²	161	135.4 Å²	135.4	79%	0.793	76%	0.756	S	S	*	*			trans	159.5	136.9	137.4	-86.1	171.7	83.3	0	0	108.8
633	N	29.5	Very low	30	Very low	115 Å²	115	140.5 Å²	140.5	62%	0.615	77%	0.766	S	S	*	*			cis	-154.8	142.8	3.3	-132.3	-9.1	0	0	0	112.1
634	R	32.4	Very low	29.9	Very low	227 Å²	227	140.7 Å²	140.7	86%	0.857	77%	0.767	S	S	*	*			trans	22.7	150	144.3	-66	179.7	176.5	-171.5	-1.7	121.5
635	V	33.6	Very low	30	Very low	134 Å²	134	140 Å²	140	81%	0.812	77%	0.767	S	S	*	*			cis	-171.9	164.2	-1.9	127.4	0	0	0	0	106
636	A	29.3	Very low	30	Very low	84 Å²	84	142.1 Å²	142.1	69%	0.694	77%	0.773	S	S	*	*			cis	-124.5	-159.3	11.2	0	0	0	0	0	110.1
637	D	31.6	Very low	30.1	Very low	144 Å²	144	141.4 Å²	141.4	77%	0.77	77%	0.767	S	S	*	*			cis	68.8	138.1	13.1	-150	54	0	0	0	118.6
638	G	28.2	Very low	30.2	Very low	65 Å²	65	143.2 Å²	143.2	67%	0.67	77%	0.768	S	S	*	*			cis	-151	-161	-6	0	0	0	0	0	111.2
639	R	28.4	Very low	30.2	Very low	197 Å²	197	137.9 Å²	137.9	74%	0.743	77%	0.767	S	S	*	*			cis	-167	153.2	-1.9	-152.2	-175.1	-170.2	-169	4.8	110.6
640	M	28.4	Very low	30.3	Very low	153 Å²	153	143 Å²	143	75%	0.754	77%	0.768	S	S	*	*			trans	71.7	166.5	157.8	-81.4	156	175.9	0	0	121.4
641	T	28.7	Very low	30.2	Very low	137 Å²	137	144 Å²	144	84%	0.84	77%	0.773	S	S	*	*			trans	-142.4	-155.9	-162.3	48	0	0	0	0	111.2
642	P	55.3	Low	30	Very low	114 Å²	114	143 Å²	143	74%	0.74	77%	0.771	S	S	*	*				-121.6	169.3	-88.6	40	-24.6	0	0	0	115.1
643	K	26.2	Very low	29.9	Very low	206 Å²	206	141.8 Å²	141.8	90%	0.896	77%	0.773	S	S	*	*			trans	173.5	169.4	161	-103.7	168	-176.5	-177.1	0	110.1
644	S	25.7	Very low	29.8	Very low	108 Å²	108	141.7 Å²	141.7	76%	0.755	78%	0.781	S	S	*	*			cis	-160.1	172.3	-6.3	40	0	0	0	0	110.5
645	E	28.8	Very low	29.6	Very low	178 Å²	178	133.7 Å²	133.7	83%	0.832	77%	0.77	S	S	*	*			trans	-79.5	154.3	171.8	-56.3	154	120	0	0	112.4
646	L	27.2	Very low	29.4	Very low	171 Å²	171	135.2 Å²	135.2	90%	0.895	77%	0.768	S	S	*	*			trans	-167	-173.6	134.7	-130.6	65.8	0	0	0	113.2
647	S	26.6	Very low	29.3	Very low	94 Å²	94	137.3 Å²	137.3	66%	0.657	76%	0.764	S	S	*	*			trans	-148.9	169.8	-143.4	-51.2	0	0	0	0	115.2
648	D	30.4	Very low	29.2	Very low	159 Å²	159	137.3 Å²	137.3	85%	0.85	76%	0.759	S	S	*	*			trans	53.6	121.4	152.8	-75	-41.7	0	0	0	122.2
649	A	26.5	Very low	29.1	Very low	90 Å²	90	140.9 Å²	140.9	74%	0.744	76%	0.758	S	S	*	*				-174.3	118.6	116	0	0	0	0	0	114.3
650	R	29.8	Very low	29	Very low	222 Å²	222	138.9 Å²	138.9	84%	0.838	76%	0.757	S	S	*	*				33.7	152.3	121.4	-58.3	-174.8	-175.7	-170.7	1.5	120.6
651	Q	28.5	Very low	28.9	Very low	161 Å²	161	139.7 Å²	139.7	75%	0.752	76%	0.759	S	S	*	*			cis	-164.8	164.5	12.3	-136.6	164.6	-60.3	0	0	113.6
652	A	27.1	Very low	28.8	Very low	83 Å²	83	139.5 Å²	139.5	69%	0.686	75%	0.749	S	S	*	*			trans	70.7	149.1	152.5	0	0	0	0	0	118.9
653	T	26	Very low	27.5	Very low	135 Å²	135	141.2 Å²	141.2	83%	0.828	75%	0.747	S	S	*	*			cis	-152.4	150.7	1	-13.3	0	0	0	0	112.6
654	S	27.4	Very low	27.5	Very low	113 Å²	113	138.7 Å²	138.7	79%	0.79	74%	0.738	S	S	*	*			trans	28.7	136.6	152.2	-147.3	0	0	0	0	122.6
655	G	27.1	Very low	27.6	Very low	60 Å²	60	140.4 Å²	140.4	62%	0.619	74%	0.738	S	S	*	*			cis	164.3	145.3	-6.6	0	0	0	0	0	116
656	Q	29.7	Very low	27.4	Very low	165 Å²	165	137.1 Å²	137.1	77%	0.771	73%	0.73	S	S	*	*			trans	63.9	145.7	143.4	-57.7	176.6	-92.4	0	0	121
657	Q	27.7	Very low	27.3	Very low	129 Å²	129	136 Å²	136	60%	0.603	72%	0.724	S	S	*	*			cis	-158	144.4	-14.7	-114	177.3	-53	0	0	109.3
658	Q	28.6	Very low	27.2	Very low	143 Å²	143	138 Å²	138	67%	0.668	73%	0.728	S	S	*	*				50.5	148.4	97.3	-67.6	-169.9	-74.7	0	0	117.5
659	Q	26.5	Very low	27.1	Very low	140 Å²	140	138.3 Å²	138.3	65%	0.654	72%	0.724	S	S	*	*			cis	-167.8	177.5	-21.3	-173.3	158	-7.9	0	0	108.5
660	Q	27.7	Very low	27.1	Very low	155 Å²	155	138 Å²	138	72%	0.724	72%	0.716	S	S	*	*			trans	-50	147.2	177.8	-54.8	144.7	-70.5	0	0	114.6
661	Q	25.9	Very low	26.9	Very low	171 Å²	171	135 Å²	135	80%	0.799	71%	0.711	S	S	*	*				-178.3	146.7	104.8	-123.2	169	-63.3	0	0	116.8
662	Q	26.7	Very low	26.8	Very low	133 Å²	133	132.1 Å²	132.1	62%	0.621	71%	0.709	S	S	*	*			trans	85.4	114.9	135.3	-146.8	119.2	-22.1	0	0	125.1
663	Q	26.9	Very low	26.8	Very low	150 Å²	150	133.1 Å²	133.1	70%	0.701	71%	0.711	S	S	*	*			trans	68.7	120.1	134.9	-84.2	172.9	-35.1	0	0	126.7
664	H	26.1	Very low	27	Very low	153 Å²	153	133.4 Å²	133.4	71%	0.708	71%	0.706	S	S	*	*				69.8	126.9	128.2	-96.9	-115.2	0	0	0	124.7
665	L	27.5	Very low	27.1	Very low	143 Å²	143	134.9 Å²	134.9	75%	0.749	70%	0.704	S	S	*	*			trans	66.4	155	149.9	-62.4	165.3	0	0	0	116.7
666	T	25.9	Very low	27.1	Very low	109 Å²	109	138 Å²	138	67%	0.669	71%	0.706	S	S	*	*			cis	-156.8	163.7	9.9	-14.6	0	0	0	0	111.4
667	L	25.2	Very low	27.1	Very low	149 Å²	149	135 Å²	135	78%	0.78	70%	0.704	S	S	*	*			trans	61.4	138.2	167.1	-84	62.1	0	0	0	116.7
668	N	24	Very low	27.2	Very low	136 Å²	136	133.1 Å²	133.1	73%	0.727	71%	0.71	S	S	*	*			cis	97.5	144.2	22.8	-167.5	33.3	0	0	0	114.5
669	Q	27.7	Very low	27.2	Very low	165 Å²	165	135.1 Å²	135.1	77%	0.771	72%	0.719	S	S	*	*			trans	66.5	155	179.6	-72.5	175.1	-17.8	0	0	116.9
670	S	26.3	Very low	27.2	Very low	82 Å²	82	138 Å²	138	57%	0.573	73%	0.732	S	S	*	*			cis	-174.8	-176.6	-40.8	47.4	0	0	0	0	108
671	H	26.6	Very low	27.3	Very low	161 Å²	161	139.4 Å²	139.4	75%	0.745	74%	0.736	S	S	*	*			trans	72.8	124.2	-173.7	-53.5	-88.6	0	0	0	113.4
672	S	26.7	Very low	27.5	Very low	99 Å²	99	136.9 Å²	136.9	69%	0.692	73%	0.732	S	S	*	*			cis	77.5	149.7	15.3	102.2	0	0	0	0	116.8
673	S	27.6	Very low	27.5	Very low	105 Å²	105	136.8 Å²	136.8	73%	0.734	74%	0.736	S	S	*	*			trans	78.3	147.9	174.8	95.3	0	0	0	0	115.1
674	I	30.1	Very low	27.6	Very low	141 Å²	141	137.9 Å²	137.9	72%	0.723	74%	0.738	S	S	*	*			cis	-169	151.6	-13.6	-128.3	172.9	0	0	0	111.4
675	L	29.2	Very low	27.7	Very low	143 Å²	143	134.7 Å²	134.7	75%	0.749	74%	0.739	S	S	*	*			trans	57.3	170.8	160.6	-90.9	68.1	0	0	0	118.4
676	D	27.6	Very low	27.7	Very low	125 Å²	125	132.7 Å²	132.7	67%	0.668	74%	0.737	S	S	*	*			cis	-161.9	166	-39.1	-145.9	-49.2	0	0	0	108.6
677	S	28.9	Very low	27.8	Very low	104 Å²	104	136.5 Å²	136.5	73%	0.727	75%	0.747	S	S	*	*			trans	51	152.2	142.1	-76.7	0	0	0	0	122.3
678	A	29.5	Very low	27.9	Very low	88 Å²	88	137.1 Å²	137.1	73%	0.727	75%	0.746	S	S	*	*			cis	-160.3	-178.1	-6.3	0	0	0	0	0	111.1
679	H	29.6	Very low	28.2	Very low	185 Å²	185	135 Å²	135	86%	0.856	74%	0.742	S	S	*	*			trans	-41.4	150.2	179.8	-55.3	-75.1	0	0	0	119.2
680	Q	26.3	Very low	28.3	Very low	200 Å²	200	135.7 Å²	135.7	94%	0.935	74%	0.742	S	S	*	*				-145.8	-177.1	116.6	-133	165.1	-4.1	0	0	112.4
681	K	29.2	Very low	29	Very low	186 Å²	186	138.7 Å²	138.7	81%	0.809	75%	0.752	S	S	*	*			trans	-156	163.3	-152.7	-164.4	-172.9	-179.7	-176.3	0	111.9
682	V	29.6	Very low	30.1	Very low	118 Å²	118	137.1 Å²	137.1	72%	0.715	76%	0.756	S	S	*	*			trans	63.7	154.2	177	-113.5	0	0	0	0	113.9
683	D	27	Very low	30.9	Very low	130 Å²	130	140.9 Å²	140.9	70%	0.695	76%	0.759	S	S	*	*			cis	-152.1	172.3	8.7	-104.4	-55.9	0	0	0	106.8
684	K	29.3	Very low	31.7	Very low	173 Å²	173	143.7 Å²	143.7	75%	0.752	76%	0.761	S	S	*	*			cis	168.9	142.5	-26	161.5	-174	165.2	-165.4	0	109.9
685	A	28.1	Very low	32.1	Very low	87 Å²	87	148.7 Å²	148.7	72%	0.719	79%	0.787	S	S	*	*			trans	63.2	161.8	172.8	0	0	0	0	0	115.7
686	S	26.5	Very low	32.3	Very low	100 Å²	100	149 Å²	149	70%	0.699	79%	0.788	S	S	*	*			cis	-165.6	167.6	-21.8	-96	0	0	0	0	109.5
687	E	28.3	Very low	32.5	Very low	189 Å²	189	150.2 Å²	150.2	88%	0.883	80%	0.795	S	S	*	*			trans	66	160.7	167	-67.3	160.7	123.1	0	0	116.5
688	E	27.7	Very low	32.7	Very low	163 Å²	163	152.8 Å²	152.8	76%	0.762	80%	0.799	S	S	*	*			cis	-135.5	174.2	3	-155.9	-164.5	113.2	0	0	110.7	K690	E688-K690 IonicContact OE1-NZ 2.64Å; E688-K690 PolarHBondContact OE1-NZ 3.25Å
689	S	29.4	Very low	32.9	Very low	91 Å²	91	156.6 Å²	156.6	64%	0.636	80%	0.803	S	S	*	*			trans	-96.1	153.2	-177.4	175.9	0	0	0	0	114.2
690	K	31.4	Very low	33.1	Very low	179 Å²	179	154.8 Å²	154.8	78%	0.778	80%	0.799	S	S	*	*			trans	-166.3	120.1	144.2	-109.3	153.1	-164.4	117.6	0	114.9	E688	E688-K690 IonicContact OE1-NZ 2.64Å; E688-K690 PolarHBondContact OE1-NZ 3.25Å
691	D	39.9	Very low	33.6	Very low	146 Å²	146	151.8 Å²	151.8	78%	0.781	79%	0.79	S	S	*	*			trans	-70.5	163.6	154.3	-73.4	-64.6	0	0	0	111.6
692	P	50.7	Low	33.9	Very low	127 Å²	127	149.4 Å²	149.4	83%	0.825	79%	0.789	S	S	*	*				-131	138.6	129.4	35.3	-25.5	0	0	0	114.5
693	K	42.3	Very low	34.2	Very low	178 Å²	178	151.8 Å²	151.8	77%	0.774	80%	0.795	S	S	*	*			trans	-46	151.8	-179.5	-63.7	178.6	169.3	-167.2	0	118.6
694	E	44.7	Very low	34.8	Very low	165 Å²	165	153.6 Å²	153.6	77%	0.771	80%	0.803	S	S	*	*				21.8	122.7	129.4	-51.6	170.8	120.4	0	0	119.3
695	I	39.2	Very low	35.3	Very low	245 Å²	245	151.8 Å²	151.8	100%	1.256	81%	0.808	S	S	*	*				-143.6	0	114.3	-96.3	163	0	0	0	107.7

Retrieved 695 of 695 residues in 270 ms (Link to these results)

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