A0A096NH79_PAPAN Loading...

Protein disulfide-isomerase-like protein of the testis

Probable redox-inactive chaperone involved in spermatogenesis.

AlphaFold DB , UniProt , Accession A0A096NH79, Species PAPAN (Papio anubis, Olive baboon), Gene PDILT, Length 585 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	32.8	Very low	31	Very low	225 Å²	225	158.8 Å²	158.8	100%	1.108	82%	0.815	S	S	*	*				0	116.9	0	-64.1	168.4	173.1	0	0	108.7
2	D	33.2	Very low	30.4	Very low	130 Å²	130	153.2 Å²	153.2	70%	0.695	81%	0.81	S	S	*	*			cis	-163.7	144.5	-13	-95.4	-34.3	0	0	0	111.6
3	L	33.8	Very low	30.3	Very low	147 Å²	147	149.2 Å²	149.2	77%	0.77	81%	0.812	S	S	*	*			trans	56.1	161.8	157.6	-78.8	76.9	0	0	0	119.2
4	L	34.7	Very low	30	Very low	135 Å²	135	155.9 Å²	155.9	71%	0.707	82%	0.82	S	S	*	*			cis	-160.4	163.6	-42.2	-111.6	179	0	0	0	108
5	W	27	Very low	30	Very low	228 Å²	228	156.9 Å²	156.9	86%	0.864	82%	0.823	S	S	*	*			trans	70.7	137.9	157.4	-75.8	16.4	0	0	0	122
6	M	31.7	Very low	29.8	Very low	170 Å²	170	154.5 Å²	154.5	84%	0.837	82%	0.824	S	S	*	*			trans	-94.4	156.4	143.1	-90.7	-160.2	151.5	0	0	109.1
7	P	39.5	Very low	29.7	Very low	114 Å²	114	150.7 Å²	150.7	74%	0.74	82%	0.819	S	S	*	*				-145.8	178.4	102.1	37.8	-21.8	0	0	0	115.2
8	L	29.6	Very low	29.7	Very low	149 Å²	149	149.4 Å²	149.4	78%	0.78	82%	0.817	S	S	*	*			trans	-71.5	155.9	173.2	-71.7	65.3	0	0	0	112.2
9	L	25.6	Very low	29.6	Very low	161 Å²	161	151.3 Å²	151.3	84%	0.843	82%	0.818	S	S	*	*				-179.2	116.2	120.1	-96.3	163.5	0	0	0	114.3
10	L	26.6	Very low	29.5	Very low	153 Å²	153	149.2 Å²	149.2	80%	0.801	82%	0.816	S	S	*	*			trans	31.5	151.2	131.1	-97.1	164.2	0	0	0	124.5
11	V	26.3	Very low	29.2	Very low	135 Å²	135	147.3 Å²	147.3	82%	0.818	81%	0.813	S	S	*	*			trans	98.2	151	158.4	-172.7	0	0	0	0	118.3
12	A	24.3	Very low	29	Very low	91 Å²	91	142 Å²	142	75%	0.752	80%	0.796	S	S	*	*			trans	91.8	106.4	165.3	0	0	0	0	0	118.3
13	A	28.8	Very low	28.7	Very low	102 Å²	102	144.3 Å²	144.3	84%	0.843	80%	0.802	S	S	*	*			trans	-55.3	155.4	168.8	0	0	0	0	0	113.9
14	R	26.3	Very low	28.4	Very low	243 Å²	243	143.7 Å²	143.7	92%	0.917	81%	0.805	S	S	*	*			trans	-121.9	136.7	156.8	-78.5	-163.8	170.8	-149.3	-2.1	111.2	S16	R14-S16 PolarHBondContact O-N 3.5Å
15	I	29.2	Very low	28.1	Very low	170 Å²	170	144.2 Å²	144.2	87%	0.872	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-73.9	118.8	169.9	-62.4	162.5	0	0	0	107.3	A17	I15-A17 PolarHBondContact O-N 3.5Å
16	S	27.7	Very low	28.3	Very low	119 Å²	119	137.8 Å²	137.8	83%	0.832	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-77.8	116.2	166.6	-69.2	0	0	0	0	109	R14	R14-S16 PolarHBondContact O-N 3.5Å
17	A	27.2	Very low	28.3	Very low	90 Å²	90	132.8 Å²	132.8	74%	0.744	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-66	155.4	178.1	0	0	0	0	0	111.8	I15 H19	I15-A17 PolarHBondContact O-N 3.5Å; A17-H19 PolarHBondContact O-N 3.45Å
18	V	30.7	Very low	28.1	Very low	128 Å²	128	133.1 Å²	133.1	78%	0.776	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-60.1	128.4	177.7	175.4	0	0	0	0	110.5
19	H	27.5	Very low	28.6	Very low	184 Å²	184	130.7 Å²	130.7	85%	0.852	79%	0.791	S	S	*	*			trans	-122.8	108.6	152.9	-100.6	37.5	0	0	0	108.4	A17 S21	A17-H19 PolarHBondContact O-N 3.45Å; H19-S21 PolarHBondContact O-N 3.01Å; H19-S21 VanDerWaalsContact O-N 3.1Å
20	S	27.1	Very low	29.6	Very low	110 Å²	110	128 Å²	128	77%	0.769	79%	0.785	S	S	*	*			trans	-76.1	90.6	177.1	50.8	0	0	0	0	109.9
21	S	24.3	Very low	31.5	Very low	109 Å²	109	124 Å²	124	76%	0.762	76%	0.764	S	S	*	*			trans	-58.8	136.8	159.3	-69.4	0	0	0	0	108.9	H19	H19-S21 PolarHBondContact O-N 3.01Å; H19-S21 VanDerWaalsContact O-N 3.1Å
22	P	27.5	Very low	33.7	Very low	114 Å²	114	125.1 Å²	125.1	74%	0.74	76%	0.76	S	S	*	*			trans	-65.5	141.4	-172.6	26.5	-34.7	0	0	0	111.4	V24	P22-V24 PolarHBondContact O-N 3.15Å; P22-V24 VanDerWaalsContact O-N 3.08Å
23	E	27.2	Very low	36.4	Very low	178 Å²	178	122.5 Å²	122.5	83%	0.832	73%	0.733	S	S	*	*			trans	-58.4	115	166.5	-67.4	-177.5	121.1	0	0	108.8	N25	E23-N25 PolarHBondContact O-N 2.72Å
24	V	28.6	Very low	39.1	Very low	135 Å²	135	121.9 Å²	121.9	82%	0.818	72%	0.719	S	S	*	*			trans	-67.6	93.6	165.4	179.1	0	0	0	0	106.5	P22 A26	P22-V24 PolarHBondContact O-N 3.15Å; P22-V24 VanDerWaalsContact O-N 3.08Å; V24-A26 PolarHBondContact O-N 2.76Å
25	N	28.1	Very low	42.1	Very low	146 Å²	146	116.5 Å²	116.5	78%	0.781	70%	0.702	S	S	*	*			trans	-56.5	94.9	163.7	-99	-69.1	0	0	0	107.3	E23 G27	E23-N25 PolarHBondContact O-N 2.72Å; N25-G27 PolarHBondContact O-N 3.26Å
26	A	30.7	Very low	45	Very low	92 Å²	92	109.5 Å²	109.5	76%	0.76	67%	0.667	S	S	*	*			trans	-65.7	87.2	171.1	0	0	0	0	0	107.2	V24 V28	V24-A26 PolarHBondContact O-N 2.76Å; A26-V28 PolarHBondContact O-N 3.48Å
27	G	31	Very low	48	Very low	65 Å²	65	106.5 Å²	106.5	67%	0.67	64%	0.644	S	S	*	*			trans	-51.4	136.3	-175.3	0	0	0	0	0	110.2	N25 S29	N25-G27 PolarHBondContact O-N 3.26Å; G27-S29 PolarHBondContact O-N 3.01Å
28	V	36.1	Very low	51.2	Low	121 Å²	121	106.6 Å²	106.6	73%	0.733	63%	0.629	S	S	*	*			trans	-53.9	107.8	-176.2	178.9	0	0	0	0	108.8	A26 S30	A26-V28 PolarHBondContact O-N 3.48Å; V28-S30 PolarHBondContact O-N 3.21Å
29	S	39.3	Very low	54.2	Low	99 Å²	99	101.9 Å²	101.9	69%	0.692	60%	0.599	S	S	*	*			trans	-60.1	114.8	170.5	46.2	0	0	0	0	107.1	G27 I31	G27-S29 PolarHBondContact O-N 3.01Å; S29-I31 PolarHBondContact O-N 3.15Å
30	S	48.2	Very low	57.3	Low	103 Å²	103	97.9 Å²	97.9	72%	0.72	58%	0.584	S	S	*	*			trans	-59.4	112.7	-178.1	41.2	0	0	0	0	108.7	V28 H32	V28-S30 PolarHBondContact O-N 3.21Å; S30-H32 VanDerWaalsContact C-N 3.28Å; S30-H32 PolarHBondContact O-N 2.85Å
31	I	64.6	Low	60.5	Low	70 Å²	70	96.2 Å²	96.2	36%	0.359	56%	0.564	S	S	.	*			trans	-72.3	90	-175.4	-58.7	178.2	0	0	0	107.8	S29 I33 L298 Y356	S29-I31 PolarHBondContact O-N 3.15Å; I31-I33 VanDerWaalsContact C-N 3.29Å; I31-I33 HydrophobicContact CG2-CD1 4.48Å; I31-I33 HydrophobicContact CG2-CG1 4.04Å; I31-I33 PolarHBondContact O-N 3.28Å; I31-L298 HydrophobicContact CG2-CD1 3.68Å; I31-Y356 HydrophobicContact CD1-CD1 3.16Å; I31-Y356 HydrophobicContact CD1-CE1 3.36Å; I31-Y356 HydrophobicContact CD1-CG 3.88Å
32	H	72.4	Confident	63.9	Low	159 Å²	159	95 Å²	95	74%	0.736	55%	0.546	S	S	*	.			trans	-79.8	73.8	-168.2	-166.2	-66.4	0	0	0	111.5	S30 T34	S30-H32 VanDerWaalsContact C-N 3.28Å; S30-H32 PolarHBondContact O-N 2.85Å; H32-T34 PolarHBondContact O-N 3.33Å
33	I	82.4	Confident	67	Low	36 Å²	36	98.1 Å²	98.1	19%	0.185	54%	0.543	C	S	.	.	P	Polyproline II helix	trans	-70.3	119.7	174.5	-60.6	-162.5	0	0	0	109.6	I31 I291 Q294 H295 L298	I31-I33 VanDerWaalsContact C-N 3.29Å; I31-I33 HydrophobicContact CG2-CD1 4.48Å; I31-I33 HydrophobicContact CG2-CG1 4.04Å; I31-I33 PolarHBondContact O-N 3.28Å; I33-I291 HydrophobicContact CG2-CG2 4.18Å; I33-Q294 HydrophobicContact CD1-CB 3.81Å; I33-Q294 HydrophobicContact CG2-CB 4.22Å; I33-H295 HydrophobicContact CD1-CB 4.39Å; I33-H295 WeakPolarHBondContact CD1-CE1 3.37Å; I33-H295 WeakPolarHBondContact CD1-ND1 3.31Å; I33-L298 HydrophobicContact CD1-CD1 4.11Å
34	T	85.4	Confident	70.2	Confident	88 Å²	88	90.8 Å²	90.8	54%	0.54	51%	0.509	S	S	.	.	P	Polyproline II helix	trans	-82.6	143.4	170.3	49	0	0	0	0	110.2	H32 P36 Q294	H32-T34 PolarHBondContact O-N 3.33Å; T34-P36 WeakPolarHBondContact O-CD 3.47Å; T34-Q294 PolarHBondContact O-NE2 3.32Å
35	K	89.1	Confident	73.5	Confident	130 Å²	130	84.4 Å²	84.4	57%	0.565	47%	0.471	S	S	*	.	P	Polyproline II helix	trans	-65.5	119.5	171.4	-176.8	176.4	179.6	-177.8	0	108.2	E287 I291	K35-E287 IonicContact NZ-OE2 2.63Å; K35-E287 PolarHBondContact NZ-OE2 2.62Å; K35-I291 HydrophobicContact CB-CD1 4.16Å; K35-I291 HydrophobicContact CG-CD1 4.15Å
36	P	89.1	Confident	76.9	Confident	23 Å²	23	78.8 Å²	78.8	15%	0.149	44%	0.44	C	S	.	.	P	Polyproline II helix	trans	-75	165.9	177.7	32.3	-34.5	0	0	0	111	T34 H38	T34-P36 WeakPolarHBondContact O-CD 3.47Å; P36-H38 PolarHBondContact O-N 3.07Å
37	V	92.2	Very high	80	Confident	57 Å²	57	77.1 Å²	77.1	35%	0.345	42%	0.421	S	S	.	.	P	Polyproline II helix	trans	-59.3	127.1	166.3	-176	0	0	0	0	108.2	I39 A51 Q55	V37-I39 HydrophobicContact CG1-CG1 4.17Å; V37-A51 HydrophobicContact CG1-CB 4.44Å; V37-A51 HydrophobicContact CG2-CB 4.05Å; V37-Q55 PolarHBondContact O-NE2 2.91Å
38	H	93.2	Very high	83.3	Confident	92 Å²	92	74.1 Å²	74.1	43%	0.426	39%	0.389	S	S	.	.	P	Polyproline II helix	trans	-74.1	127.8	168.1	177.2	74.5	0	0	0	108.8	P36 S285	P36-H38 PolarHBondContact O-N 3.07Å; H38-S285 PolarHBondContact CE1-O 3.49Å; H38-S285 VanDerWaalsContact CE1-O 3.29Å
39	I	94	Very high	86.2	Confident	29 Å²	29	71.1 Å²	71.1	15%	0.149	37%	0.371	C	S	.	.			trans	-124.2	119.8	-175.7	-57.5	176.7	0	0	0	107.5	V37 L46 L48 M56	V37-I39 HydrophobicContact CG1-CG1 4.17Å; I39-L46 HydrophobicContact CG2-CB 3.88Å; I39-L46 HydrophobicContact CG2-CD2 3.95Å; I39-L46 HydrophobicContact CG2-CG 4.4Å; I39-L48 HydrophobicContact CD1-CD2 4.45Å; I39-L48 HydrophobicContact CG2-CD2 4.09Å; I39-M56 HydrophobicContact CD1-CG 3.83Å; I39-M56 HydrophobicContact CD1-SD 4.01Å
40	L	93.5	Very high	89	Confident	100 Å²	100	68.3 Å²	68.3	52%	0.524	35%	0.351	S	S	.	.			trans	-73.4	139.7	178	-175.3	65.2	0	0	0	110.7	L46 V47	L40-L46 CarbonylContact O-C 3.6Å; L40-L46 WeakPolarHBondContact O-CA 3.1Å; L40-V47 HydrophobicContact CB-CG2 4.43Å; L40-V47 PolarHBondContact O-N 2.68Å
41	E	94.4	Very high	91.3	Very high	75 Å²	75	65.9 Å²	65.9	35%	0.35	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	121.9	169.5	-165.9	-178.2	118.6	0	0	108.9	L46	E41-L46 HydrophobicContact CB-CD2 4.23Å; E41-L46 HydrophobicContact CG-CD2 4.42Å
42	E	94.4	Very high	92.9	Very high	82 Å²	82	62.5 Å²	62.5	38%	0.383	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	112.5	177.4	-168.3	-120.7	136.5	0	0	110.2	L45 V47 K100	E42-L45 PolarHBondContact N-O 3.29Å; E42-L45 PolarHBondContact O-N 3.3Å; E42-V47 HydrophobicContact CB-CG2 4.16Å; E42-K100 VanDerWaalsContact CD-NZ 3.29Å; E42-K100 PolarHBondContact O-NZ 2.8Å; E42-K100 IonicContact OE1-NZ 3.61Å; E42-K100 IonicContact OE2-NZ 3.41Å; E42-K100 PolarHBondContact OE2-NZ 2.84Å
43	R	93.1	Very high	94.1	Very high	180 Å²	180	55 Å²	55	68%	0.679	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.5	50.8	-172.6	-50	175.5	-166.1	-123.9	-6.9	112.5	L45	R43-L45 PolarHBondContact O-N 3.36Å; R43-L45 VanDerWaalsContact O-N 3.13Å
44	N	95.4	Very high	94.8	Very high	24 Å²	24	55.8 Å²	55.8	13%	0.128	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	63.2	10	-178.3	-42.8	-40.8	0	0	0	114.9	G83 V86 E87 K91	N44-G83 PolarHBondContact ND2-O 3.43Å; N44-V86 HydrophobicContact CB-CB 3.94Å; N44-V86 HydrophobicContact CB-CG1 4.1Å; N44-V86 HydrophobicContact CB-CG2 4.29Å; N44-V86 WeakPolarHBondContact O-CG2 3.5Å; N44-E87 WeakPolarHBondContact ND2-CG 3.47Å; N44-E87 PolarHBondContact ND2-OE1 3.48Å; N44-K91 WeakPolarHBondContact OD1-CE 3.12Å; N44-K91 PolarHBondContact OD1-NZ 2.92Å
45	L	97.9	Very high	95.4	Very high	1 Å²	1	53.1 Å²	53.1	1%	0.005	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	127.3	177.6	-61.7	-178.2	0	0	0	110.9	E42 R43 L66 A79 L82 V86 F98 K100	E42-L45 PolarHBondContact N-O 3.29Å; E42-L45 PolarHBondContact O-N 3.3Å; R43-L45 PolarHBondContact O-N 3.36Å; R43-L45 VanDerWaalsContact O-N 3.13Å; L45-L66 HydrophobicContact CD1-CD2 4.45Å; L45-A79 HydrophobicContact CD1-CB 4.11Å; L45-A79 WeakPolarHBondContact CD1-O 3.49Å; L45-L82 HydrophobicContact CD1-CB 4.39Å; L45-L82 HydrophobicContact CD1-CD2 4.31Å; L45-L82 HydrophobicContact CD2-CB 4.28Å; L45-L82 HydrophobicContact CD2-CD2 3.84Å; L45-L82 HydrophobicContact CD2-CG 3.84Å; L45-V86 HydrophobicContact CD2-CG2 3.99Å; L45-F98 HydrophobicContact CD2-CB 3.8Å; L45-K100 HydrophobicContact CB-CD 3.99Å; L45-K100 HydrophobicContact CB-CG 4.29Å; L45-K100 HydrophobicContact CD1-CB 4.49Å; L45-K100 HydrophobicContact CD1-CD 4.13Å
46	L	97.8	Very high	95.8	Very high	28 Å²	28	48.1 Å²	48.1	15%	0.147	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	131.8	174.3	-63.3	171.9	0	0	0	111.1	I39 L40 E41 L48 M56 F98 G99 K100	I39-L46 HydrophobicContact CG2-CB 3.88Å; I39-L46 HydrophobicContact CG2-CD2 3.95Å; I39-L46 HydrophobicContact CG2-CG 4.4Å; L40-L46 CarbonylContact O-C 3.6Å; L40-L46 WeakPolarHBondContact O-CA 3.1Å; E41-L46 HydrophobicContact CB-CD2 4.23Å; E41-L46 HydrophobicContact CG-CD2 4.42Å; L46-L48 HydrophobicContact CB-CD2 3.85Å; L46-L48 HydrophobicContact CB-CG 4.39Å; L46-L48 PolarHBondContact O-N 2.75Å; L46-M56 HydrophobicContact CD1-CE 3.55Å; L46-M56 HydrophobicContact CD1-CG 4.12Å; L46-M56 HydrophobicContact CD1-SD 3.88Å; L46-F98 WeakPolarHBondContact CB-O 3.47Å; L46-F98 WeakPolarHBondContact CG-O 3.4Å; L46-F98 PolarHBondContact N-O 2.92Å; L46-F98 VanDerWaalsContact N-O 3.1Å; L46-G99 CarbonylContact O-C 3.59Å; L46-G99 WeakPolarHBondContact O-CA 3.49Å; L46-K100 PolarHBondContact O-N 2.96Å
47	V	97.8	Very high	96.2	Very high	57 Å²	57	47.3 Å²	47.3	35%	0.345	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	103	176.2	-176.4	0	0	0	0	108.7	L40 E42	L40-V47 HydrophobicContact CB-CG2 4.43Å; L40-V47 PolarHBondContact O-N 2.68Å; E42-V47 HydrophobicContact CB-CG2 4.16Å
48	L	98.3	Very high	96.4	Very high	3 Å²	3	50.9 Å²	50.9	2%	0.016	26%	0.263	C	S	.	.			trans	-97.9	105.5	-169.9	-59.1	-176.1	0	0	0	112.2	I39 L46 L53 M56 V65 K100 V101	I39-L48 HydrophobicContact CD1-CD2 4.45Å; I39-L48 HydrophobicContact CG2-CD2 4.09Å; L46-L48 HydrophobicContact CB-CD2 3.85Å; L46-L48 HydrophobicContact CB-CG 4.39Å; L46-L48 PolarHBondContact O-N 2.75Å; L48-L53 HydrophobicContact CB-CB 4.27Å; L48-L53 HydrophobicContact CD1-CD1 4.01Å; L48-M56 HydrophobicContact CD2-CB 4.47Å; L48-M56 HydrophobicContact CD2-CG 3.78Å; L48-V65 HydrophobicContact CD1-CG1 4.29Å; L48-V65 HydrophobicContact CD1-CG2 4.14Å; L48-K100 PolarHBondContact N-O 3.44Å; L48-V101 HydrophobicContact CB-CG2 4.01Å
49	T	97.8	Very high	96.5	Very high	57 Å²	57	52.4 Å²	52.4	35%	0.35	27%	0.27	S	S	.	.			trans	-75.3	173.9	159.7	65.5	0	0	0	0	110.5	A51 G52 L53 E106	T49-A51 VanDerWaalsContact C-N 3.27Å; T49-A51 PolarHBondContact O-N 3.22Å; T49-G52 PolarHBondContact O-N 2.76Å; T49-G52 VanDerWaalsContact O-N 3.11Å; T49-G52 PolarHBondContact OG1-N 2.8Å; T49-L53 WeakPolarHBondContact O-CB 3.48Å; T49-L53 PolarHBondContact O-N 3.14Å; T49-E106 WeakPolarHBondContact CA-OE1 3.23Å
50	P	98	Very high	96.6	Very high	41 Å²	41	51.6 Å²	51.6	27%	0.266	27%	0.267	S	S	.	.	H	α-helix	trans	-60.1	-36.9	179.1	-24.3	35.6	0	0	0	112.7	T54 E106 L109	P50-T54 WeakPolarHBondContact O-CB 3.28Å; P50-T54 PolarHBondContact O-N 3.01Å; P50-T54 VanDerWaalsContact O-N 3.11Å; P50-T54 PolarHBondContact O-OG1 3.39Å; P50-E106 VanDerWaalsContact CD-OE2 3.29Å; P50-E106 WeakPolarHBondContact CD-OE2 3.39Å; P50-E106 WeakPolarHBondContact CG-OE2 3.49Å; P50-L109 HydrophobicContact CB-CD1 4.45Å; P50-L109 HydrophobicContact CB-CD2 4.15Å; P50-L109 HydrophobicContact CB-CG 4.49Å; P50-L109 HydrophobicContact CG-CD1 4.07Å; P50-L109 HydrophobicContact CG-CD2 4.28Å; P50-L109 HydrophobicContact CG-CG 4.11Å
51	A	97.1	Very high	96.8	Very high	51 Å²	51	48.3 Å²	48.3	42%	0.421	25%	0.248	S	C	.	.	H	α-helix	trans	-69.4	-44.3	174	0	0	0	0	0	111.8	V37 T49 T54 Q55	V37-A51 HydrophobicContact CG1-CB 4.44Å; V37-A51 HydrophobicContact CG2-CB 4.05Å; T49-A51 VanDerWaalsContact C-N 3.27Å; T49-A51 PolarHBondContact O-N 3.22Å; A51-T54 PolarHBondContact O-N 3.33Å; A51-Q55 PolarHBondContact O-N 3.31Å
52	G	97.1	Very high	97	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-63	-44	177.3	0	0	0	0	0	113	T49 Q55 M56	T49-G52 PolarHBondContact O-N 2.76Å; T49-G52 VanDerWaalsContact O-N 3.11Å; T49-G52 PolarHBondContact OG1-N 2.8Å; G52-Q55 PolarHBondContact O-N 3.29Å; G52-M56 WeakPolarHBondContact O-CG 3.37Å; G52-M56 PolarHBondContact O-N 3.1Å
53	L	98.3	Very high	97.2	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-59.7	-47.1	174	176.4	60.6	0	0	0	111.3	L48 T49 Q55 M56 L57 L63 V65 L109 F113	L48-L53 HydrophobicContact CB-CB 4.27Å; L48-L53 HydrophobicContact CD1-CD1 4.01Å; T49-L53 WeakPolarHBondContact O-CB 3.48Å; T49-L53 PolarHBondContact O-N 3.14Å; L53-Q55 VanDerWaalsContact C-N 3.33Å; L53-Q55 PolarHBondContact O-N 2.74Å; L53-M56 PolarHBondContact O-N 3.29Å; L53-L57 HydrophobicContact CD1-CD1 4.08Å; L53-L57 HydrophobicContact CD1-CG 4.08Å; L53-L57 HydrophobicContact CG-CD1 3.96Å; L53-L57 HydrophobicContact CG-CG 4.41Å; L53-L57 WeakPolarHBondContact O-CB 3.29Å; L53-L57 VanDerWaalsContact O-CG 3.29Å; L53-L57 WeakPolarHBondContact O-CG 3.45Å; L53-L57 PolarHBondContact O-N 3.42Å; L53-L63 HydrophobicContact CD1-CD2 4.07Å; L53-V65 HydrophobicContact CD1-CG2 3.87Å; L53-L109 HydrophobicContact CD2-CD1 4.09Å; L53-L109 HydrophobicContact CD2-CD2 4.13Å; L53-F113 HydrophobicContact CD2-CE2 3.69Å; L53-F113 HydrophobicContact CD2-CZ 4.07Å
54	T	97.9	Very high	97.5	Very high	54 Å²	54	32.5 Å²	32.5	33%	0.331	18%	0.181	S	C	.	.	H	α-helix	trans	-62.3	-41.2	179.3	-54.3	0	0	0	0	111.5	P50 A51 N58 R129	P50-T54 WeakPolarHBondContact O-CB 3.28Å; P50-T54 PolarHBondContact O-N 3.01Å; P50-T54 VanDerWaalsContact O-N 3.11Å; P50-T54 PolarHBondContact O-OG1 3.39Å; A51-T54 PolarHBondContact O-N 3.33Å; T54-N58 VanDerWaalsContact O-CG 3.26Å; T54-N58 PolarHBondContact O-N 3.05Å; T54-N58 PolarHBondContact O-ND2 2.87Å; T54-R129 PolarHBondContact OG1-NH1 3.45Å
55	Q	96.8	Very high	97.7	Very high	31 Å²	31	31.3 Å²	31.3	15%	0.145	18%	0.175	C	C	.	.	H	α-helix	trans	-62.1	-47	173.3	-179.1	169.6	-79.3	0	0	112.2	V37 A51 G52 L53 N58 Q59	V37-Q55 PolarHBondContact O-NE2 2.91Å; A51-Q55 PolarHBondContact O-N 3.31Å; G52-Q55 PolarHBondContact O-N 3.29Å; L53-Q55 VanDerWaalsContact C-N 3.33Å; L53-Q55 PolarHBondContact O-N 2.74Å; Q55-N58 PolarHBondContact O-N 3.39Å; Q55-Q59 WeakPolarHBondContact O-CB 3.36Å; Q55-Q59 VanDerWaalsContact O-CG 3.31Å; Q55-Q59 WeakPolarHBondContact O-CG 3.22Å; Q55-Q59 PolarHBondContact O-N 3.21Å
56	M	97.6	Very high	97.7	Very high	26 Å²	26	31.3 Å²	31.3	13%	0.128	18%	0.175	C	C	.	.	H	α-helix	trans	-67.7	-36.8	-178.7	-70.8	-48.6	-63.7	0	0	112.6	I39 L46 L48 G52 L53 N58 Q59 T60 L63	I39-M56 HydrophobicContact CD1-CG 3.83Å; I39-M56 HydrophobicContact CD1-SD 4.01Å; L46-M56 HydrophobicContact CD1-CE 3.55Å; L46-M56 HydrophobicContact CD1-CG 4.12Å; L46-M56 HydrophobicContact CD1-SD 3.88Å; L48-M56 HydrophobicContact CD2-CB 4.47Å; L48-M56 HydrophobicContact CD2-CG 3.78Å; G52-M56 WeakPolarHBondContact O-CG 3.37Å; G52-M56 PolarHBondContact O-N 3.1Å; L53-M56 PolarHBondContact O-N 3.29Å; M56-N58 VanDerWaalsContact C-N 3.31Å; M56-N58 PolarHBondContact O-N 3.33Å; M56-Q59 PolarHBondContact O-N 3.01Å; M56-T60 VanDerWaalsContact CE-OG1 3.24Å; M56-T60 WeakPolarHBondContact CE-OG1 3.4Å; M56-T60 WeakPolarHBondContact O-CB 3.34Å; M56-T60 PolarHBondContact O-N 2.85Å; M56-T60 PolarHBondContact O-OG1 2.89Å; M56-L63 HydrophobicContact CB-CD1 3.98Å; M56-L63 HydrophobicContact CB-CD2 3.74Å; M56-L63 HydrophobicContact CE-CD1 4.47Å
57	L	98	Very high	97.7	Very high	6 Å²	6	30 Å²	30	3%	0.031	17%	0.168	C	C	.	.	H	α-helix	trans	-59.5	-41.3	173	-74.4	169	0	0	0	111.9	L53 Q59 L63 F124 G127 R129	L53-L57 HydrophobicContact CD1-CD1 4.08Å; L53-L57 HydrophobicContact CD1-CG 4.08Å; L53-L57 HydrophobicContact CG-CD1 3.96Å; L53-L57 HydrophobicContact CG-CG 4.41Å; L53-L57 WeakPolarHBondContact O-CB 3.29Å; L53-L57 VanDerWaalsContact O-CG 3.29Å; L53-L57 WeakPolarHBondContact O-CG 3.45Å; L53-L57 PolarHBondContact O-N 3.42Å; L57-Q59 VanDerWaalsContact C-N 3.28Å; L57-Q59 PolarHBondContact O-N 2.78Å; L57-L63 HydrophobicContact CD2-CD2 3.92Å; L57-L63 HydrophobicContact CG-CD2 4.06Å; L57-F124 HydrophobicContact CD2-CB 3.48Å; L57-F124 VanDerWaalsContact CD2-CB 3.48Å; L57-F124 HydrophobicContact CD2-CD1 3.56Å; L57-F124 HydrophobicContact CD2-CD2 4.35Å; L57-F124 HydrophobicContact CD2-CE1 4.34Å; L57-F124 HydrophobicContact CD2-CG 3.56Å; L57-G127 VanDerWaalsContact O-CA 3.28Å; L57-G127 WeakPolarHBondContact O-CA 3.27Å; L57-R129 HydrophobicContact CD1-CB 4.18Å; L57-R129 HydrophobicContact CD1-CG 3.93Å
58	N	96.4	Very high	97.7	Very high	132 Å²	132	28.1 Å²	28.1	71%	0.706	16%	0.156	S	C	*	.	H	α-helix	trans	-74.4	-15.5	179.3	-67.4	-11.4	0	0	0	113.8	T54 Q55 M56	T54-N58 VanDerWaalsContact O-CG 3.26Å; T54-N58 PolarHBondContact O-N 3.05Å; T54-N58 PolarHBondContact O-ND2 2.87Å; Q55-N58 PolarHBondContact O-N 3.39Å; M56-N58 VanDerWaalsContact C-N 3.31Å; M56-N58 PolarHBondContact O-N 3.33Å
59	Q	94.7	Very high	97.7	Very high	123 Å²	123	28.8 Å²	28.8	58%	0.575	16%	0.161	S	C	*	.	H	α-helix	trans	-115.3	-10.2	-173.4	-67.3	-179.3	6.9	0	0	114.3	Q55 M56 L57	Q55-Q59 WeakPolarHBondContact O-CB 3.36Å; Q55-Q59 VanDerWaalsContact O-CG 3.31Å; Q55-Q59 WeakPolarHBondContact O-CG 3.22Å; Q55-Q59 PolarHBondContact O-N 3.21Å; M56-Q59 PolarHBondContact O-N 3.01Å; L57-Q59 VanDerWaalsContact C-N 3.28Å; L57-Q59 PolarHBondContact O-N 2.78Å
60	T	97.3	Very high	97.4	Very high	13 Å²	13	28.7 Å²	28.7	8%	0.08	16%	0.161	C	C	.	.			trans	-124.1	130	-170.5	-43.8	0	0	0	0	110.8	M56 L63 I96	M56-T60 VanDerWaalsContact CE-OG1 3.24Å; M56-T60 WeakPolarHBondContact CE-OG1 3.4Å; M56-T60 WeakPolarHBondContact O-CB 3.34Å; M56-T60 PolarHBondContact O-N 2.85Å; M56-T60 PolarHBondContact O-OG1 2.89Å; T60-L63 HydrophobicContact CG2-CB 4.02Å; T60-L63 HydrophobicContact CG2-CD1 4.2Å; T60-I96 VanDerWaalsContact CG2-C 3.47Å
61	R	97.7	Very high	97.1	Very high	31 Å²	31	31.3 Å²	31.3	12%	0.117	18%	0.18	C	C	.	.	S	Bend	trans	-78.9	-32.5	-178.2	-173.8	156.4	-179.3	-99.5	-6	112.8	G95 F125 E126 P199 L201	R61-G95 CarbonylContact C-O 3.55Å; R61-G95 WeakPolarHBondContact CA-O 3.44Å; R61-G95 WeakPolarHBondContact CB-O 3.16Å; R61-G95 PolarHBondContact N-O 2.91Å; R61-F125 HydrophobicContact CG-CE2 4.31Å; R61-F125 WeakPolarHBondContact O-CA 3.4Å; R61-F125 WeakPolarHBondContact O-CD2 3.46Å; R61-E126 HydrophobicContact CG-CG 3.78Å; R61-E126 IonicContact CZ-OE1 3.13Å; R61-E126 IonicContact NE-OE1 2.64Å; R61-E126 PolarHBondContact NE-OE1 2.88Å; R61-E126 IonicContact NH2-OE1 2.66Å; R61-E126 PolarHBondContact NH2-OE1 2.88Å; R61-E126 VanDerWaalsContact NH2-OE1 3.12Å; R61-E126 PolarHBondContact O-N 3.42Å; R61-P199 WeakPolarHBondContact CD-O 3.45Å; R61-P199 PolarHBondContact NH1-O 3.31Å; R61-L201 PolarHBondContact NH1-O 3.01Å
62	F	98.6	Very high	97	Very high	2 Å²	2	30.5 Å²	30.5	1%	0.009	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	91.5	176.6	-67.3	-88	0	0	0	109.6	G95 I96 G97 L123 F124 F125 I152 K155 P199	F62-G95 PolarHBondContact N-O 2.94Å; F62-I96 HydrophobicContact CB-CG2 4.04Å; F62-I96 WeakPolarHBondContact O-CA 3.43Å; F62-G97 PolarHBondContact O-N 2.95Å; F62-L123 HydrophobicContact CB-CD1 4.03Å; F62-L123 HydrophobicContact CD1-CD1 4.35Å; F62-L123 HydrophobicContact CD1-CD2 4.45Å; F62-F124 WeakPolarHBondContact CA-O 3.19Å; F62-F125 AromaticContact CD1-CD2 3.92Å; F62-F125 HydrophobicContact CD1-CD2 3.92Å; F62-F125 AromaticContact CE1-CD2 3.54Å; F62-F125 HydrophobicContact CE1-CD2 3.54Å; F62-F125 AromaticContact CE1-CE2 3.8Å; F62-F125 HydrophobicContact CE1-CE2 3.8Å; F62-F125 HydrophobicContact CE2-CD2 4.45Å; F62-F125 HydrophobicContact CE2-CE2 4.2Å; F62-F125 AromaticContact CZ-CD2 3.85Å; F62-F125 HydrophobicContact CZ-CD2 3.85Å; F62-F125 AromaticContact CZ-CE2 3.62Å; F62-F125 HydrophobicContact CZ-CE2 3.62Å; F62-I152 HydrophobicContact CD1-CG1 3.94Å; F62-I152 HydrophobicContact CD2-CG1 4.15Å; F62-I152 HydrophobicContact CE1-CB 4.28Å; F62-I152 HydrophobicContact CE1-CG1 3.85Å; F62-I152 HydrophobicContact CE2-CG1 4.06Å; F62-I152 HydrophobicContact CE2-CG2 4.25Å; F62-I152 HydrophobicContact CG-CG1 4.09Å; F62-I152 HydrophobicContact CZ-CB 4.11Å; F62-I152 HydrophobicContact CZ-CG1 3.92Å; F62-I152 HydrophobicContact CZ-CG2 4.12Å; F62-K155 HydrophobicContact CE1-CB 3.91Å; F62-K155 HydrophobicContact CE1-CG 3.93Å; F62-K155 HydrophobicContact CZ-CB 3.89Å; F62-K155 HydrophobicContact CZ-CG 4.42Å; F62-P199 HydrophobicContact CD2-CB 3.63Å; F62-P199 HydrophobicContact CE2-CB 3.77Å; F62-P199 WeakPolarHBondContact CE2-O 3.28Å
63	L	98.8	Very high	97	Very high	1 Å²	1	37.8 Å²	37.8	1%	0.005	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	113.7	-178	-177	68.3	0	0	0	110.7	L53 M56 L57 T60 V65 L123 F124	L53-L63 HydrophobicContact CD1-CD2 4.07Å; M56-L63 HydrophobicContact CB-CD1 3.98Å; M56-L63 HydrophobicContact CB-CD2 3.74Å; M56-L63 HydrophobicContact CE-CD1 4.47Å; L57-L63 HydrophobicContact CD2-CD2 3.92Å; L57-L63 HydrophobicContact CG-CD2 4.06Å; T60-L63 HydrophobicContact CG2-CB 4.02Å; T60-L63 HydrophobicContact CG2-CD1 4.2Å; L63-V65 HydrophobicContact CD2-CG2 3.83Å; L63-V65 HydrophobicContact CG-CG2 3.79Å; L63-L123 WeakPolarHBondContact O-CA 3.45Å; L63-F124 HydrophobicContact CB-CB 4.36Å; L63-F124 PolarHBondContact N-O 2.73Å; L63-F124 PolarHBondContact O-N 2.95Å
64	M	98.6	Very high	96.9	Very high	1 Å²	1	43.9 Å²	43.9	1%	0.005	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	121.6	169.9	-68.7	-163.4	72.9	0	0	110.7	L82 G97 F98 G99 L121 K122 L123 W147 L148	M64-L82 HydrophobicContact CE-CD1 4.34Å; M64-G97 PolarHBondContact N-O 2.88Å; M64-F98 HydrophobicContact CB-CD1 3.82Å; M64-F98 HydrophobicContact CB-CE1 4.19Å; M64-F98 HydrophobicContact CG-CD1 4.38Å; M64-F98 HydrophobicContact CG-CE1 4.24Å; M64-F98 WeakPolarHBondContact O-CA 3.48Å; M64-F98 HydrophobicContact SD-CD1 4.37Å; M64-F98 HydrophobicContact SD-CE1 3.83Å; M64-G99 PolarHBondContact O-N 2.8Å; M64-L121 HydrophobicContact CB-CD1 4.49Å; M64-L121 HydrophobicContact CE-CD1 3.92Å; M64-L121 HydrophobicContact CE-CD2 3.62Å; M64-L121 HydrophobicContact CE-CG 3.65Å; M64-K122 CarbonylContact C-O 3.45Å; M64-K122 WeakPolarHBondContact CA-O 3.42Å; M64-L123 HydrophobicContact CG-CB 4.48Å; M64-L123 HydrophobicContact CG-CD1 3.9Å; M64-W147 HydrophobicContact CE-CE3 3.95Å; M64-W147 HydrophobicContact CE-CZ3 3.66Å; M64-W147 HydrophobicContact SD-CE3 4.48Å; M64-W147 HydrophobicContact SD-CZ3 4.26Å; M64-L148 HydrophobicContact CG-CD1 4.2Å; M64-L148 HydrophobicContact CG-CD2 4.34Å; M64-L148 HydrophobicContact SD-CB 4.06Å; M64-L148 HydrophobicContact SD-CD1 4.01Å; M64-L148 HydrophobicContact SD-CD2 3.8Å; M64-L148 HydrophobicContact SD-CG 4.16Å
65	V	98.8	Very high	96.8	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	121.6	-179.5	-173.3	0	0	0	0	110.2	L48 L53 L63 F67 G99 V101 K122 F124	L48-V65 HydrophobicContact CD1-CG1 4.29Å; L48-V65 HydrophobicContact CD1-CG2 4.14Å; L53-V65 HydrophobicContact CD1-CG2 3.87Å; L63-V65 HydrophobicContact CD2-CG2 3.83Å; L63-V65 HydrophobicContact CG-CG2 3.79Å; V65-F67 HydrophobicContact CB-CE2 3.97Å; V65-F67 HydrophobicContact CB-CZ 4.39Å; V65-F67 HydrophobicContact CG1-CD2 4.16Å; V65-F67 HydrophobicContact CG1-CE1 4.31Å; V65-F67 HydrophobicContact CG1-CE2 3.64Å; V65-F67 HydrophobicContact CG1-CZ 3.73Å; V65-G99 WeakPolarHBondContact CA-O 3.41Å; V65-V101 HydrophobicContact CG1-CG2 3.64Å; V65-K122 PolarHBondContact N-O 3.1Å; V65-K122 PolarHBondContact O-N 3.32Å; V65-F124 HydrophobicContact CB-CD2 4.33Å; V65-F124 HydrophobicContact CB-CE2 3.9Å; V65-F124 HydrophobicContact CG2-CD2 3.75Å; V65-F124 HydrophobicContact CG2-CE2 3.68Å
66	L	98.7	Very high	96.8	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	104.8	176.8	177.7	55.8	0	0	0	110.5	L45 H68 L78 A79 L82 G99 K100 V101 P119 L121	L45-L66 HydrophobicContact CD1-CD2 4.45Å; L66-H68 HydrophobicContact CG-CB 4.12Å; L66-H68 PolarHBondContact O-N 3.18Å; L66-L78 HydrophobicContact CD1-CD2 3.78Å; L66-L78 HydrophobicContact CD1-CG 4.03Å; L66-L78 HydrophobicContact CD2-CG 4.47Å; L66-A79 VanDerWaalsContact CD2-CA 3.42Å; L66-A79 HydrophobicContact CD2-CB 3.71Å; L66-L82 HydrophobicContact CB-CD2 3.83Å; L66-L82 HydrophobicContact CD2-CD2 4.14Å; L66-G99 PolarHBondContact N-O 3.43Å; L66-K100 HydrophobicContact CB-CB 4.28Å; L66-K100 CarbonylContact O-C 3.59Å; L66-K100 VanDerWaalsContact O-CA 3.25Å; L66-K100 WeakPolarHBondContact O-CA 3.43Å; L66-V101 PolarHBondContact O-N 2.79Å; L66-P119 HydrophobicContact CD1-CB 3.92Å; L66-L121 HydrophobicContact CB-CD1 4Å; L66-L121 HydrophobicContact CD1-CB 4.42Å; L66-L121 HydrophobicContact CD1-CD1 4.44Å
67	F	98.5	Very high	96.8	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	112.3	172.4	-63.8	-89.1	0	0	0	109	V65 V101 I103 F113 I115 P119 Q120 K122 F124	V65-F67 HydrophobicContact CB-CE2 3.97Å; V65-F67 HydrophobicContact CB-CZ 4.39Å; V65-F67 HydrophobicContact CG1-CD2 4.16Å; V65-F67 HydrophobicContact CG1-CE1 4.31Å; V65-F67 HydrophobicContact CG1-CE2 3.64Å; V65-F67 HydrophobicContact CG1-CZ 3.73Å; F67-V101 HydrophobicContact CD1-CB 3.75Å; F67-V101 HydrophobicContact CD1-CG1 3.91Å; F67-V101 HydrophobicContact CD1-CG2 4.18Å; F67-V101 HydrophobicContact CE1-CB 3.97Å; F67-V101 HydrophobicContact CE1-CG1 4.08Å; F67-V101 HydrophobicContact CE1-CG2 3.89Å; F67-V101 HydrophobicContact CZ-CG2 4.47Å; F67-I103 HydrophobicContact CB-CG2 3.97Å; F67-I103 HydrophobicContact CD1-CG2 4.12Å; F67-F113 HydrophobicContact CE1-CB 4.31Å; F67-F113 AromaticContact CE1-CD2 3.43Å; F67-F113 HydrophobicContact CE1-CD2 3.43Å; F67-F113 VanDerWaalsContact CE1-CD2 3.43Å; F67-F113 HydrophobicContact CE1-CE2 4.1Å; F67-F113 HydrophobicContact CE1-CG 4.14Å; F67-F113 HydrophobicContact CE2-CD2 4.43Å; F67-F113 HydrophobicContact CZ-CB 4.16Å; F67-F113 AromaticContact CZ-CD2 3.34Å; F67-F113 HydrophobicContact CZ-CD2 3.34Å; F67-F113 AromaticContact CZ-CE2 3.86Å; F67-F113 HydrophobicContact CZ-CE2 3.86Å; F67-F113 AromaticContact CZ-CG 3.79Å; F67-F113 HydrophobicContact CZ-CG 3.79Å; F67-I115 HydrophobicContact CB-CD1 3.97Å; F67-I115 HydrophobicContact CB-CG1 3.99Å; F67-I115 HydrophobicContact CB-CG2 3.99Å; F67-I115 HydrophobicContact CD1-CD1 4.22Å; F67-I115 HydrophobicContact CD1-CG1 3.91Å; F67-I115 HydrophobicContact CD2-CD1 3.95Å; F67-I115 HydrophobicContact CG-CD1 3.77Å; F67-I115 HydrophobicContact CG-CG1 3.88Å; F67-P119 CarbonylContact O-C 3.5Å; F67-P119 VanDerWaalsContact O-CA 3.3Å; F67-P119 WeakPolarHBondContact O-CA 3.37Å; F67-Q120 PolarHBondContact N-O 3.01Å; F67-Q120 PolarHBondContact O-N 3.12Å; F67-K122 HydrophobicContact CD2-CD 4.29Å; F67-K122 HydrophobicContact CE2-CB 4.18Å; F67-K122 HydrophobicContact CE2-CD 3.98Å; F67-K122 HydrophobicContact CE2-CG 4.42Å; F67-F124 HydrophobicContact CE2-CE2 4.32Å; F67-F124 HydrophobicContact CE2-CZ 4.47Å; F67-F124 HydrophobicContact CZ-CZ 4.4Å
68	H	97.7	Very high	96.8	Very high	18 Å²	18	50.1 Å²	50.1	8%	0.083	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	167.5	-164.9	87.5	-41.5	0	0	0	113.2	L66 V101 D102 I103	L66-H68 HydrophobicContact CG-CB 4.12Å; L66-H68 PolarHBondContact O-N 3.18Å; H68-V101 PolarHBondContact N-O 3.32Å; H68-V101 PolarHBondContact ND1-O 2.84Å; H68-D102 WeakPolarHBondContact O-CA 3.24Å; H68-I103 WeakPolarHBondContact O-CG1 3.49Å; H68-I103 PolarHBondContact O-N 3.49Å
69	S	96.7	Very high	96.9	Very high	18 Å²	18	44.4 Å²	44.4	13%	0.126	23%	0.225	C	C	.	.			trans	-129.4	118.4	171.8	174	0	0	0	0	109.2	S71 S72 S75 T104	S69-S71 VanDerWaalsContact C-N 3.25Å; S69-S71 PolarHBondContact O-N 2.8Å; S69-S71 VanDerWaalsContact O-N 3.14Å; S69-S71 PolarHBondContact OG-OG 2.84Å; S69-S72 WeakPolarHBondContact O-CB 3.44Å; S69-S72 PolarHBondContact O-N 2.89Å; S69-S75 PolarHBondContact N-OG 3.24Å; S69-S75 VanDerWaalsContact N-OG 3.13Å; S69-S75 WeakPolarHBondContact O-CB 3.45Å; S69-S75 PolarHBondContact O-OG 3.38Å; S69-T104 WeakPolarHBondContact OG-CG2 3.06Å
70	P	92.5	Very high	97	Very high	55 Å²	55	43.2 Å²	43.2	36%	0.357	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-29.6	-171.9	-30	35.9	0	0	0	115.5	S72 R76 D102	P70-S72 VanDerWaalsContact C-N 3.33Å; P70-S72 PolarHBondContact O-N 2.9Å; P70-R76 WeakPolarHBondContact O-CD 3.35Å; P70-R76 WeakPolarHBondContact O-CG 3.24Å; P70-R76 PolarHBondContact O-NE 3.15Å; P70-D102 VanDerWaalsContact CD-OD1 3.25Å; P70-D102 WeakPolarHBondContact CD-OD1 3.28Å; P70-D102 WeakPolarHBondContact CD-OD2 3.21Å; P70-D102 WeakPolarHBondContact CG-OD2 3.43Å
71	S	91.4	Very high	97.1	Very high	95 Å²	95	44.4 Å²	44.4	66%	0.664	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.2	-33.1	177.1	58	0	0	0	0	112.5	S69 K73 R76	S69-S71 VanDerWaalsContact C-N 3.25Å; S69-S71 PolarHBondContact O-N 2.8Å; S69-S71 VanDerWaalsContact O-N 3.14Å; S69-S71 PolarHBondContact OG-OG 2.84Å; S71-K73 PolarHBondContact O-N 2.9Å; S71-R76 PolarHBondContact O-NH2 2.97Å
72	S	95.8	Very high	97.1	Very high	35 Å²	35	42.9 Å²	42.9	25%	0.245	22%	0.218	C	C	.	.			trans	-69.7	124	-178.3	173.1	0	0	0	0	112.2	S69 P70 Q74 S75 R76	S69-S72 WeakPolarHBondContact O-CB 3.44Å; S69-S72 PolarHBondContact O-N 2.89Å; P70-S72 VanDerWaalsContact C-N 3.33Å; P70-S72 PolarHBondContact O-N 2.9Å; S72-Q74 VanDerWaalsContact C-N 3.3Å; S72-Q74 PolarHBondContact O-N 2.94Å; S72-Q74 PolarHBondContact OG-N 2.86Å; S72-S75 WeakPolarHBondContact O-CB 3.47Å; S72-S75 PolarHBondContact O-N 3.23Å; S72-S75 VanDerWaalsContact O-N 3.16Å; S72-S75 PolarHBondContact OG-N 3.04Å; S72-R76 PolarHBondContact O-N 2.9Å
73	K	96.1	Very high	97.1	Very high	153 Å²	153	43 Å²	43	67%	0.665	22%	0.22	S	C	*	.	H	α-helix	trans	-58	-42	174.2	-174.6	175.3	-179.6	177.9	0	111.7	S71 S75 R76 N77	S71-K73 PolarHBondContact O-N 2.9Å; K73-S75 VanDerWaalsContact C-N 3.31Å; K73-S75 PolarHBondContact O-N 3.09Å; K73-R76 PolarHBondContact O-N 3.28Å; K73-N77 WeakPolarHBondContact CG-OD1 3.31Å; K73-N77 WeakPolarHBondContact O-CB 3.41Å; K73-N77 PolarHBondContact O-N 3.29Å; K73-N77 PolarHBondContact O-OD1 3.14Å
74	Q	95.7	Very high	97	Very high	127 Å²	127	46.4 Å²	46.4	59%	0.593	24%	0.235	S	C	*	.	H	α-helix	trans	-63.2	-37.4	177.8	-69.5	-179.3	-18.3	0	0	112.1	S72 L78 P119	S72-Q74 VanDerWaalsContact C-N 3.3Å; S72-Q74 PolarHBondContact O-N 2.94Å; S72-Q74 PolarHBondContact OG-N 2.86Å; Q74-L78 PolarHBondContact O-N 3.46Å; Q74-L78 VanDerWaalsContact O-N 3.13Å; Q74-P119 HydrophobicContact CB-CG 4.46Å
75	S	96.9	Very high	97	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-65.8	-45	174.4	-75.2	0	0	0	0	112.6	S69 S72 K73 L78 A79	S69-S75 PolarHBondContact N-OG 3.24Å; S69-S75 VanDerWaalsContact N-OG 3.13Å; S69-S75 WeakPolarHBondContact O-CB 3.45Å; S69-S75 PolarHBondContact O-OG 3.38Å; S72-S75 WeakPolarHBondContact O-CB 3.47Å; S72-S75 PolarHBondContact O-N 3.23Å; S72-S75 VanDerWaalsContact O-N 3.16Å; S72-S75 PolarHBondContact OG-N 3.04Å; K73-S75 VanDerWaalsContact C-N 3.31Å; K73-S75 PolarHBondContact O-N 3.09Å; S75-L78 PolarHBondContact O-N 3.48Å; S75-A79 WeakPolarHBondContact O-CB 3.48Å; S75-A79 PolarHBondContact O-N 2.99Å
76	R	96.6	Very high	97	Very high	146 Å²	146	47 Å²	47	55%	0.551	24%	0.239	S	C	*	.	H	α-helix	trans	-64.7	-45.3	177.8	-76	-173.7	-80.6	153.2	-6.7	112.6	P70 S71 S72 K73 L78 A79 E80	P70-R76 WeakPolarHBondContact O-CD 3.35Å; P70-R76 WeakPolarHBondContact O-CG 3.24Å; P70-R76 PolarHBondContact O-NE 3.15Å; S71-R76 PolarHBondContact O-NH2 2.97Å; S72-R76 PolarHBondContact O-N 2.9Å; K73-R76 PolarHBondContact O-N 3.28Å; R76-L78 PolarHBondContact O-N 2.67Å; R76-A79 PolarHBondContact O-N 3.08Å; R76-E80 PolarHBondContact O-N 2.87Å
77	N	97.4	Very high	96.8	Very high	88 Å²	88	50.5 Å²	50.5	47%	0.471	26%	0.255	S	S	.	.	H	α-helix	trans	-57.7	-46.3	175.7	-80	58.1	0	0	0	112	K73 E80 E81	K73-N77 WeakPolarHBondContact CG-OD1 3.31Å; K73-N77 WeakPolarHBondContact O-CB 3.41Å; K73-N77 PolarHBondContact O-N 3.29Å; K73-N77 PolarHBondContact O-OD1 3.14Å; N77-E80 PolarHBondContact O-N 2.84Å; N77-E81 PolarHBondContact O-N 3.17Å; N77-E81 VanDerWaalsContact O-N 3.08Å
78	L	97.7	Very high	96.7	Very high	14 Å²	14	54.7 Å²	54.7	7%	0.073	28%	0.277	C	S	.	.	H	α-helix	trans	-71.2	-30.4	179.9	-172.8	56.5	0	0	0	112.8	L66 Q74 S75 R76 E80 L82 P119 L121 V139 L144	L66-L78 HydrophobicContact CD1-CD2 3.78Å; L66-L78 HydrophobicContact CD1-CG 4.03Å; L66-L78 HydrophobicContact CD2-CG 4.47Å; Q74-L78 PolarHBondContact O-N 3.46Å; Q74-L78 VanDerWaalsContact O-N 3.13Å; S75-L78 PolarHBondContact O-N 3.48Å; R76-L78 PolarHBondContact O-N 2.67Å; L78-E80 VanDerWaalsContact C-N 3.35Å; L78-L82 VanDerWaalsContact O-CB 3.27Å; L78-L82 WeakPolarHBondContact O-CB 3.48Å; L78-L82 PolarHBondContact O-N 3.1Å; L78-P119 HydrophobicContact CB-CG 4.33Å; L78-P119 HydrophobicContact CD2-CB 4.01Å; L78-P119 HydrophobicContact CD2-CG 3.86Å; L78-L121 HydrophobicContact CD2-CB 4.47Å; L78-V139 HydrophobicContact CD1-CB 4.21Å; L78-V139 HydrophobicContact CD1-CG1 4.44Å; L78-L144 HydrophobicContact CD1-CD1 4.18Å
79	A	97.9	Very high	96.6	Very high	13 Å²	13	54.6 Å²	54.6	11%	0.107	28%	0.276	C	S	.	.	H	α-helix	trans	-66.6	-37.1	172.1	0	0	0	0	0	112	L45 L66 S75 R76 G83	L45-A79 HydrophobicContact CD1-CB 4.11Å; L45-A79 WeakPolarHBondContact CD1-O 3.49Å; L66-A79 VanDerWaalsContact CD2-CA 3.42Å; L66-A79 HydrophobicContact CD2-CB 3.71Å; S75-A79 WeakPolarHBondContact O-CB 3.48Å; S75-A79 PolarHBondContact O-N 2.99Å; R76-A79 PolarHBondContact O-N 3.08Å; A79-G83 PolarHBondContact O-N 3.5Å
80	E	97.9	Very high	96.3	Very high	98 Å²	98	53.9 Å²	53.9	46%	0.458	27%	0.272	S	S	.	.	H	α-helix	trans	-66.9	-47	175.4	-164.2	-171	123.9	0	0	111.9	R76 N77 L78 G83 K84	R76-E80 PolarHBondContact O-N 2.87Å; N77-E80 PolarHBondContact O-N 2.84Å; L78-E80 VanDerWaalsContact C-N 3.35Å; E80-G83 PolarHBondContact O-N 2.79Å; E80-K84 WeakPolarHBondContact O-CG 3.38Å; E80-K84 PolarHBondContact O-N 2.66Å; E80-K84 WeakPolarHBondContact OE1-CE 3.28Å; E80-K84 IonicContact OE1-NZ 3.31Å; E80-K84 PolarHBondContact OE1-NZ 3.42Å
81	E	98.4	Very high	96.3	Very high	37 Å²	37	52.6 Å²	52.6	17%	0.173	26%	0.261	C	S	.	.	H	α-helix	trans	-67.3	-34.8	177.4	-69.2	-57.9	123	0	0	112.8	N77 K84 A85 V139 S141 L144	N77-E81 PolarHBondContact O-N 3.17Å; N77-E81 VanDerWaalsContact O-N 3.08Å; E81-K84 PolarHBondContact O-N 2.67Å; E81-K84 WeakPolarHBondContact OE1-CD 3.3Å; E81-K84 IonicContact OE1-NZ 3.84Å; E81-K84 PolarHBondContact OE1-NZ 3.34Å; E81-A85 PolarHBondContact O-N 2.99Å; E81-V139 WeakPolarHBondContact CB-O 3.32Å; E81-V139 WeakPolarHBondContact CG-O 3.33Å; E81-S141 VanDerWaalsContact O-CB 3.23Å; E81-S141 WeakPolarHBondContact O-CB 3.46Å; E81-S141 WeakPolarHBondContact OE2-CB 3.22Å; E81-S141 PolarHBondContact OE2-N 3.26Å; E81-S141 PolarHBondContact OE2-OG 3.16Å; E81-L144 HydrophobicContact CB-CD1 4.38Å
82	L	98.4	Very high	96.2	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-68	-38.7	171.7	-167.5	67.8	0	0	0	111.3	L45 M64 L66 L78 K84 A85 V86 F98 L121 L144	L45-L82 HydrophobicContact CD1-CB 4.39Å; L45-L82 HydrophobicContact CD1-CD2 4.31Å; L45-L82 HydrophobicContact CD2-CB 4.28Å; L45-L82 HydrophobicContact CD2-CD2 3.84Å; L45-L82 HydrophobicContact CD2-CG 3.84Å; M64-L82 HydrophobicContact CE-CD1 4.34Å; L66-L82 HydrophobicContact CB-CD2 3.83Å; L66-L82 HydrophobicContact CD2-CD2 4.14Å; L78-L82 VanDerWaalsContact O-CB 3.27Å; L78-L82 WeakPolarHBondContact O-CB 3.48Å; L78-L82 PolarHBondContact O-N 3.1Å; L82-K84 VanDerWaalsContact C-N 3.33Å; L82-K84 PolarHBondContact O-N 3.01Å; L82-A85 WeakPolarHBondContact O-CB 3.31Å; L82-A85 PolarHBondContact O-N 2.84Å; L82-A85 VanDerWaalsContact O-N 3.15Å; L82-V86 VanDerWaalsContact O-CG2 3.27Å; L82-V86 WeakPolarHBondContact O-CG2 3.49Å; L82-V86 PolarHBondContact O-N 2.88Å; L82-V86 VanDerWaalsContact O-N 3.1Å; L82-F98 HydrophobicContact CD1-CD1 3.9Å; L82-F98 HydrophobicContact CD1-CE1 4.17Å; L82-F98 HydrophobicContact CG-CD1 4.18Å; L82-L121 HydrophobicContact CD1-CD1 4.34Å; L82-L121 HydrophobicContact CD1-CD2 4.12Å; L82-L121 HydrophobicContact CD2-CD1 3.79Å; L82-L144 HydrophobicContact CB-CD1 4.44Å; L82-L144 HydrophobicContact CD1-CD1 4.13Å
83	G	98	Very high	96.2	Very high	5 Å²	5	49.2 Å²	49.2	5%	0.052	24%	0.239	C	C	.	.	H	α-helix	trans	-62.4	-34.8	174.6	0	0	0	0	0	113.7	N44 A79 E80	N44-G83 PolarHBondContact ND2-O 3.43Å; A79-G83 PolarHBondContact O-N 3.5Å; E80-G83 PolarHBondContact O-N 2.79Å
84	K	98.1	Very high	96.3	Very high	71 Å²	71	43.2 Å²	43.2	31%	0.309	21%	0.214	S	C	.	.	H	α-helix	trans	-70.2	-39.3	170.1	-69.2	168	-168.3	163.7	0	112	E80 E81 L82 V86 E87 I88	E80-K84 WeakPolarHBondContact O-CG 3.38Å; E80-K84 PolarHBondContact O-N 2.66Å; E80-K84 WeakPolarHBondContact OE1-CE 3.28Å; E80-K84 IonicContact OE1-NZ 3.31Å; E80-K84 PolarHBondContact OE1-NZ 3.42Å; E81-K84 PolarHBondContact O-N 2.67Å; E81-K84 WeakPolarHBondContact OE1-CD 3.3Å; E81-K84 IonicContact OE1-NZ 3.84Å; E81-K84 PolarHBondContact OE1-NZ 3.34Å; L82-K84 VanDerWaalsContact C-N 3.33Å; L82-K84 PolarHBondContact O-N 3.01Å; K84-V86 PolarHBondContact O-N 3.13Å; K84-E87 PolarHBondContact O-N 3.36Å; K84-I88 WeakPolarHBondContact O-CG1 3.2Å; K84-I88 PolarHBondContact O-N 3.1Å
85	A	98.1	Very high	96.3	Very high	1 Å²	1	38 Å²	38	1%	0.008	20%	0.195	C	C	.	.	H	α-helix	trans	-60.6	-33	175.4	0	0	0	0	0	112.6	E81 L82 E87 M89 L144 V145	E81-A85 PolarHBondContact O-N 2.99Å; L82-A85 WeakPolarHBondContact O-CB 3.31Å; L82-A85 PolarHBondContact O-N 2.84Å; L82-A85 VanDerWaalsContact O-N 3.15Å; A85-E87 VanDerWaalsContact C-N 3.34Å; A85-M89 WeakPolarHBondContact O-CG 3.46Å; A85-M89 PolarHBondContact O-N 3.37Å; A85-M89 VanDerWaalsContact O-N 3.15Å; A85-L144 HydrophobicContact CB-CB 4.22Å; A85-V145 HydrophobicContact CB-CG2 3.8Å
86	V	97.7	Very high	96.3	Very high	13 Å²	13	38.9 Å²	38.9	8%	0.079	20%	0.199	C	C	.	.	H	α-helix	trans	-62.7	-39.4	172.2	-172.4	0	0	0	0	112.1	N44 L45 L82 K84 M89 G90 F98	N44-V86 HydrophobicContact CB-CB 3.94Å; N44-V86 HydrophobicContact CB-CG1 4.1Å; N44-V86 HydrophobicContact CB-CG2 4.29Å; N44-V86 WeakPolarHBondContact O-CG2 3.5Å; L45-V86 HydrophobicContact CD2-CG2 3.99Å; L82-V86 VanDerWaalsContact O-CG2 3.27Å; L82-V86 WeakPolarHBondContact O-CG2 3.49Å; L82-V86 PolarHBondContact O-N 2.88Å; L82-V86 VanDerWaalsContact O-N 3.1Å; K84-V86 PolarHBondContact O-N 3.13Å; V86-M89 PolarHBondContact O-N 2.98Å; V86-G90 CarbonylContact O-C 3.15Å; V86-G90 PolarHBondContact O-N 3.14Å; V86-F98 HydrophobicContact CB-CD2 4.23Å; V86-F98 HydrophobicContact CG1-CD2 4.06Å; V86-F98 HydrophobicContact CG1-CE2 4.48Å; V86-F98 HydrophobicContact CG2-CB 3.65Å; V86-F98 HydrophobicContact CG2-CD1 4.03Å; V86-F98 HydrophobicContact CG2-CD2 3.55Å; V86-F98 HydrophobicContact CG2-CE2 4.15Å; V86-F98 HydrophobicContact CG2-CG 3.48Å; V86-F98 VanDerWaalsContact CG2-CG 3.48Å
87	E	95	Very high	96.4	Very high	73 Å²	73	32.5 Å²	32.5	34%	0.341	18%	0.178	S	C	.	.	H	α-helix	trans	-70.3	-44.8	178.5	-65.5	-178.8	157.2	0	0	111.3	N44 K84 A85 M89 G90	N44-E87 WeakPolarHBondContact ND2-CG 3.47Å; N44-E87 PolarHBondContact ND2-OE1 3.48Å; K84-E87 PolarHBondContact O-N 3.36Å; A85-E87 VanDerWaalsContact C-N 3.34Å; E87-M89 PolarHBondContact O-N 2.99Å; E87-G90 PolarHBondContact O-N 3.29Å
88	I	96.6	Very high	96.5	Very high	88 Å²	88	29 Å²	29	45%	0.451	16%	0.159	S	C	.	.	H	α-helix	trans	-59	-30.2	176.9	-64	164.8	0	0	0	112	K84 T142 V145	K84-I88 WeakPolarHBondContact O-CG1 3.2Å; K84-I88 PolarHBondContact O-N 3.1Å; I88-T142 HydrophobicContact CD1-CG2 4.33Å; I88-V145 HydrophobicContact CB-CG2 4.13Å; I88-V145 HydrophobicContact CG2-CG1 4.39Å; I88-V145 HydrophobicContact CG2-CG2 3.94Å
89	M	94.8	Very high	96.5	Very high	16 Å²	16	28.3 Å²	28.3	8%	0.079	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.2	-0.2	177.8	-65.1	-169.3	76.9	0	0	114.8	A85 V86 E87 K93 I96 F98 V145 L148 R149	A85-M89 WeakPolarHBondContact O-CG 3.46Å; A85-M89 PolarHBondContact O-N 3.37Å; A85-M89 VanDerWaalsContact O-N 3.15Å; V86-M89 PolarHBondContact O-N 2.98Å; E87-M89 PolarHBondContact O-N 2.99Å; M89-K93 VanDerWaalsContact O-CD 3.29Å; M89-K93 WeakPolarHBondContact O-CD 3.39Å; M89-I96 HydrophobicContact CB-CD1 4Å; M89-I96 HydrophobicContact CE-CD1 3.73Å; M89-I96 HydrophobicContact SD-CD1 4.14Å; M89-F98 HydrophobicContact SD-CZ 3.96Å; M89-V145 HydrophobicContact CG-CB 4.32Å; M89-V145 HydrophobicContact CG-CG1 3.75Å; M89-V145 HydrophobicContact CG-CG2 3.69Å; M89-V145 HydrophobicContact SD-CB 4.35Å; M89-V145 HydrophobicContact SD-CG1 3.97Å; M89-V145 HydrophobicContact SD-CG2 4Å; M89-L148 HydrophobicContact CE-CD2 4.06Å; M89-L148 HydrophobicContact SD-CD2 3.82Å; M89-R149 HydrophobicContact CE-CG 4.46Å
90	G	92.3	Very high	96.5	Very high	3 Å²	3	28.3 Å²	28.3	3%	0.031	15%	0.153	C	C	.	.			trans	80.3	121.6	-176.9	0	0	0	0	0	113.4	V86 E87 G92 K93	V86-G90 CarbonylContact O-C 3.15Å; V86-G90 PolarHBondContact O-N 3.14Å; E87-G90 PolarHBondContact O-N 3.29Å; G90-G92 PolarHBondContact O-N 2.97Å; G90-K93 WeakPolarHBondContact O-CB 3.47Å; G90-K93 PolarHBondContact O-N 3.12Å
91	K	91.1	Very high	96.6	Very high	28 Å²	28	23.6 Å²	23.6	12%	0.122	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.8	129.1	176.6	-70	-173.7	178.4	-179	0	111	N44 K93 E260 N262 E316	N44-K91 WeakPolarHBondContact OD1-CE 3.12Å; N44-K91 PolarHBondContact OD1-NZ 2.92Å; K91-K93 VanDerWaalsContact C-N 3.32Å; K91-K93 PolarHBondContact O-N 2.88Å; K91-E260 WeakPolarHBondContact O-CG 3.46Å; K91-N262 PolarHBondContact N-ND2 2.9Å; K91-N262 PolarHBondContact O-ND2 3.38Å; K91-E316 WeakPolarHBondContact CE-OE2 3.39Å; K91-E316 IonicContact NZ-OE2 2.66Å; K91-E316 PolarHBondContact NZ-OE2 2.64Å
92	G	90.6	Very high	96.5	Very high	33 Å²	33	23.7 Å²	23.7	34%	0.34	13%	0.133	S	C	.	.	T	Hydrogen-bonded Turn	trans	73.1	14.8	179.3	0	0	0	0	0	115.8	G90 N94 E260	G90-G92 PolarHBondContact O-N 2.97Å; G92-N94 PolarHBondContact O-N 3.22Å; G92-E260 WeakPolarHBondContact CA-OE2 3.21Å
93	K	95.8	Very high	96.5	Very high	27 Å²	27	24.2 Å²	24.2	12%	0.117	14%	0.136	C	C	.	.			trans	-54.1	128.9	169.8	177.2	165	178.5	58	0	110.4	M89 G90 K91 I96 D197 E200	M89-K93 VanDerWaalsContact O-CD 3.29Å; M89-K93 WeakPolarHBondContact O-CD 3.39Å; G90-K93 WeakPolarHBondContact O-CB 3.47Å; G90-K93 PolarHBondContact O-N 3.12Å; K91-K93 VanDerWaalsContact C-N 3.32Å; K91-K93 PolarHBondContact O-N 2.88Å; K93-I96 HydrophobicContact CB-CD1 3.98Å; K93-I96 HydrophobicContact CB-CG1 4.11Å; K93-I96 HydrophobicContact CD-CD1 4.02Å; K93-I96 HydrophobicContact CG-CD1 4.03Å; K93-I96 HydrophobicContact CG-CG1 4.18Å; K93-I96 WeakPolarHBondContact O-CG1 3.43Å; K93-D197 WeakPolarHBondContact CE-O 3.32Å; K93-D197 PolarHBondContact NZ-O 2.82Å; K93-E200 IonicContact NZ-OE2 3.6Å
94	N	96.7	Very high	96.4	Very high	26 Å²	26	27.1 Å²	27.1	14%	0.139	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	157.5	-176.5	-71.9	-68	0	0	0	111.9	G92 I96 E200 F257 V258	G92-N94 PolarHBondContact O-N 3.22Å; N94-I96 PolarHBondContact O-N 2.9Å; N94-E200 HydrophobicContact CB-CB 3.62Å; N94-E200 HydrophobicContact CB-CG 3.95Å; N94-F257 HydrophobicContact CB-CD1 4.42Å; N94-V258 PolarHBondContact ND2-O 2.91Å
95	G	96.4	Very high	96.4	Very high	18 Å²	18	28.5 Å²	28.5	19%	0.186	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.5	-35.8	176.8	0	0	0	0	0	115	R61 F62	R61-G95 CarbonylContact C-O 3.55Å; R61-G95 WeakPolarHBondContact CA-O 3.44Å; R61-G95 WeakPolarHBondContact CB-O 3.16Å; R61-G95 PolarHBondContact N-O 2.91Å; F62-G95 PolarHBondContact N-O 2.94Å
96	I	97.9	Very high	96.4	Very high	19 Å²	19	30.2 Å²	30.2	10%	0.097	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	159.9	177.6	61.7	178.4	0	0	0	112.6	T60 F62 M89 K93 N94 F98 L148 I152 P199	T60-I96 VanDerWaalsContact CG2-C 3.47Å; F62-I96 HydrophobicContact CB-CG2 4.04Å; F62-I96 WeakPolarHBondContact O-CA 3.43Å; M89-I96 HydrophobicContact CB-CD1 4Å; M89-I96 HydrophobicContact CE-CD1 3.73Å; M89-I96 HydrophobicContact SD-CD1 4.14Å; K93-I96 HydrophobicContact CB-CD1 3.98Å; K93-I96 HydrophobicContact CB-CG1 4.11Å; K93-I96 HydrophobicContact CD-CD1 4.02Å; K93-I96 HydrophobicContact CG-CD1 4.03Å; K93-I96 HydrophobicContact CG-CG1 4.18Å; K93-I96 WeakPolarHBondContact O-CG1 3.43Å; N94-I96 PolarHBondContact O-N 2.9Å; I96-F98 HydrophobicContact CB-CE2 4.49Å; I96-F98 HydrophobicContact CD1-CE2 3.88Å; I96-F98 HydrophobicContact CD1-CZ 4.31Å; I96-F98 HydrophobicContact CG1-CE2 4.28Å; I96-L148 HydrophobicContact CG2-CD2 4.2Å; I96-I152 HydrophobicContact CG2-CD1 4.11Å; I96-P199 HydrophobicContact CG2-CB 3.84Å; I96-P199 HydrophobicContact CG2-CG 3.7Å
97	G	97.9	Very high	96.3	Very high	11 Å²	11	34.3 Å²	34.3	11%	0.113	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.5	154.3	171.8	0	0	0	0	0	111.5	F62 M64	F62-G97 PolarHBondContact O-N 2.95Å; M64-G97 PolarHBondContact N-O 2.88Å
98	F	98.6	Very high	96.4	Very high	14 Å²	14	38 Å²	38	6%	0.061	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	132	-174.2	-59.7	-92.9	0	0	0	110.6	L45 L46 M64 L82 V86 M89 I96 L148	L45-F98 HydrophobicContact CD2-CB 3.8Å; L46-F98 WeakPolarHBondContact CB-O 3.47Å; L46-F98 WeakPolarHBondContact CG-O 3.4Å; L46-F98 PolarHBondContact N-O 2.92Å; L46-F98 VanDerWaalsContact N-O 3.1Å; M64-F98 HydrophobicContact CB-CD1 3.82Å; M64-F98 HydrophobicContact CB-CE1 4.19Å; M64-F98 HydrophobicContact CG-CD1 4.38Å; M64-F98 HydrophobicContact CG-CE1 4.24Å; M64-F98 WeakPolarHBondContact O-CA 3.48Å; M64-F98 HydrophobicContact SD-CD1 4.37Å; M64-F98 HydrophobicContact SD-CE1 3.83Å; L82-F98 HydrophobicContact CD1-CD1 3.9Å; L82-F98 HydrophobicContact CD1-CE1 4.17Å; L82-F98 HydrophobicContact CG-CD1 4.18Å; V86-F98 HydrophobicContact CB-CD2 4.23Å; V86-F98 HydrophobicContact CG1-CD2 4.06Å; V86-F98 HydrophobicContact CG1-CE2 4.48Å; V86-F98 HydrophobicContact CG2-CB 3.65Å; V86-F98 HydrophobicContact CG2-CD1 4.03Å; V86-F98 HydrophobicContact CG2-CD2 3.55Å; V86-F98 HydrophobicContact CG2-CE2 4.15Å; V86-F98 HydrophobicContact CG2-CG 3.48Å; V86-F98 VanDerWaalsContact CG2-CG 3.48Å; M89-F98 HydrophobicContact SD-CZ 3.96Å; I96-F98 HydrophobicContact CB-CE2 4.49Å; I96-F98 HydrophobicContact CD1-CE2 3.88Å; I96-F98 HydrophobicContact CD1-CZ 4.31Å; I96-F98 HydrophobicContact CG1-CE2 4.28Å; F98-L148 HydrophobicContact CE1-CD2 4Å; F98-L148 HydrophobicContact CZ-CD2 3.71Å
99	G	98.3	Very high	96.5	Very high	0 Å²	0	34 Å²	34	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	170.5	177.8	0	0	0	0	0	113.5	L46 M64 V65 L66	L46-G99 CarbonylContact O-C 3.59Å; L46-G99 WeakPolarHBondContact O-CA 3.49Å; M64-G99 PolarHBondContact O-N 2.8Å; V65-G99 WeakPolarHBondContact CA-O 3.41Å; L66-G99 PolarHBondContact N-O 3.43Å
100	K	98.4	Very high	96.6	Very high	13 Å²	13	35.6 Å²	35.6	6%	0.057	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	141.9	180	64	-169.9	-179.6	-169.3	0	110.7	E42 L45 L46 L48 L66	E42-K100 VanDerWaalsContact CD-NZ 3.29Å; E42-K100 PolarHBondContact O-NZ 2.8Å; E42-K100 IonicContact OE1-NZ 3.61Å; E42-K100 IonicContact OE2-NZ 3.41Å; E42-K100 PolarHBondContact OE2-NZ 2.84Å; L45-K100 HydrophobicContact CB-CD 3.99Å; L45-K100 HydrophobicContact CB-CG 4.29Å; L45-K100 HydrophobicContact CD1-CB 4.49Å; L45-K100 HydrophobicContact CD1-CD 4.13Å; L46-K100 PolarHBondContact O-N 2.96Å; L48-K100 PolarHBondContact N-O 3.44Å; L66-K100 HydrophobicContact CB-CB 4.28Å; L66-K100 CarbonylContact O-C 3.59Å; L66-K100 VanDerWaalsContact O-CA 3.25Å; L66-K100 WeakPolarHBondContact O-CA 3.43Å
101	V	98.7	Very high	96.9	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	125.8	175	174.7	0	0	0	0	107.1	L48 V65 L66 F67 H68 I103 E106 L109	L48-V101 HydrophobicContact CB-CG2 4.01Å; V65-V101 HydrophobicContact CG1-CG2 3.64Å; L66-V101 PolarHBondContact O-N 2.79Å; F67-V101 HydrophobicContact CD1-CB 3.75Å; F67-V101 HydrophobicContact CD1-CG1 3.91Å; F67-V101 HydrophobicContact CD1-CG2 4.18Å; F67-V101 HydrophobicContact CE1-CB 3.97Å; F67-V101 HydrophobicContact CE1-CG1 4.08Å; F67-V101 HydrophobicContact CE1-CG2 3.89Å; F67-V101 HydrophobicContact CZ-CG2 4.47Å; H68-V101 PolarHBondContact N-O 3.32Å; H68-V101 PolarHBondContact ND1-O 2.84Å; V101-I103 HydrophobicContact CG1-CG2 4.45Å; V101-I103 PolarHBondContact O-N 2.9Å; V101-E106 HydrophobicContact CG1-CB 3.78Å; V101-E106 HydrophobicContact CG1-CG 4.08Å; V101-L109 HydrophobicContact CG1-CB 4.17Å; V101-L109 HydrophobicContact CG1-CD1 3.82Å; V101-L109 HydrophobicContact CG2-CD1 4.24Å
102	D	98.1	Very high	97.2	Very high	39 Å²	39	46.1 Å²	46.1	21%	0.209	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	102.9	172.3	-173.3	-11	0	0	0	110	H68 P70 T104 V105 E106	H68-D102 WeakPolarHBondContact O-CA 3.24Å; P70-D102 VanDerWaalsContact CD-OD1 3.25Å; P70-D102 WeakPolarHBondContact CD-OD1 3.28Å; P70-D102 WeakPolarHBondContact CD-OD2 3.21Å; P70-D102 WeakPolarHBondContact CG-OD2 3.43Å; D102-T104 PolarHBondContact O-N 3.38Å; D102-T104 VanDerWaalsContact O-N 3.17Å; D102-T104 WeakPolarHBondContact OD1-CA 3.24Å; D102-T104 VanDerWaalsContact OD1-CB 3.29Å; D102-T104 WeakPolarHBondContact OD1-CB 3.38Å; D102-T104 WeakPolarHBondContact OD1-CG2 3.27Å; D102-T104 PolarHBondContact OD1-N 3.08Å; D102-T104 PolarHBondContact OD1-OG1 3.21Å; D102-T104 PolarHBondContact OD2-OG1 3.26Å; D102-V105 PolarHBondContact O-N 2.83Å; D102-V105 VanDerWaalsContact O-N 3.14Å; D102-E106 WeakPolarHBondContact O-CB 3.32Å; D102-E106 PolarHBondContact O-N 3.28Å
103	I	97.6	Very high	97.5	Very high	11 Å²	11	45.3 Å²	45.3	6%	0.056	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73	-2.9	-179.9	73.8	172	0	0	0	113.2	F67 H68 V101 K107 Q110 I115 A118	F67-I103 HydrophobicContact CB-CG2 3.97Å; F67-I103 HydrophobicContact CD1-CG2 4.12Å; H68-I103 WeakPolarHBondContact O-CG1 3.49Å; H68-I103 PolarHBondContact O-N 3.49Å; V101-I103 HydrophobicContact CG1-CG2 4.45Å; V101-I103 PolarHBondContact O-N 2.9Å; I103-K107 PolarHBondContact O-NZ 3.38Å; I103-Q110 HydrophobicContact CB-CB 3.99Å; I103-Q110 HydrophobicContact CB-CG 3.85Å; I103-Q110 HydrophobicContact CD1-CG 4.1Å; I103-Q110 HydrophobicContact CG1-CG 4.44Å; I103-Q110 HydrophobicContact CG2-CB 4.27Å; I103-Q110 HydrophobicContact CG2-CG 4.25Å; I103-Q110 PolarHBondContact O-OE1 3.33Å; I103-I115 HydrophobicContact CD1-CB 4.46Å; I103-I115 HydrophobicContact CD1-CG2 3.7Å; I103-I115 HydrophobicContact CG2-CG2 4.27Å; I103-A118 HydrophobicContact CD1-CB 3.76Å
104	T	96.5	Very high	97.6	Very high	66 Å²	66	46.1 Å²	46.1	41%	0.405	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-32.1	169.2	70.8	0	0	0	0	111.3	S69 D102 K107	S69-T104 WeakPolarHBondContact OG-CG2 3.06Å; D102-T104 PolarHBondContact O-N 3.38Å; D102-T104 VanDerWaalsContact O-N 3.17Å; D102-T104 WeakPolarHBondContact OD1-CA 3.24Å; D102-T104 VanDerWaalsContact OD1-CB 3.29Å; D102-T104 WeakPolarHBondContact OD1-CB 3.38Å; D102-T104 WeakPolarHBondContact OD1-CG2 3.27Å; D102-T104 PolarHBondContact OD1-N 3.08Å; D102-T104 PolarHBondContact OD1-OG1 3.21Å; D102-T104 PolarHBondContact OD2-OG1 3.26Å; T104-K107 VanDerWaalsContact O-CE 3.26Å; T104-K107 WeakPolarHBondContact O-CE 3.45Å
105	V	97.1	Very high	97.6	Very high	99 Å²	99	45 Å²	45	60%	0.6	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.9	-54.2	175.8	-178.4	0	0	0	0	111	D102 K107	D102-V105 PolarHBondContact O-N 2.83Å; D102-V105 VanDerWaalsContact O-N 3.14Å; V105-K107 VanDerWaalsContact C-N 3.32Å; V105-K107 PolarHBondContact O-N 2.97Å
106	E	97.8	Very high	97.4	Very high	38 Å²	38	50.5 Å²	50.5	18%	0.178	27%	0.271	C	S	.	.			trans	-83.1	69.3	-167.1	-58.5	-66.6	-174.6	0	0	112.2	T49 P50 V101 D102 E108 L109 Q110	T49-E106 WeakPolarHBondContact CA-OE1 3.23Å; P50-E106 VanDerWaalsContact CD-OE2 3.29Å; P50-E106 WeakPolarHBondContact CD-OE2 3.39Å; P50-E106 WeakPolarHBondContact CG-OE2 3.49Å; V101-E106 HydrophobicContact CG1-CB 3.78Å; V101-E106 HydrophobicContact CG1-CG 4.08Å; D102-E106 WeakPolarHBondContact O-CB 3.32Å; D102-E106 PolarHBondContact O-N 3.28Å; E106-E108 PolarHBondContact O-N 2.84Å; E106-L109 HydrophobicContact CB-CB 4.25Å; E106-L109 HydrophobicContact CB-CD1 4.08Å; E106-L109 HydrophobicContact CB-CG 4.26Å; E106-L109 HydrophobicContact CG-CD1 4.42Å; E106-L109 PolarHBondContact O-N 2.99Å; E106-Q110 PolarHBondContact O-N 3.3Å
107	K	97.3	Very high	97.1	Very high	99 Å²	99	56.8 Å²	56.8	43%	0.43	30%	0.298	S	S	.	.	H	α-helix	trans	-65.6	-35.2	-172.9	-65.7	-45.8	-166.7	-177.6	0	114.7	I103 T104 V105 Q110 Q111	I103-K107 PolarHBondContact O-NZ 3.38Å; T104-K107 VanDerWaalsContact O-CE 3.26Å; T104-K107 WeakPolarHBondContact O-CE 3.45Å; V105-K107 VanDerWaalsContact C-N 3.32Å; V105-K107 PolarHBondContact O-N 2.97Å; K107-Q110 WeakPolarHBondContact O-CB 3.36Å; K107-Q110 PolarHBondContact O-N 3.09Å; K107-Q111 WeakPolarHBondContact O-CG 3.29Å; K107-Q111 PolarHBondContact O-N 3.24Å
108	E	97.2	Very high	96.9	Very high	150 Å²	150	57.3 Å²	57.3	70%	0.701	30%	0.301	S	S	*	.	H	α-helix	trans	-64.4	-47.2	176.5	-63.7	179	178.7	0	0	110.5	E106 Q110 Q111 E112	E106-E108 PolarHBondContact O-N 2.84Å; E108-Q110 VanDerWaalsContact C-N 3.31Å; E108-Q110 PolarHBondContact O-N 3.42Å; E108-Q111 PolarHBondContact O-N 2.64Å; E108-Q111 VanDerWaalsContact O-N 3.17Å; E108-E112 VanDerWaalsContact O-CB 3.32Å; E108-E112 WeakPolarHBondContact O-CB 3.33Å; E108-E112 PolarHBondContact O-N 3.16Å
109	L	97.7	Very high	96.8	Very high	3 Å²	3	58.1 Å²	58.1	2%	0.016	31%	0.308	C	S	.	.	H	α-helix	trans	-64.6	-34	174.8	-54.2	-175.2	0	0	0	112.1	P50 L53 V101 E106 Q111 E112 F113	P50-L109 HydrophobicContact CB-CD1 4.45Å; P50-L109 HydrophobicContact CB-CD2 4.15Å; P50-L109 HydrophobicContact CB-CG 4.49Å; P50-L109 HydrophobicContact CG-CD1 4.07Å; P50-L109 HydrophobicContact CG-CD2 4.28Å; P50-L109 HydrophobicContact CG-CG 4.11Å; L53-L109 HydrophobicContact CD2-CD1 4.09Å; L53-L109 HydrophobicContact CD2-CD2 4.13Å; V101-L109 HydrophobicContact CG1-CB 4.17Å; V101-L109 HydrophobicContact CG1-CD1 3.82Å; V101-L109 HydrophobicContact CG2-CD1 4.24Å; E106-L109 HydrophobicContact CB-CB 4.25Å; E106-L109 HydrophobicContact CB-CD1 4.08Å; E106-L109 HydrophobicContact CB-CG 4.26Å; E106-L109 HydrophobicContact CG-CD1 4.42Å; E106-L109 PolarHBondContact O-N 2.99Å; L109-Q111 VanDerWaalsContact C-N 3.33Å; L109-Q111 PolarHBondContact O-N 2.98Å; L109-E112 WeakPolarHBondContact CD2-OE2 3.22Å; L109-F113 HydrophobicContact CB-CD2 4.38Å; L109-F113 HydrophobicContact CB-CE2 4.49Å; L109-F113 HydrophobicContact CD2-CE2 4.25Å; L109-F113 VanDerWaalsContact O-CD2 3.3Å; L109-F113 WeakPolarHBondContact O-CD2 3.41Å; L109-F113 PolarHBondContact O-N 3.21Å
110	Q	97.8	Very high	96.8	Very high	50 Å²	50	60.5 Å²	60.5	23%	0.234	32%	0.319	C	S	.	.	H	α-helix	trans	-59.7	-44.9	173.4	-168.7	-172	-5.9	0	0	111.2	I103 E106 K107 E108 G114 I115	I103-Q110 HydrophobicContact CB-CB 3.99Å; I103-Q110 HydrophobicContact CB-CG 3.85Å; I103-Q110 HydrophobicContact CD1-CG 4.1Å; I103-Q110 HydrophobicContact CG1-CG 4.44Å; I103-Q110 HydrophobicContact CG2-CB 4.27Å; I103-Q110 HydrophobicContact CG2-CG 4.25Å; I103-Q110 PolarHBondContact O-OE1 3.33Å; E106-Q110 PolarHBondContact O-N 3.3Å; K107-Q110 WeakPolarHBondContact O-CB 3.36Å; K107-Q110 PolarHBondContact O-N 3.09Å; E108-Q110 VanDerWaalsContact C-N 3.31Å; E108-Q110 PolarHBondContact O-N 3.42Å; Q110-G114 PolarHBondContact O-N 2.77Å; Q110-I115 HydrophobicContact CG-CB 4.01Å; Q110-I115 PolarHBondContact NE2-O 3.17Å; Q110-I115 PolarHBondContact O-N 3.03Å
111	Q	97.4	Very high	96.8	Very high	156 Å²	156	60.1 Å²	60.1	73%	0.729	32%	0.317	S	S	*	.	H	α-helix	trans	-73.3	-50.3	-179.2	-69.2	175.8	10.8	0	0	111.6	K107 E108 L109 F113 G114	K107-Q111 WeakPolarHBondContact O-CG 3.29Å; K107-Q111 PolarHBondContact O-N 3.24Å; E108-Q111 PolarHBondContact O-N 2.64Å; E108-Q111 VanDerWaalsContact O-N 3.17Å; L109-Q111 VanDerWaalsContact C-N 3.33Å; L109-Q111 PolarHBondContact O-N 2.98Å; Q111-F113 VanDerWaalsContact C-N 3.32Å; Q111-F113 PolarHBondContact O-N 2.7Å; Q111-G114 PolarHBondContact O-N 3Å
112	E	97.8	Very high	96.8	Very high	97 Å²	97	61 Å²	61	45%	0.453	32%	0.321	S	S	.	.	H	α-helix	trans	-50.3	-49.8	179.6	-177.2	-170.6	178.4	0	0	111.8	E108 L109 G114 R129	E108-E112 VanDerWaalsContact O-CB 3.32Å; E108-E112 WeakPolarHBondContact O-CB 3.33Å; E108-E112 PolarHBondContact O-N 3.16Å; L109-E112 WeakPolarHBondContact CD2-OE2 3.22Å; E112-G114 VanDerWaalsContact C-N 3.33Å; E112-G114 PolarHBondContact O-N 3.21Å; E112-R129 IonicContact OE1-CZ 2.74Å; E112-R129 IonicContact OE1-NE 3.94Å; E112-R129 PolarHBondContact OE1-NE 2.67Å; E112-R129 IonicContact OE1-NH2 2.66Å; E112-R129 PolarHBondContact OE1-NH2 2.79Å; E112-R129 IonicContact OE2-CZ 3.68Å; E112-R129 IonicContact OE2-NE 3.74Å; E112-R129 IonicContact OE2-NH2 3.67Å; E112-R129 PolarHBondContact OE2-NH2 2.69Å
113	F	97.4	Very high	96.8	Very high	15 Å²	15	59.3 Å²	59.3	7%	0.066	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.1	9.1	-178	-61	-62.3	0	0	0	113.9	L53 F67 L109 Q111 I115 K122 F124 R129 P132	L53-F113 HydrophobicContact CD2-CE2 3.69Å; L53-F113 HydrophobicContact CD2-CZ 4.07Å; F67-F113 HydrophobicContact CE1-CB 4.31Å; F67-F113 AromaticContact CE1-CD2 3.43Å; F67-F113 HydrophobicContact CE1-CD2 3.43Å; F67-F113 VanDerWaalsContact CE1-CD2 3.43Å; F67-F113 HydrophobicContact CE1-CE2 4.1Å; F67-F113 HydrophobicContact CE1-CG 4.14Å; F67-F113 HydrophobicContact CE2-CD2 4.43Å; F67-F113 HydrophobicContact CZ-CB 4.16Å; F67-F113 AromaticContact CZ-CD2 3.34Å; F67-F113 HydrophobicContact CZ-CD2 3.34Å; F67-F113 AromaticContact CZ-CE2 3.86Å; F67-F113 HydrophobicContact CZ-CE2 3.86Å; F67-F113 AromaticContact CZ-CG 3.79Å; F67-F113 HydrophobicContact CZ-CG 3.79Å; L109-F113 HydrophobicContact CB-CD2 4.38Å; L109-F113 HydrophobicContact CB-CE2 4.49Å; L109-F113 HydrophobicContact CD2-CE2 4.25Å; L109-F113 VanDerWaalsContact O-CD2 3.3Å; L109-F113 WeakPolarHBondContact O-CD2 3.41Å; L109-F113 PolarHBondContact O-N 3.21Å; Q111-F113 VanDerWaalsContact C-N 3.32Å; Q111-F113 PolarHBondContact O-N 2.7Å; F113-I115 HydrophobicContact CB-CD1 3.82Å; F113-I115 HydrophobicContact CB-CG1 3.95Å; F113-I115 WeakPolarHBondContact O-CD1 3.26Å; F113-I115 PolarHBondContact O-N 3.12Å; F113-K122 PolarHBondContact O-NZ 2.71Å; F113-F124 HydrophobicContact CD1-CE1 4.34Å; F113-F124 HydrophobicContact CD1-CZ 4.09Å; F113-F124 AromaticContact CE1-CE1 3.63Å; F113-F124 HydrophobicContact CE1-CE1 3.63Å; F113-F124 AromaticContact CE1-CZ 3.68Å; F113-F124 HydrophobicContact CE1-CZ 3.68Å; F113-F124 HydrophobicContact CZ-CE1 4.01Å; F113-F124 AromaticContact CZ-CZ 3.93Å; F113-F124 HydrophobicContact CZ-CZ 3.93Å; F113-R129 HydrophobicContact CE1-CG 3.97Å; F113-R129 WeakPolarHBondContact CE1-O 3.47Å; F113-R129 HydrophobicContact CZ-CG 3.83Å; F113-P132 HydrophobicContact CD1-CG 4.4Å
114	G	96.4	Very high	96.9	Very high	44 Å²	44	58.9 Å²	58.9	45%	0.454	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.6	35.7	175.1	0	0	0	0	0	114.3	Q110 Q111 E112 T116	Q110-G114 PolarHBondContact O-N 2.77Å; Q111-G114 PolarHBondContact O-N 3Å; E112-G114 VanDerWaalsContact C-N 3.33Å; E112-G114 PolarHBondContact O-N 3.21Å; G114-T116 VanDerWaalsContact C-N 3.32Å; G114-T116 PolarHBondContact O-N 3.5Å
115	I	96.8	Very high	97	Very high	3 Å²	3	57.1 Å²	57.1	2%	0.015	30%	0.296	C	S	.	.			trans	-81.1	77.6	-172	-45.8	-62.1	0	0	0	110.9	F67 I103 Q110 F113 Q120 K122	F67-I115 HydrophobicContact CB-CD1 3.97Å; F67-I115 HydrophobicContact CB-CG1 3.99Å; F67-I115 HydrophobicContact CB-CG2 3.99Å; F67-I115 HydrophobicContact CD1-CD1 4.22Å; F67-I115 HydrophobicContact CD1-CG1 3.91Å; F67-I115 HydrophobicContact CD2-CD1 3.95Å; F67-I115 HydrophobicContact CG-CD1 3.77Å; F67-I115 HydrophobicContact CG-CG1 3.88Å; I103-I115 HydrophobicContact CD1-CB 4.46Å; I103-I115 HydrophobicContact CD1-CG2 3.7Å; I103-I115 HydrophobicContact CG2-CG2 4.27Å; Q110-I115 HydrophobicContact CG-CB 4.01Å; Q110-I115 PolarHBondContact NE2-O 3.17Å; Q110-I115 PolarHBondContact O-N 3.03Å; F113-I115 HydrophobicContact CB-CD1 3.82Å; F113-I115 HydrophobicContact CB-CG1 3.95Å; F113-I115 WeakPolarHBondContact O-CD1 3.26Å; F113-I115 PolarHBondContact O-N 3.12Å; I115-Q120 HydrophobicContact CD1-CB 4.25Å; I115-Q120 HydrophobicContact CD1-CG 4.45Å; I115-Q120 HydrophobicContact CG2-CG 4.14Å; I115-K122 HydrophobicContact CD1-CD 4.49Å
116	T	92.9	Very high	96.9	Very high	133 Å²	133	55.6 Å²	55.6	82%	0.816	28%	0.283	S	S	*	.			trans	-73.3	-27.8	179.9	53.9	0	0	0	0	114.2	G114	G114-T116 VanDerWaalsContact C-N 3.32Å; G114-T116 PolarHBondContact O-N 3.5Å
117	K	91.6	Very high	96.9	Very high	151 Å²	151	54.9 Å²	54.9	66%	0.657	29%	0.286	S	S	*	.	S	Bend	trans	-144.9	128.1	178.8	179.7	177.9	178.6	179	0	110.1	Q120	K117-Q120 WeakPolarHBondContact O-CG 3.4Å; K117-Q120 PolarHBondContact O-NE2 2.76Å
118	A	93.6	Very high	96.8	Very high	22 Å²	22	53 Å²	53	18%	0.182	28%	0.281	C	S	.	.	S	Bend	trans	-95.8	155	176.1	0	0	0	0	0	112.9	I103	I103-A118 HydrophobicContact CD1-CB 3.76Å
119	P	97.1	Very high	96.9	Very high	32 Å²	32	49 Å²	49	21%	0.208	26%	0.259	C	S	.	.			cis	-76.9	156.7	-7.8	32.6	-35	0	0	0	112.8	L66 F67 Q74 L78	L66-P119 HydrophobicContact CD1-CB 3.92Å; F67-P119 CarbonylContact O-C 3.5Å; F67-P119 VanDerWaalsContact O-CA 3.3Å; F67-P119 WeakPolarHBondContact O-CA 3.37Å; Q74-P119 HydrophobicContact CB-CG 4.46Å; L78-P119 HydrophobicContact CB-CG 4.33Å; L78-P119 HydrophobicContact CD2-CB 4.01Å; L78-P119 HydrophobicContact CD2-CG 3.86Å
120	Q	97.9	Very high	96.8	Very high	50 Å²	50	54 Å²	54	23%	0.234	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	137.9	163.4	-56.8	-169.6	13	0	0	109.9	F67 I115 K117	F67-Q120 PolarHBondContact N-O 3.01Å; F67-Q120 PolarHBondContact O-N 3.12Å; I115-Q120 HydrophobicContact CD1-CB 4.25Å; I115-Q120 HydrophobicContact CD1-CG 4.45Å; I115-Q120 HydrophobicContact CG2-CG 4.14Å; K117-Q120 WeakPolarHBondContact O-CG 3.4Å; K117-Q120 PolarHBondContact O-NE2 2.76Å
121	L	98.4	Very high	96.8	Very high	5 Å²	5	58.5 Å²	58.5	3%	0.026	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	125.8	179.1	-176.1	55.8	0	0	0	109	M64 L66 L78 L82 C135 L144	M64-L121 HydrophobicContact CB-CD1 4.49Å; M64-L121 HydrophobicContact CE-CD1 3.92Å; M64-L121 HydrophobicContact CE-CD2 3.62Å; M64-L121 HydrophobicContact CE-CG 3.65Å; L66-L121 HydrophobicContact CB-CD1 4Å; L66-L121 HydrophobicContact CD1-CB 4.42Å; L66-L121 HydrophobicContact CD1-CD1 4.44Å; L78-L121 HydrophobicContact CD2-CB 4.47Å; L82-L121 HydrophobicContact CD1-CD1 4.34Å; L82-L121 HydrophobicContact CD1-CD2 4.12Å; L82-L121 HydrophobicContact CD2-CD1 3.79Å; L121-C135 HydrophobicContact CB-CB 4.04Å; L121-C135 HydrophobicContact CD2-CB 4.21Å; L121-C135 HydrophobicContact CG-CB 3.95Å; L121-C135 WeakPolarHBondContact O-CB 3.34Å; L121-C135 PolarHBondContact O-N 3.17Å; L121-L144 HydrophobicContact CD2-CD2 3.52Å
122	K	98.6	Very high	96.8	Very high	19 Å²	19	52.2 Å²	52.2	8%	0.083	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	138.9	-174.3	-75.9	-176.7	174.8	-169.5	0	110.6	M64 V65 F67 F113 I115 F124 P132 I133	M64-K122 CarbonylContact C-O 3.45Å; M64-K122 WeakPolarHBondContact CA-O 3.42Å; V65-K122 PolarHBondContact N-O 3.1Å; V65-K122 PolarHBondContact O-N 3.32Å; F67-K122 HydrophobicContact CD2-CD 4.29Å; F67-K122 HydrophobicContact CE2-CB 4.18Å; F67-K122 HydrophobicContact CE2-CD 3.98Å; F67-K122 HydrophobicContact CE2-CG 4.42Å; F113-K122 PolarHBondContact O-NZ 2.71Å; I115-K122 HydrophobicContact CD1-CD 4.49Å; K122-F124 HydrophobicContact CB-CE2 3.99Å; K122-P132 HydrophobicContact CB-CB 4.09Å; K122-P132 HydrophobicContact CD-CB 4Å; K122-P132 HydrophobicContact CD-CG 3.94Å; K122-P132 HydrophobicContact CG-CB 4.35Å; K122-I133 CarbonylContact C-O 3.55Å; K122-I133 WeakPolarHBondContact CA-O 3.3Å
123	L	98.8	Very high	96.8	Very high	2 Å²	2	49.9 Å²	49.9	1%	0.01	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	123.7	173.5	172.2	63.9	0	0	0	109.4	F62 L63 M64 I133 W147 L148 Q151	F62-L123 HydrophobicContact CB-CD1 4.03Å; F62-L123 HydrophobicContact CD1-CD1 4.35Å; F62-L123 HydrophobicContact CD1-CD2 4.45Å; L63-L123 WeakPolarHBondContact O-CA 3.45Å; M64-L123 HydrophobicContact CG-CB 4.48Å; M64-L123 HydrophobicContact CG-CD1 3.9Å; L123-I133 HydrophobicContact CB-CB 4.36Å; L123-I133 PolarHBondContact N-O 3.15Å; L123-I133 PolarHBondContact O-N 2.77Å; L123-W147 HydrophobicContact CB-CH2 3.7Å; L123-W147 HydrophobicContact CB-CZ3 3.91Å; L123-W147 HydrophobicContact CD2-CH2 3.98Å; L123-W147 HydrophobicContact CD2-CZ3 3.93Å; L123-L148 HydrophobicContact CD1-CD1 3.89Å; L123-L148 HydrophobicContact CD2-CD1 3.9Å; L123-Q151 HydrophobicContact CD2-CB 3.52Å; L123-Q151 HydrophobicContact CD2-CG 3.81Å
124	F	98.7	Very high	96.8	Very high	2 Å²	2	51.5 Å²	51.5	1%	0.009	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	136.1	172.6	-62.6	-103.4	0	0	0	109	L57 F62 L63 V65 F67 F113 K122 N128 P132	L57-F124 HydrophobicContact CD2-CB 3.48Å; L57-F124 VanDerWaalsContact CD2-CB 3.48Å; L57-F124 HydrophobicContact CD2-CD1 3.56Å; L57-F124 HydrophobicContact CD2-CD2 4.35Å; L57-F124 HydrophobicContact CD2-CE1 4.34Å; L57-F124 HydrophobicContact CD2-CG 3.56Å; F62-F124 WeakPolarHBondContact CA-O 3.19Å; L63-F124 HydrophobicContact CB-CB 4.36Å; L63-F124 PolarHBondContact N-O 2.73Å; L63-F124 PolarHBondContact O-N 2.95Å; V65-F124 HydrophobicContact CB-CD2 4.33Å; V65-F124 HydrophobicContact CB-CE2 3.9Å; V65-F124 HydrophobicContact CG2-CD2 3.75Å; V65-F124 HydrophobicContact CG2-CE2 3.68Å; F67-F124 HydrophobicContact CE2-CE2 4.32Å; F67-F124 HydrophobicContact CE2-CZ 4.47Å; F67-F124 HydrophobicContact CZ-CZ 4.4Å; F113-F124 HydrophobicContact CD1-CE1 4.34Å; F113-F124 HydrophobicContact CD1-CZ 4.09Å; F113-F124 AromaticContact CE1-CE1 3.63Å; F113-F124 HydrophobicContact CE1-CE1 3.63Å; F113-F124 AromaticContact CE1-CZ 3.68Å; F113-F124 HydrophobicContact CE1-CZ 3.68Å; F113-F124 HydrophobicContact CZ-CE1 4.01Å; F113-F124 AromaticContact CZ-CZ 3.93Å; F113-F124 HydrophobicContact CZ-CZ 3.93Å; K122-F124 HydrophobicContact CB-CE2 3.99Å; F124-N128 WeakPolarHBondContact CD1-O 3.49Å; F124-P132 HydrophobicContact CD1-CB 3.91Å; F124-P132 HydrophobicContact CD2-CB 4.33Å; F124-P132 HydrophobicContact CE1-CB 3.64Å; F124-P132 HydrophobicContact CE1-CG 4.03Å; F124-P132 HydrophobicContact CE2-CB 4.05Å; F124-P132 HydrophobicContact CG-CB 4.26Å; F124-P132 HydrophobicContact CZ-CB 3.71Å; F124-P132 HydrophobicContact CZ-CG 4.16Å
125	F	98.3	Very high	96.8	Very high	29 Å²	29	50 Å²	50	13%	0.127	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	128.8	-178.7	175.8	-108.9	0	0	0	110.3	R61 F62 G127 N128 K155 F157	R61-F125 HydrophobicContact CG-CE2 4.31Å; R61-F125 WeakPolarHBondContact O-CA 3.4Å; R61-F125 WeakPolarHBondContact O-CD2 3.46Å; F62-F125 AromaticContact CD1-CD2 3.92Å; F62-F125 HydrophobicContact CD1-CD2 3.92Å; F62-F125 AromaticContact CE1-CD2 3.54Å; F62-F125 HydrophobicContact CE1-CD2 3.54Å; F62-F125 AromaticContact CE1-CE2 3.8Å; F62-F125 HydrophobicContact CE1-CE2 3.8Å; F62-F125 HydrophobicContact CE2-CD2 4.45Å; F62-F125 HydrophobicContact CE2-CE2 4.2Å; F62-F125 AromaticContact CZ-CD2 3.85Å; F62-F125 HydrophobicContact CZ-CD2 3.85Å; F62-F125 AromaticContact CZ-CE2 3.62Å; F62-F125 HydrophobicContact CZ-CE2 3.62Å; F125-G127 PolarHBondContact O-N 3.38Å; F125-G127 VanDerWaalsContact O-N 3.1Å; F125-N128 WeakPolarHBondContact O-CB 3.39Å; F125-N128 PolarHBondContact O-N 3.01Å; F125-K155 HydrophobicContact CD1-CD 4Å; F125-K155 HydrophobicContact CD1-CG 4.49Å; F125-K155 HydrophobicContact CD2-CB 4.17Å; F125-K155 HydrophobicContact CD2-CD 4.3Å; F125-K155 HydrophobicContact CD2-CG 3.91Å; F125-K155 HydrophobicContact CE1-CD 4.01Å; F125-K155 HydrophobicContact CE1-CG 4.47Å; F125-K155 HydrophobicContact CE2-CB 3.64Å; F125-K155 HydrophobicContact CE2-CD 4.31Å; F125-K155 HydrophobicContact CE2-CG 3.89Å; F125-K155 HydrophobicContact CG-CD 4.14Å; F125-K155 HydrophobicContact CG-CG 4.21Å; F125-K155 HydrophobicContact CZ-CB 3.86Å; F125-K155 HydrophobicContact CZ-CD 4.16Å; F125-K155 HydrophobicContact CZ-CG 4.17Å; F125-F157 AromaticContact CE1-CZ 3.91Å; F125-F157 HydrophobicContact CE1-CZ 3.91Å; F125-F157 HydrophobicContact CZ-CE2 4.06Å; F125-F157 AromaticContact CZ-CZ 3.91Å; F125-F157 HydrophobicContact CZ-CZ 3.91Å
126	E	96.4	Very high	96.7	Very high	67 Å²	67	58 Å²	58	31%	0.313	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	46.4	40.7	178.5	-68	-178	177.5	0	0	113.8	R61 N128 R172	R61-E126 HydrophobicContact CG-CG 3.78Å; R61-E126 IonicContact CZ-OE1 3.13Å; R61-E126 IonicContact NE-OE1 2.64Å; R61-E126 PolarHBondContact NE-OE1 2.88Å; R61-E126 IonicContact NH2-OE1 2.66Å; R61-E126 PolarHBondContact NH2-OE1 2.88Å; R61-E126 VanDerWaalsContact NH2-OE1 3.12Å; R61-E126 PolarHBondContact O-N 3.42Å; E126-N128 PolarHBondContact O-N 2.79Å; E126-R172 VanDerWaalsContact CD-NH1 3.3Å; E126-R172 IonicContact OE1-CZ 3.12Å; E126-R172 IonicContact OE1-NH1 3.8Å; E126-R172 PolarHBondContact OE1-NH1 2.85Å; E126-R172 IonicContact OE1-NH2 3.74Å; E126-R172 IonicContact OE2-CZ 3.38Å; E126-R172 IonicContact OE2-NH1 2.71Å; E126-R172 PolarHBondContact OE2-NH1 3.23Å; E126-R172 VanDerWaalsContact OE2-NH1 3.15Å; E126-R172 IonicContact OE2-NH2 3.39Å; E126-R172 PolarHBondContact OE2-NH2 2.94Å
127	G	96.1	Very high	96.5	Very high	23 Å²	23	55.4 Å²	55.4	24%	0.237	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	73.2	1.4	178.6	0	0	0	0	0	116	L57 F125 R129	L57-G127 VanDerWaalsContact O-CA 3.28Å; L57-G127 WeakPolarHBondContact O-CA 3.27Å; F125-G127 PolarHBondContact O-N 3.38Å; F125-G127 VanDerWaalsContact O-N 3.1Å; G127-R129 PolarHBondContact O-N 2.71Å
128	N	96.9	Very high	96.7	Very high	61 Å²	61	49.8 Å²	49.8	33%	0.326	29%	0.287	S	S	.	.			trans	-64.2	98	177.2	-177.1	-13.7	0	0	0	110.6	F124 F125 E126 S130 E131	F124-N128 WeakPolarHBondContact CD1-O 3.49Å; F125-N128 WeakPolarHBondContact O-CB 3.39Å; F125-N128 PolarHBondContact O-N 3.01Å; E126-N128 PolarHBondContact O-N 2.79Å; N128-S130 PolarHBondContact OD1-N 3.26Å; N128-S130 VanDerWaalsContact OD1-N 3.1Å; N128-E131 PolarHBondContact ND2-OE2 3.02Å; N128-E131 PolarHBondContact OD1-N 3.41Å; N128-E131 VanDerWaalsContact OD1-N 3.1Å
129	R	97.4	Very high	96.8	Very high	64 Å²	64	53.1 Å²	53.1	24%	0.242	31%	0.305	C	S	.	.	S	Bend	trans	-74.8	-27.9	-178.6	-167.9	168.9	176.5	147.3	-3.8	112.8	T54 L57 E112 F113 G127	T54-R129 PolarHBondContact OG1-NH1 3.45Å; L57-R129 HydrophobicContact CD1-CB 4.18Å; L57-R129 HydrophobicContact CD1-CG 3.93Å; E112-R129 IonicContact OE1-CZ 2.74Å; E112-R129 IonicContact OE1-NE 3.94Å; E112-R129 PolarHBondContact OE1-NE 2.67Å; E112-R129 IonicContact OE1-NH2 2.66Å; E112-R129 PolarHBondContact OE1-NH2 2.79Å; E112-R129 IonicContact OE2-CZ 3.68Å; E112-R129 IonicContact OE2-NE 3.74Å; E112-R129 IonicContact OE2-NH2 3.67Å; E112-R129 PolarHBondContact OE2-NH2 2.69Å; F113-R129 HydrophobicContact CE1-CG 3.97Å; F113-R129 WeakPolarHBondContact CE1-O 3.47Å; F113-R129 HydrophobicContact CZ-CG 3.83Å; G127-R129 PolarHBondContact O-N 2.71Å
130	S	96.9	Very high	96.8	Very high	110 Å²	110	55.8 Å²	55.8	77%	0.769	31%	0.314	S	S	*	.	S	Bend	trans	-77.4	-31.1	-174.2	-55.4	0	0	0	0	113.4	N128 P132	N128-S130 PolarHBondContact OD1-N 3.26Å; N128-S130 VanDerWaalsContact OD1-N 3.1Å; S130-P132 VanDerWaalsContact O-CD 3.28Å; S130-P132 WeakPolarHBondContact O-CD 3.32Å
131	E	96.4	Very high	96.8	Very high	143 Å²	143	54.1 Å²	54.1	67%	0.668	31%	0.308	S	S	*	.	S	Bend	trans	-121.5	58.4	-171.7	-59.1	175.6	106.1	0	0	114.1	N128 I133	N128-E131 PolarHBondContact ND2-OE2 3.02Å; N128-E131 PolarHBondContact OD1-N 3.41Å; N128-E131 VanDerWaalsContact OD1-N 3.1Å; E131-I133 PolarHBondContact O-N 3.06Å
132	P	97.6	Very high	96.8	Very high	24 Å²	24	57.5 Å²	57.5	16%	0.156	33%	0.329	C	S	.	.	P	Polyproline II helix	trans	-71.3	127.5	-179.9	27.2	-33.1	0	0	0	113.3	F113 K122 F124 S130 S134	F113-P132 HydrophobicContact CD1-CG 4.4Å; K122-P132 HydrophobicContact CB-CB 4.09Å; K122-P132 HydrophobicContact CD-CB 4Å; K122-P132 HydrophobicContact CD-CG 3.94Å; K122-P132 HydrophobicContact CG-CB 4.35Å; F124-P132 HydrophobicContact CD1-CB 3.91Å; F124-P132 HydrophobicContact CD2-CB 4.33Å; F124-P132 HydrophobicContact CE1-CB 3.64Å; F124-P132 HydrophobicContact CE1-CG 4.03Å; F124-P132 HydrophobicContact CE2-CB 4.05Å; F124-P132 HydrophobicContact CG-CB 4.26Å; F124-P132 HydrophobicContact CZ-CB 3.71Å; F124-P132 HydrophobicContact CZ-CG 4.16Å; S130-P132 VanDerWaalsContact O-CD 3.28Å; S130-P132 WeakPolarHBondContact O-CD 3.32Å; P132-S134 PolarHBondContact O-N 3.02Å
133	I	98.3	Very high	96.7	Very high	48 Å²	48	58.3 Å²	58.3	25%	0.246	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	119.4	178.7	-53.2	174.9	0	0	0	109.1	K122 L123 E131 C135 W147	K122-I133 CarbonylContact C-O 3.55Å; K122-I133 WeakPolarHBondContact CA-O 3.3Å; L123-I133 HydrophobicContact CB-CB 4.36Å; L123-I133 PolarHBondContact N-O 3.15Å; L123-I133 PolarHBondContact O-N 2.77Å; E131-I133 PolarHBondContact O-N 3.06Å; I133-C135 PolarHBondContact O-N 3.32Å; I133-W147 HydrophobicContact CG2-CH2 4.34Å; I133-W147 HydrophobicContact CG2-CZ2 4.13Å
134	S	97.4	Very high	96.7	Very high	50 Å²	50	58.3 Å²	58.3	35%	0.35	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	117	-176.7	-62.7	0	0	0	0	112.3	P132 K136	P132-S134 PolarHBondContact O-N 3.02Å; S134-K136 PolarHBondContact O-N 2.89Å
135	C	97.3	Very high	96.7	Very high	12 Å²	12	59 Å²	59	8%	0.081	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	106.9	170.4	-169.2	0	0	0	0	109.1	L121 I133 W147	L121-C135 HydrophobicContact CB-CB 4.04Å; L121-C135 HydrophobicContact CD2-CB 4.21Å; L121-C135 HydrophobicContact CG-CB 3.95Å; L121-C135 WeakPolarHBondContact O-CB 3.34Å; L121-C135 PolarHBondContact O-N 3.17Å; I133-C135 PolarHBondContact O-N 3.32Å; C135-W147 HydrophobicContact CB-CD2 4.29Å; C135-W147 HydrophobicContact CB-CE3 4.23Å; C135-W147 HydrophobicContact CB-CH2 3.69Å; C135-W147 HydrophobicContact CB-CZ2 3.72Å; C135-W147 HydrophobicContact CB-CZ3 3.96Å; C135-W147 VanDerWaalsContact SG-CD2 3.55Å
136	K	93.3	Very high	96.7	Very high	171 Å²	171	60.9 Å²	60.9	74%	0.743	36%	0.357	S	S	*	.			trans	-115.9	136.5	-176.4	-67	177.2	179.7	174	0	110.4	S134 V138	S134-K136 PolarHBondContact O-N 2.89Å; K136-V138 PolarHBondContact O-N 3.15Å; K136-V138 VanDerWaalsContact O-N 3.15Å
137	G	89.4	Confident	96.8	Very high	79 Å²	79	59.6 Å²	59.6	81%	0.814	35%	0.35	S	S	*	.	S	Bend	trans	76.9	-13.5	174.8	0	0	0	0	0	116.1
138	V	96	Very high	96.9	Very high	33 Å²	33	58.6 Å²	58.6	20%	0.2	34%	0.339	C	S	.	.			trans	-92.1	122.4	175.5	-166.9	0	0	0	0	109.1	K136 A143 L144 W147	K136-V138 PolarHBondContact O-N 3.15Å; K136-V138 VanDerWaalsContact O-N 3.15Å; V138-A143 HydrophobicContact CG1-CB 3.69Å; V138-A143 WeakPolarHBondContact CG1-O 3.43Å; V138-L144 HydrophobicContact CB-CD2 4.12Å; V138-L144 HydrophobicContact CG1-CB 4.49Å; V138-L144 HydrophobicContact CG1-CD2 3.76Å; V138-L144 HydrophobicContact CG1-CG 3.98Å; V138-W147 HydrophobicContact CG1-CB 4.39Å; V138-W147 HydrophobicContact CG2-CB 4.34Å; V138-W147 HydrophobicContact CG2-CG 4.24Å
139	V	94.8	Very high	97	Very high	92 Å²	92	58.7 Å²	58.7	56%	0.558	33%	0.334	S	S	*	.			trans	-139.2	-1.2	-172.1	-61.9	0	0	0	0	115.2	L78 E81	L78-V139 HydrophobicContact CD1-CB 4.21Å; L78-V139 HydrophobicContact CD1-CG1 4.44Å; E81-V139 WeakPolarHBondContact CB-O 3.32Å; E81-V139 WeakPolarHBondContact CG-O 3.33Å
140	E	97.9	Very high	97	Very high	88 Å²	88	63 Å²	63	41%	0.411	35%	0.351	S	S	.	.	S	Bend	trans	-118.4	142	-175.3	176.6	-97.2	112.1	0	0	109.4	T142 A143 L144	E140-T142 PolarHBondContact O-N 2.74Å; E140-T142 WeakPolarHBondContact OE1-CA 3.49Å; E140-T142 VanDerWaalsContact OE1-CB 3.27Å; E140-T142 WeakPolarHBondContact OE1-CB 3.46Å; E140-T142 WeakPolarHBondContact OE1-CG2 3.37Å; E140-T142 PolarHBondContact OE1-N 3.03Å; E140-T142 PolarHBondContact OE1-OG1 3.09Å; E140-T142 PolarHBondContact OE2-OG1 2.99Å; E140-A143 PolarHBondContact O-N 3Å; E140-A143 VanDerWaalsContact O-N 3.15Å; E140-L144 WeakPolarHBondContact O-CG 3.05Å; E140-L144 PolarHBondContact O-N 2.97Å
141	S	98	Very high	97.1	Very high	14 Å²	14	59 Å²	59	10%	0.098	32%	0.32	C	S	.	.	H	α-helix	trans	-57	-45	-163.9	43.4	0	0	0	0	114.9	E81 L144 V145	E81-S141 VanDerWaalsContact O-CB 3.23Å; E81-S141 WeakPolarHBondContact O-CB 3.46Å; E81-S141 WeakPolarHBondContact OE2-CB 3.22Å; E81-S141 PolarHBondContact OE2-N 3.26Å; E81-S141 PolarHBondContact OE2-OG 3.16Å; S141-L144 PolarHBondContact O-N 3.14Å; S141-V145 WeakPolarHBondContact O-CG2 3.47Å; S141-V145 PolarHBondContact O-N 3.44Å; S141-V145 VanDerWaalsContact O-N 3.17Å
142	T	97.8	Very high	97.1	Very high	77 Å²	77	52.5 Å²	52.5	47%	0.472	29%	0.29	S	S	.	.	H	α-helix	trans	-69.1	-39.6	178.3	72.2	0	0	0	0	111.3	I88 E140 L144 V145 V146	I88-T142 HydrophobicContact CD1-CG2 4.33Å; E140-T142 PolarHBondContact O-N 2.74Å; E140-T142 WeakPolarHBondContact OE1-CA 3.49Å; E140-T142 VanDerWaalsContact OE1-CB 3.27Å; E140-T142 WeakPolarHBondContact OE1-CB 3.46Å; E140-T142 WeakPolarHBondContact OE1-CG2 3.37Å; E140-T142 PolarHBondContact OE1-N 3.03Å; E140-T142 PolarHBondContact OE1-OG1 3.09Å; E140-T142 PolarHBondContact OE2-OG1 2.99Å; T142-L144 VanDerWaalsContact C-N 3.33Å; T142-L144 PolarHBondContact O-N 3.18Å; T142-V145 PolarHBondContact O-N 3.12Å; T142-V146 WeakPolarHBondContact O-CG2 3.34Å; T142-V146 PolarHBondContact O-N 3.34Å
143	A	98.1	Very high	97.1	Very high	35 Å²	35	51.9 Å²	51.9	29%	0.289	29%	0.286	S	S	.	.	H	α-helix	trans	-65.6	-34.7	176.3	0	0	0	0	0	112.3	V138 E140 V146 W147	V138-A143 HydrophobicContact CG1-CB 3.69Å; V138-A143 WeakPolarHBondContact CG1-O 3.43Å; E140-A143 PolarHBondContact O-N 3Å; E140-A143 VanDerWaalsContact O-N 3.15Å; A143-V146 PolarHBondContact O-N 3.37Å; A143-W147 WeakPolarHBondContact O-CB 3.1Å; A143-W147 PolarHBondContact O-N 3.24Å
144	L	98.6	Very high	97	Very high	2 Å²	2	55.9 Å²	55.9	1%	0.01	30%	0.303	C	S	.	.	H	α-helix	trans	-63.9	-42.8	172.8	-73.5	170.4	0	0	0	111.8	L78 E81 L82 A85 L121 V138 E140 S141 T142 W147 L148	L78-L144 HydrophobicContact CD1-CD1 4.18Å; E81-L144 HydrophobicContact CB-CD1 4.38Å; L82-L144 HydrophobicContact CB-CD1 4.44Å; L82-L144 HydrophobicContact CD1-CD1 4.13Å; A85-L144 HydrophobicContact CB-CB 4.22Å; L121-L144 HydrophobicContact CD2-CD2 3.52Å; V138-L144 HydrophobicContact CB-CD2 4.12Å; V138-L144 HydrophobicContact CG1-CB 4.49Å; V138-L144 HydrophobicContact CG1-CD2 3.76Å; V138-L144 HydrophobicContact CG1-CG 3.98Å; E140-L144 WeakPolarHBondContact O-CG 3.05Å; E140-L144 PolarHBondContact O-N 2.97Å; S141-L144 PolarHBondContact O-N 3.14Å; T142-L144 VanDerWaalsContact C-N 3.33Å; T142-L144 PolarHBondContact O-N 3.18Å; L144-W147 PolarHBondContact O-N 3.07Å; L144-L148 PolarHBondContact O-N 2.71Å
145	V	98.4	Very high	97	Very high	16 Å²	16	57 Å²	57	10%	0.097	30%	0.302	C	S	.	.	H	α-helix	trans	-63.6	-44.8	174.8	174.5	0	0	0	0	111.3	A85 I88 M89 S141 T142 W147 L148 R149	A85-V145 HydrophobicContact CB-CG2 3.8Å; I88-V145 HydrophobicContact CB-CG2 4.13Å; I88-V145 HydrophobicContact CG2-CG1 4.39Å; I88-V145 HydrophobicContact CG2-CG2 3.94Å; M89-V145 HydrophobicContact CG-CB 4.32Å; M89-V145 HydrophobicContact CG-CG1 3.75Å; M89-V145 HydrophobicContact CG-CG2 3.69Å; M89-V145 HydrophobicContact SD-CB 4.35Å; M89-V145 HydrophobicContact SD-CG1 3.97Å; M89-V145 HydrophobicContact SD-CG2 4Å; S141-V145 WeakPolarHBondContact O-CG2 3.47Å; S141-V145 PolarHBondContact O-N 3.44Å; S141-V145 VanDerWaalsContact O-N 3.17Å; T142-V145 PolarHBondContact O-N 3.12Å; V145-W147 VanDerWaalsContact C-N 3.32Å; V145-W147 PolarHBondContact O-N 3.1Å; V145-L148 PolarHBondContact O-N 3.37Å; V145-R149 HydrophobicContact CG1-CG 4.39Å; V145-R149 WeakPolarHBondContact O-CB 3.17Å; V145-R149 WeakPolarHBondContact O-CG 3.18Å; V145-R149 PolarHBondContact O-N 3.43Å
146	V	98.3	Very high	97	Very high	69 Å²	69	57.1 Å²	57.1	42%	0.418	30%	0.304	S	S	.	.	H	α-helix	trans	-61.5	-40.4	175.5	171.9	0	0	0	0	111.5	T142 A143 R150	T142-V146 WeakPolarHBondContact O-CG2 3.34Å; T142-V146 PolarHBondContact O-N 3.34Å; A143-V146 PolarHBondContact O-N 3.37Å; V146-R150 VanDerWaalsContact O-CG 3.3Å; V146-R150 WeakPolarHBondContact O-CG 3.4Å; V146-R150 PolarHBondContact O-N 2.73Å; V146-R150 VanDerWaalsContact O-N 3.07Å
147	W	98.6	Very high	97.2	Very high	41 Å²	41	51.7 Å²	51.7	16%	0.155	28%	0.281	C	S	.	.	H	α-helix	trans	-63.2	-48.9	175.6	-176.7	89.3	0	0	0	111.8	M64 L123 I133 C135 V138 A143 L144 V145 R150 Q151	M64-W147 HydrophobicContact CE-CE3 3.95Å; M64-W147 HydrophobicContact CE-CZ3 3.66Å; M64-W147 HydrophobicContact SD-CE3 4.48Å; M64-W147 HydrophobicContact SD-CZ3 4.26Å; L123-W147 HydrophobicContact CB-CH2 3.7Å; L123-W147 HydrophobicContact CB-CZ3 3.91Å; L123-W147 HydrophobicContact CD2-CH2 3.98Å; L123-W147 HydrophobicContact CD2-CZ3 3.93Å; I133-W147 HydrophobicContact CG2-CH2 4.34Å; I133-W147 HydrophobicContact CG2-CZ2 4.13Å; C135-W147 HydrophobicContact CB-CD2 4.29Å; C135-W147 HydrophobicContact CB-CE3 4.23Å; C135-W147 HydrophobicContact CB-CH2 3.69Å; C135-W147 HydrophobicContact CB-CZ2 3.72Å; C135-W147 HydrophobicContact CB-CZ3 3.96Å; C135-W147 VanDerWaalsContact SG-CD2 3.55Å; V138-W147 HydrophobicContact CG1-CB 4.39Å; V138-W147 HydrophobicContact CG2-CB 4.34Å; V138-W147 HydrophobicContact CG2-CG 4.24Å; A143-W147 WeakPolarHBondContact O-CB 3.1Å; A143-W147 PolarHBondContact O-N 3.24Å; L144-W147 PolarHBondContact O-N 3.07Å; V145-W147 VanDerWaalsContact C-N 3.32Å; V145-W147 PolarHBondContact O-N 3.1Å; W147-R150 WeakPolarHBondContact O-CB 3.32Å; W147-R150 PolarHBondContact O-N 2.8Å; W147-Q151 HydrophobicContact CD2-CG 4.05Å; W147-Q151 HydrophobicContact CE3-CG 4.07Å; W147-Q151 HydrophobicContact CH2-CG 3.79Å; W147-Q151 HydrophobicContact CZ2-CG 3.76Å; W147-Q151 HydrophobicContact CZ3-CG 3.93Å; W147-Q151 WeakPolarHBondContact O-CG 3.43Å; W147-Q151 PolarHBondContact O-N 3.29Å
148	L	98.4	Very high	97.6	Very high	1 Å²	1	52.5 Å²	52.5	1%	0.005	27%	0.266	C	S	.	.	H	α-helix	trans	-64.2	-42.9	179.5	-179	58.6	0	0	0	111.8	M64 M89 I96 F98 L123 L144 V145 R150 Q151 I152	M64-L148 HydrophobicContact CG-CD1 4.2Å; M64-L148 HydrophobicContact CG-CD2 4.34Å; M64-L148 HydrophobicContact SD-CB 4.06Å; M64-L148 HydrophobicContact SD-CD1 4.01Å; M64-L148 HydrophobicContact SD-CD2 3.8Å; M64-L148 HydrophobicContact SD-CG 4.16Å; M89-L148 HydrophobicContact CE-CD2 4.06Å; M89-L148 HydrophobicContact SD-CD2 3.82Å; I96-L148 HydrophobicContact CG2-CD2 4.2Å; F98-L148 HydrophobicContact CE1-CD2 4Å; F98-L148 HydrophobicContact CZ-CD2 3.71Å; L123-L148 HydrophobicContact CD1-CD1 3.89Å; L123-L148 HydrophobicContact CD2-CD1 3.9Å; L144-L148 PolarHBondContact O-N 2.71Å; V145-L148 PolarHBondContact O-N 3.37Å; L148-R150 VanDerWaalsContact C-N 3.31Å; L148-R150 PolarHBondContact O-N 2.88Å; L148-Q151 CarbonylContact O-C 3.6Å; L148-Q151 PolarHBondContact O-N 3.09Å; L148-Q151 VanDerWaalsContact O-N 3.08Å; L148-I152 HydrophobicContact CD1-CD1 4.37Å; L148-I152 HydrophobicContact CD1-CG1 4.38Å; L148-I152 HydrophobicContact CG-CD1 3.96Å; L148-I152 HydrophobicContact CG-CG1 4.47Å; L148-I152 WeakPolarHBondContact O-CG1 3.24Å; L148-I152 PolarHBondContact O-N 3.14Å
149	R	98.2	Very high	97.7	Very high	63 Å²	63	51.4 Å²	51.4	24%	0.238	26%	0.259	C	S	.	.	H	α-helix	trans	-57.1	-42.8	174	-74.5	178.4	73.2	89.2	1.2	111.9	M89 V145 I152 S153 K196 D197	M89-R149 HydrophobicContact CE-CG 4.46Å; V145-R149 HydrophobicContact CG1-CG 4.39Å; V145-R149 WeakPolarHBondContact O-CB 3.17Å; V145-R149 WeakPolarHBondContact O-CG 3.18Å; V145-R149 PolarHBondContact O-N 3.43Å; R149-I152 PolarHBondContact O-N 2.66Å; R149-S153 PolarHBondContact O-N 2.97Å; R149-S153 VanDerWaalsContact O-N 3.1Å; R149-K196 HydrophobicContact CB-CB 4.16Å; R149-K196 HydrophobicContact CB-CG 4.4Å; R149-K196 HydrophobicContact CG-CB 4.44Å; R149-D197 IonicContact CZ-OD1 2.83Å; R149-D197 IonicContact CZ-OD2 2.82Å; R149-D197 IonicContact NH1-OD1 2.69Å; R149-D197 PolarHBondContact NH1-OD1 3.43Å; R149-D197 IonicContact NH1-OD2 3.64Å; R149-D197 IonicContact NH2-OD1 3.59Å; R149-D197 PolarHBondContact NH2-OD1 2.88Å; R149-D197 IonicContact NH2-OD2 3.57Å; R149-D197 PolarHBondContact NH2-OD2 3.04Å
150	R	97.7	Very high	97.8	Very high	156 Å²	156	52 Å²	52	59%	0.589	26%	0.259	S	S	*	.	H	α-helix	trans	-62	-41.9	173.8	-73.2	171	177.9	-175.3	-1.1	112	V146 W147 L148 S153 Q154	V146-R150 VanDerWaalsContact O-CG 3.3Å; V146-R150 WeakPolarHBondContact O-CG 3.4Å; V146-R150 PolarHBondContact O-N 2.73Å; V146-R150 VanDerWaalsContact O-N 3.07Å; W147-R150 WeakPolarHBondContact O-CB 3.32Å; W147-R150 PolarHBondContact O-N 2.8Å; L148-R150 VanDerWaalsContact C-N 3.31Å; L148-R150 PolarHBondContact O-N 2.88Å; R150-S153 PolarHBondContact O-N 2.74Å; R150-Q154 WeakPolarHBondContact O-CB 3.36Å; R150-Q154 VanDerWaalsContact O-CG 3.3Å; R150-Q154 WeakPolarHBondContact O-CG 3.41Å; R150-Q154 PolarHBondContact O-N 2.93Å
151	Q	97.9	Very high	97.7	Very high	25 Å²	25	49.4 Å²	49.4	12%	0.117	25%	0.25	C	C	.	.	H	α-helix	trans	-65.9	-34.4	175.4	-65.6	-52.4	-78.3	0	0	113.3	L123 W147 L148 K155	L123-Q151 HydrophobicContact CD2-CB 3.52Å; L123-Q151 HydrophobicContact CD2-CG 3.81Å; W147-Q151 HydrophobicContact CD2-CG 4.05Å; W147-Q151 HydrophobicContact CE3-CG 4.07Å; W147-Q151 HydrophobicContact CH2-CG 3.79Å; W147-Q151 HydrophobicContact CZ2-CG 3.76Å; W147-Q151 HydrophobicContact CZ3-CG 3.93Å; W147-Q151 WeakPolarHBondContact O-CG 3.43Å; W147-Q151 PolarHBondContact O-N 3.29Å; L148-Q151 CarbonylContact O-C 3.6Å; L148-Q151 PolarHBondContact O-N 3.09Å; L148-Q151 VanDerWaalsContact O-N 3.08Å; Q151-K155 WeakPolarHBondContact O-CG 3.29Å; Q151-K155 PolarHBondContact O-N 3.25Å
152	I	98.1	Very high	97.5	Very high	7 Å²	7	48.9 Å²	48.9	4%	0.036	25%	0.246	C	C	.	.	H	α-helix	trans	-63.8	-48.2	175.1	-68.3	159.7	0	0	0	110.5	F62 I96 L148 R149 Q154 K155 P199	F62-I152 HydrophobicContact CD1-CG1 3.94Å; F62-I152 HydrophobicContact CD2-CG1 4.15Å; F62-I152 HydrophobicContact CE1-CB 4.28Å; F62-I152 HydrophobicContact CE1-CG1 3.85Å; F62-I152 HydrophobicContact CE2-CG1 4.06Å; F62-I152 HydrophobicContact CE2-CG2 4.25Å; F62-I152 HydrophobicContact CG-CG1 4.09Å; F62-I152 HydrophobicContact CZ-CB 4.11Å; F62-I152 HydrophobicContact CZ-CG1 3.92Å; F62-I152 HydrophobicContact CZ-CG2 4.12Å; I96-I152 HydrophobicContact CG2-CD1 4.11Å; L148-I152 HydrophobicContact CD1-CD1 4.37Å; L148-I152 HydrophobicContact CD1-CG1 4.38Å; L148-I152 HydrophobicContact CG-CD1 3.96Å; L148-I152 HydrophobicContact CG-CG1 4.47Å; L148-I152 WeakPolarHBondContact O-CG1 3.24Å; L148-I152 PolarHBondContact O-N 3.14Å; R149-I152 PolarHBondContact O-N 2.66Å; I152-Q154 PolarHBondContact O-N 3.1Å; I152-K155 PolarHBondContact O-N 2.98Å; I152-K155 VanDerWaalsContact O-N 3.1Å; I152-P199 HydrophobicContact CD1-CB 3.83Å; I152-P199 HydrophobicContact CD1-CG 4.11Å; I152-P199 HydrophobicContact CG1-CB 4.06Å; I152-P199 HydrophobicContact CG2-CB 3.99Å
153	S	97.3	Very high	97.4	Very high	11 Å²	11	48.8 Å²	48.8	8%	0.077	24%	0.24	C	C	.	.	H	α-helix	trans	-59.9	-45	176.4	-179.2	0	0	0	0	112.5	R149 R150 K155 A156 Y192	R149-S153 PolarHBondContact O-N 2.97Å; R149-S153 VanDerWaalsContact O-N 3.1Å; R150-S153 PolarHBondContact O-N 2.74Å; S153-K155 PolarHBondContact O-N 2.98Å; S153-A156 PolarHBondContact O-N 2.64Å; S153-A156 VanDerWaalsContact O-N 3.12Å; S153-Y192 WeakPolarHBondContact CB-O 3.44Å; S153-Y192 PolarHBondContact OG-O 2.87Å
154	Q	95.3	Very high	97.3	Very high	131 Å²	131	51 Å²	51	61%	0.612	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.5	3.6	176	-69.9	175.7	-17.6	0	0	114.5	R150 I152	R150-Q154 WeakPolarHBondContact O-CB 3.36Å; R150-Q154 VanDerWaalsContact O-CG 3.3Å; R150-Q154 WeakPolarHBondContact O-CG 3.41Å; R150-Q154 PolarHBondContact O-N 2.93Å; I152-Q154 PolarHBondContact O-N 3.1Å
155	K	97.4	Very high	97.2	Very high	73 Å²	73	50.9 Å²	50.9	32%	0.317	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-114.5	21.9	171.4	-67.8	-61.7	-175.5	-172.5	0	113.3	F62 F125 Q151 I152 S153	F62-K155 HydrophobicContact CE1-CB 3.91Å; F62-K155 HydrophobicContact CE1-CG 3.93Å; F62-K155 HydrophobicContact CZ-CB 3.89Å; F62-K155 HydrophobicContact CZ-CG 4.42Å; F125-K155 HydrophobicContact CD1-CD 4Å; F125-K155 HydrophobicContact CD1-CG 4.49Å; F125-K155 HydrophobicContact CD2-CB 4.17Å; F125-K155 HydrophobicContact CD2-CD 4.3Å; F125-K155 HydrophobicContact CD2-CG 3.91Å; F125-K155 HydrophobicContact CE1-CD 4.01Å; F125-K155 HydrophobicContact CE1-CG 4.47Å; F125-K155 HydrophobicContact CE2-CB 3.64Å; F125-K155 HydrophobicContact CE2-CD 4.31Å; F125-K155 HydrophobicContact CE2-CG 3.89Å; F125-K155 HydrophobicContact CG-CD 4.14Å; F125-K155 HydrophobicContact CG-CG 4.21Å; F125-K155 HydrophobicContact CZ-CB 3.86Å; F125-K155 HydrophobicContact CZ-CD 4.16Å; F125-K155 HydrophobicContact CZ-CG 4.17Å; Q151-K155 WeakPolarHBondContact O-CG 3.29Å; Q151-K155 PolarHBondContact O-N 3.25Å; I152-K155 PolarHBondContact O-N 2.98Å; I152-K155 VanDerWaalsContact O-N 3.1Å; S153-K155 PolarHBondContact O-N 2.98Å
156	A	97.6	Very high	97.1	Very high	16 Å²	16	51.1 Å²	51.1	13%	0.132	25%	0.248	C	C	.	.	S	Bend	trans	-67.6	134.1	150.4	0	0	0	0	0	109.6	S153 L158 Y192 I195 F203 V205	S153-A156 PolarHBondContact O-N 2.64Å; S153-A156 VanDerWaalsContact O-N 3.12Å; A156-L158 PolarHBondContact O-N 3.45Å; A156-Y192 HydrophobicContact CB-CE1 4.04Å; A156-I195 HydrophobicContact CB-CD1 3.77Å; A156-F203 WeakPolarHBondContact CA-O 3.34Å; A156-F203 HydrophobicContact CB-CB 4.19Å; A156-V205 HydrophobicContact CB-CG2 4.29Å
157	F	98	Very high	96.9	Very high	56 Å²	56	54.4 Å²	54.4	25%	0.246	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	113.7	-179.9	-68.5	-95.7	0	0	0	110.6	F125 F159 F168 T202 F203 G204 V205	F125-F157 AromaticContact CE1-CZ 3.91Å; F125-F157 HydrophobicContact CE1-CZ 3.91Å; F125-F157 HydrophobicContact CZ-CE2 4.06Å; F125-F157 AromaticContact CZ-CZ 3.91Å; F125-F157 HydrophobicContact CZ-CZ 3.91Å; F157-F159 HydrophobicContact CB-CE1 4.04Å; F157-F159 HydrophobicContact CB-CE2 4.42Å; F157-F159 HydrophobicContact CB-CZ 3.79Å; F157-F159 WeakPolarHBondContact O-CE2 3.41Å; F157-F168 HydrophobicContact CB-CE2 4.48Å; F157-F168 HydrophobicContact CB-CZ 4.24Å; F157-F168 AromaticContact CD1-CE2 3.76Å; F157-F168 HydrophobicContact CD1-CE2 3.76Å; F157-F168 AromaticContact CD1-CZ 3.99Å; F157-F168 HydrophobicContact CD1-CZ 3.99Å; F157-F168 HydrophobicContact CD2-CE1 4.25Å; F157-F168 HydrophobicContact CD2-CE2 4.12Å; F157-F168 AromaticContact CD2-CZ 3.47Å; F157-F168 HydrophobicContact CD2-CZ 3.47Å; F157-F168 VanDerWaalsContact CD2-CZ 3.47Å; F157-F168 AromaticContact CE1-CE2 3.92Å; F157-F168 HydrophobicContact CE1-CE2 3.92Å; F157-F168 HydrophobicContact CE1-CZ 4.17Å; F157-F168 HydrophobicContact CE2-CE2 4.26Å; F157-F168 AromaticContact CE2-CZ 3.68Å; F157-F168 HydrophobicContact CE2-CZ 3.68Å; F157-F168 HydrophobicContact CG-CE1 4.45Å; F157-F168 AromaticContact CG-CE2 3.87Å; F157-F168 HydrophobicContact CG-CE2 3.87Å; F157-F168 AromaticContact CG-CZ 3.63Å; F157-F168 HydrophobicContact CG-CZ 3.63Å; F157-F168 HydrophobicContact CZ-CE2 4.16Å; F157-F168 HydrophobicContact CZ-CZ 4.02Å; F157-T202 HydrophobicContact CD2-CG2 4.05Å; F157-T202 HydrophobicContact CE2-CG2 3.98Å; F157-F203 WeakPolarHBondContact CD2-O 3.43Å; F157-F203 PolarHBondContact N-O 3.02Å; F157-G204 CarbonylContact O-C 3.56Å; F157-G204 WeakPolarHBondContact O-CA 3.38Å; F157-V205 PolarHBondContact O-N 2.99Å
158	L	98.1	Very high	96.8	Very high	97 Å²	97	53.9 Å²	53.9	51%	0.508	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	132.1	172	179.3	63.2	0	0	0	110.1	A156 L183 V205	A156-L158 PolarHBondContact O-N 3.45Å; L158-L183 HydrophobicContact CD1-CD1 3.63Å; L158-V205 WeakPolarHBondContact CA-O 3.05Å
159	F	97.6	Very high	96.8	Very high	10 Å²	10	54 Å²	54	4%	0.044	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	138.5	176.9	-54.1	-66.1	0	0	0	111.9	F157 Q164 V165 F168 V177 V205 I206	F157-F159 HydrophobicContact CB-CE1 4.04Å; F157-F159 HydrophobicContact CB-CE2 4.42Å; F157-F159 HydrophobicContact CB-CZ 3.79Å; F157-F159 WeakPolarHBondContact O-CE2 3.41Å; F159-Q164 HydrophobicContact CB-CB 4.41Å; F159-Q164 HydrophobicContact CD1-CB 4.07Å; F159-V165 HydrophobicContact CB-CG2 3.8Å; F159-V165 HydrophobicContact CD2-CG2 3.64Å; F159-V165 HydrophobicContact CE2-CG2 4.34Å; F159-V165 HydrophobicContact CG-CG2 3.78Å; F159-F168 HydrophobicContact CE1-CB 3.76Å; F159-F168 HydrophobicContact CE1-CD1 4.11Å; F159-F168 HydrophobicContact CE1-CD2 4.01Å; F159-F168 AromaticContact CE1-CG 3.7Å; F159-F168 HydrophobicContact CE1-CG 3.7Å; F159-F168 HydrophobicContact CZ-CB 3.92Å; F159-F168 AromaticContact CZ-CD1 3.53Å; F159-F168 HydrophobicContact CZ-CD1 3.53Å; F159-F168 HydrophobicContact CZ-CD2 4.22Å; F159-F168 HydrophobicContact CZ-CE1 4.02Å; F159-F168 AromaticContact CZ-CG 3.63Å; F159-F168 HydrophobicContact CZ-CG 3.63Å; F159-V177 HydrophobicContact CD2-CG1 4.43Å; F159-V177 HydrophobicContact CE2-CG1 4.39Å; F159-V177 HydrophobicContact CE2-CG2 4.28Å; F159-V205 PolarHBondContact N-O 3.43Å; F159-I206 HydrophobicContact CB-CB 4.24Å; F159-I206 HydrophobicContact CB-CD1 4.12Å; F159-I206 HydrophobicContact CB-CG1 4.4Å
160	N	95.9	Very high	96.6	Very high	105 Å²	105	55.9 Å²	55.9	56%	0.561	28%	0.277	S	S	*	.	S	Bend	trans	-100.9	-7.8	-178.7	-63.5	-22	0	0	0	113.1
161	S	96.2	Very high	96.5	Very high	32 Å²	32	52.5 Å²	52.5	22%	0.224	28%	0.277	C	S	.	.	S	Bend	trans	-154.7	163.6	173.8	94.8	0	0	0	0	113.6	E163 Q164 V165 N210	S161-E163 VanDerWaalsContact CB-OE2 3.28Å; S161-E163 WeakPolarHBondContact CB-OE2 3.3Å; S161-E163 PolarHBondContact O-N 3.07Å; S161-E163 PolarHBondContact OG-N 2.8Å; S161-E163 PolarHBondContact OG-OE2 2.85Å; S161-Q164 PolarHBondContact O-N 2.98Å; S161-V165 PolarHBondContact O-N 3.1Å; S161-N210 CarbonylContact C-O 3.53Å; S161-N210 WeakPolarHBondContact CA-O 3.43Å
162	S	94.9	Very high	96.3	Very high	3 Å²	3	54 Å²	54	2%	0.021	28%	0.281	C	S	.	.	H	α-helix	trans	-63.5	-25.2	178.6	98.8	0	0	0	0	113.9	A166 N210 R214 F215	S162-A166 PolarHBondContact O-N 3.24Å; S162-A166 VanDerWaalsContact O-N 3.14Å; S162-N210 PolarHBondContact N-O 2.93Å; S162-N210 VanDerWaalsContact N-O 3.07Å; S162-R214 WeakPolarHBondContact OG-CD 3.24Å; S162-R214 VanDerWaalsContact OG-CG 3.23Å; S162-R214 WeakPolarHBondContact OG-CG 3.29Å; S162-R214 PolarHBondContact OG-NE 2.81Å; S162-F215 WeakPolarHBondContact O-CE2 3.12Å
163	E	94.9	Very high	96.1	Very high	75 Å²	75	58.2 Å²	58.2	35%	0.35	31%	0.31	S	S	.	.	H	α-helix	trans	-71.5	-47.7	177.4	-64.3	57.2	-127.3	0	0	110.3	S161 V165 A166 E167 R214	S161-E163 VanDerWaalsContact CB-OE2 3.28Å; S161-E163 WeakPolarHBondContact CB-OE2 3.3Å; S161-E163 PolarHBondContact O-N 3.07Å; S161-E163 PolarHBondContact OG-N 2.8Å; S161-E163 PolarHBondContact OG-OE2 2.85Å; E163-V165 VanDerWaalsContact C-N 3.27Å; E163-V165 PolarHBondContact O-N 3.1Å; E163-A166 WeakPolarHBondContact O-CB 3.48Å; E163-A166 PolarHBondContact O-N 3.17Å; E163-E167 WeakPolarHBondContact O-CG 3.48Å; E163-E167 PolarHBondContact O-N 3.14Å; E163-R214 IonicContact OE1-CZ 3.4Å; E163-R214 IonicContact OE1-NE 3.28Å; E163-R214 PolarHBondContact OE1-NE 3.48Å; E163-R214 IonicContact OE1-NH2 3.3Å; E163-R214 PolarHBondContact OE1-NH2 2.84Å
164	Q	96.2	Very high	96.1	Very high	81 Å²	81	59 Å²	59	38%	0.379	31%	0.313	S	S	.	.	H	α-helix	trans	-58.4	-41.2	177.7	-64.2	-176.2	-16.8	0	0	111.3	F159 S161 F168	F159-Q164 HydrophobicContact CB-CB 4.41Å; F159-Q164 HydrophobicContact CD1-CB 4.07Å; S161-Q164 PolarHBondContact O-N 2.98Å; Q164-F168 WeakPolarHBondContact O-CB 3.28Å; Q164-F168 PolarHBondContact O-N 3.28Å
165	V	97	Very high	96.2	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-59.4	-52.1	172.1	-180	0	0	0	0	110.1	F159 S161 E163 E167 F168 V169 V177 I206 F215 F225	F159-V165 HydrophobicContact CB-CG2 3.8Å; F159-V165 HydrophobicContact CD2-CG2 3.64Å; F159-V165 HydrophobicContact CE2-CG2 4.34Å; F159-V165 HydrophobicContact CG-CG2 3.78Å; S161-V165 PolarHBondContact O-N 3.1Å; E163-V165 VanDerWaalsContact C-N 3.27Å; E163-V165 PolarHBondContact O-N 3.1Å; V165-E167 VanDerWaalsContact C-N 3.35Å; V165-E167 PolarHBondContact O-N 3.37Å; V165-F168 PolarHBondContact O-N 2.87Å; V165-V169 HydrophobicContact CG1-CG1 4.03Å; V165-V169 VanDerWaalsContact O-CG1 3.31Å; V165-V169 WeakPolarHBondContact O-CG1 3.44Å; V165-V169 VanDerWaalsContact O-CG2 3.28Å; V165-V169 WeakPolarHBondContact O-CG2 3.34Å; V165-V169 PolarHBondContact O-N 2.99Å; V165-V177 HydrophobicContact CG1-CG2 4.43Å; V165-I206 HydrophobicContact CG2-CB 4.43Å; V165-I206 HydrophobicContact CG2-CD1 3.63Å; V165-I206 HydrophobicContact CG2-CG2 4.37Å; V165-F215 HydrophobicContact CB-CE2 3.79Å; V165-F215 HydrophobicContact CB-CZ 3.87Å; V165-F215 HydrophobicContact CG1-CE1 4.37Å; V165-F215 HydrophobicContact CG1-CE2 3.73Å; V165-F215 HydrophobicContact CG1-CZ 3.59Å; V165-F215 HydrophobicContact CG2-CE2 4.49Å; V165-F225 HydrophobicContact CG1-CE2 4.46Å; V165-F225 HydrophobicContact CG1-CZ 4.29Å
166	A	94.9	Very high	96.3	Very high	21 Å²	21	49.2 Å²	49.2	17%	0.174	27%	0.268	C	S	.	.	H	α-helix	trans	-61	-39.4	-175.8	0	0	0	0	0	113.4	S162 E163 T170 R214 F215	S162-A166 PolarHBondContact O-N 3.24Å; S162-A166 VanDerWaalsContact O-N 3.14Å; E163-A166 WeakPolarHBondContact O-CB 3.48Å; E163-A166 PolarHBondContact O-N 3.17Å; A166-T170 WeakPolarHBondContact O-CB 3.18Å; A166-T170 PolarHBondContact O-N 3.16Å; A166-T170 PolarHBondContact O-OG1 3.08Å; A166-R214 VanDerWaalsContact CB-NH1 3.33Å; A166-F215 HydrophobicContact CB-CZ 4.12Å
167	E	95.4	Very high	96.3	Very high	139 Å²	139	48.5 Å²	48.5	65%	0.65	26%	0.262	S	S	*	.	H	α-helix	trans	-66.7	-50.1	174.3	-70.5	171.3	-168.2	0	0	110.9	E163 V165 V169 T170 S171	E163-E167 WeakPolarHBondContact O-CG 3.48Å; E163-E167 PolarHBondContact O-N 3.14Å; V165-E167 VanDerWaalsContact C-N 3.35Å; V165-E167 PolarHBondContact O-N 3.37Å; E167-V169 PolarHBondContact O-N 3.03Å; E167-T170 WeakPolarHBondContact O-CB 3.4Å; E167-T170 PolarHBondContact O-N 3.39Å; E167-T170 VanDerWaalsContact O-N 3.14Å; E167-S171 PolarHBondContact O-N 3.35Å
168	F	96.9	Very high	96.3	Very high	30 Å²	30	45.8 Å²	45.8	13%	0.132	25%	0.25	C	S	.	.	H	α-helix	trans	-63.7	-43.5	-176.9	-171.2	-88.8	0	0	0	112.9	F157 F159 Q164 V165 T170 S171 R172 V175 T202	F157-F168 HydrophobicContact CB-CE2 4.48Å; F157-F168 HydrophobicContact CB-CZ 4.24Å; F157-F168 AromaticContact CD1-CE2 3.76Å; F157-F168 HydrophobicContact CD1-CE2 3.76Å; F157-F168 AromaticContact CD1-CZ 3.99Å; F157-F168 HydrophobicContact CD1-CZ 3.99Å; F157-F168 HydrophobicContact CD2-CE1 4.25Å; F157-F168 HydrophobicContact CD2-CE2 4.12Å; F157-F168 AromaticContact CD2-CZ 3.47Å; F157-F168 HydrophobicContact CD2-CZ 3.47Å; F157-F168 VanDerWaalsContact CD2-CZ 3.47Å; F157-F168 AromaticContact CE1-CE2 3.92Å; F157-F168 HydrophobicContact CE1-CE2 3.92Å; F157-F168 HydrophobicContact CE1-CZ 4.17Å; F157-F168 HydrophobicContact CE2-CE2 4.26Å; F157-F168 AromaticContact CE2-CZ 3.68Å; F157-F168 HydrophobicContact CE2-CZ 3.68Å; F157-F168 HydrophobicContact CG-CE1 4.45Å; F157-F168 AromaticContact CG-CE2 3.87Å; F157-F168 HydrophobicContact CG-CE2 3.87Å; F157-F168 AromaticContact CG-CZ 3.63Å; F157-F168 HydrophobicContact CG-CZ 3.63Å; F157-F168 HydrophobicContact CZ-CE2 4.16Å; F157-F168 HydrophobicContact CZ-CZ 4.02Å; F159-F168 HydrophobicContact CE1-CB 3.76Å; F159-F168 HydrophobicContact CE1-CD1 4.11Å; F159-F168 HydrophobicContact CE1-CD2 4.01Å; F159-F168 AromaticContact CE1-CG 3.7Å; F159-F168 HydrophobicContact CE1-CG 3.7Å; F159-F168 HydrophobicContact CZ-CB 3.92Å; F159-F168 AromaticContact CZ-CD1 3.53Å; F159-F168 HydrophobicContact CZ-CD1 3.53Å; F159-F168 HydrophobicContact CZ-CD2 4.22Å; F159-F168 HydrophobicContact CZ-CE1 4.02Å; F159-F168 AromaticContact CZ-CG 3.63Å; F159-F168 HydrophobicContact CZ-CG 3.63Å; Q164-F168 WeakPolarHBondContact O-CB 3.28Å; Q164-F168 PolarHBondContact O-N 3.28Å; V165-F168 PolarHBondContact O-N 2.87Å; F168-T170 PolarHBondContact O-N 3.29Å; F168-S171 PolarHBondContact O-N 3.27Å; F168-S171 VanDerWaalsContact O-N 3.15Å; F168-S171 PolarHBondContact O-OG 2.89Å; F168-R172 VanDerWaalsContact CZ-NE 3.3Å; F168-R172 PolarHBondContact O-N 3.38Å; F168-V175 HydrophobicContact CD1-CG1 4.05Å; F168-V175 HydrophobicContact CD1-CG2 3.97Å; F168-V175 HydrophobicContact CE1-CG1 3.85Å; F168-V175 HydrophobicContact CE1-CG2 3.85Å; F168-T202 HydrophobicContact CE1-CG2 3.64Å; F168-T202 HydrophobicContact CZ-CG2 3.74Å
169	V	96.4	Very high	96.3	Very high	3 Å²	3	41.2 Å²	41.2	2%	0.018	23%	0.226	C	C	.	.	H	α-helix	trans	-70.6	-16.1	177.7	-56.4	0	0	0	0	113.4	V165 E167 V175 V177 F225 G228	V165-V169 HydrophobicContact CG1-CG1 4.03Å; V165-V169 VanDerWaalsContact O-CG1 3.31Å; V165-V169 WeakPolarHBondContact O-CG1 3.44Å; V165-V169 VanDerWaalsContact O-CG2 3.28Å; V165-V169 WeakPolarHBondContact O-CG2 3.34Å; V165-V169 PolarHBondContact O-N 2.99Å; E167-V169 PolarHBondContact O-N 3.03Å; V169-V175 HydrophobicContact CG1-CB 4.11Å; V169-V175 HydrophobicContact CG1-CG1 4.32Å; V169-V175 HydrophobicContact CG1-CG2 4.45Å; V169-V177 HydrophobicContact CG1-CG2 4.2Å; V169-F225 HydrophobicContact CB-CB 3.71Å; V169-F225 HydrophobicContact CB-CD1 3.93Å; V169-F225 HydrophobicContact CB-CD2 4.32Å; V169-F225 HydrophobicContact CB-CG 3.74Å; V169-F225 HydrophobicContact CG1-CB 3.89Å; V169-F225 HydrophobicContact CG1-CD1 4.02Å; V169-F225 HydrophobicContact CG1-CD2 3.63Å; V169-F225 HydrophobicContact CG1-CE1 4.45Å; V169-F225 HydrophobicContact CG1-CE2 4.09Å; V169-F225 HydrophobicContact CG1-CG 3.58Å; V169-F225 HydrophobicContact CG1-CZ 4.48Å; V169-F225 HydrophobicContact CG2-CB 4.35Å; V169-F225 HydrophobicContact CG2-CD1 3.68Å; V169-F225 HydrophobicContact CG2-CE1 4.12Å; V169-F225 HydrophobicContact CG2-CG 4.05Å; V169-G228 VanDerWaalsContact O-CA 3.3Å; V169-G228 WeakPolarHBondContact O-CA 3.48Å; V169-G228 PolarHBondContact O-N 3.31Å; V169-G228 VanDerWaalsContact O-N 3.09Å
170	T	94.8	Very high	96.4	Very high	102 Å²	102	40.7 Å²	40.7	63%	0.626	22%	0.224	S	C	*	.	H	α-helix	trans	-85.1	-33.6	171.4	-57.8	0	0	0	0	111.2	A166 E167 F168 R172	A166-T170 WeakPolarHBondContact O-CB 3.18Å; A166-T170 PolarHBondContact O-N 3.16Å; A166-T170 PolarHBondContact O-OG1 3.08Å; E167-T170 WeakPolarHBondContact O-CB 3.4Å; E167-T170 PolarHBondContact O-N 3.39Å; E167-T170 VanDerWaalsContact O-N 3.14Å; F168-T170 PolarHBondContact O-N 3.29Å; T170-R172 PolarHBondContact O-N 3.22Å
171	S	94.9	Very high	96.4	Very high	85 Å²	85	39.8 Å²	39.8	59%	0.594	22%	0.216	S	C	*	.	H	α-helix	trans	-66.9	-17.9	177.9	79.3	0	0	0	0	114.6	E167 F168	E167-S171 PolarHBondContact O-N 3.35Å; F168-S171 PolarHBondContact O-N 3.27Å; F168-S171 VanDerWaalsContact O-N 3.15Å; F168-S171 PolarHBondContact O-OG 2.89Å
172	R	94.8	Very high	96.4	Very high	56 Å²	56	42.1 Å²	42.1	21%	0.211	23%	0.226	C	C	.	.	S	Bend	trans	-127.5	148.8	-171.8	-71.6	179.9	-172	-125.2	-6.7	112.8	E126 F168 T170 L174 V175 T202	E126-R172 VanDerWaalsContact CD-NH1 3.3Å; E126-R172 IonicContact OE1-CZ 3.12Å; E126-R172 IonicContact OE1-NH1 3.8Å; E126-R172 PolarHBondContact OE1-NH1 2.85Å; E126-R172 IonicContact OE1-NH2 3.74Å; E126-R172 IonicContact OE2-CZ 3.38Å; E126-R172 IonicContact OE2-NH1 2.71Å; E126-R172 PolarHBondContact OE2-NH1 3.23Å; E126-R172 VanDerWaalsContact OE2-NH1 3.15Å; E126-R172 IonicContact OE2-NH2 3.39Å; E126-R172 PolarHBondContact OE2-NH2 2.94Å; F168-R172 VanDerWaalsContact CZ-NE 3.3Å; F168-R172 PolarHBondContact O-N 3.38Å; T170-R172 PolarHBondContact O-N 3.22Å; R172-L174 VanDerWaalsContact C-N 3.32Å; R172-L174 PolarHBondContact O-N 3.18Å; R172-V175 HydrophobicContact CB-CG2 3.68Å; R172-V175 HydrophobicContact CG-CG2 4.45Å; R172-T202 PolarHBondContact NH1-OG1 2.88Å
173	P	93.5	Very high	96.5	Very high	97 Å²	97	43.6 Å²	43.6	63%	0.63	23%	0.234	S	C	*	.	S	Bend	trans	-70.3	-27.8	-178.3	28.7	-35.3	0	0	0	113.2	K226 K227	P173-K226 CarbonylContact O-C 3.55Å; P173-K226 WeakPolarHBondContact O-CA 3.29Å; P173-K227 PolarHBondContact O-N 2.68Å
174	L	96.9	Very high	96.5	Very high	26 Å²	26	48.5 Å²	48.5	14%	0.136	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	135.8	173.5	-169.3	149.1	0	0	0	110.5	R172 I176 L201 V224 F225 K226 H253	R172-L174 VanDerWaalsContact C-N 3.32Å; R172-L174 PolarHBondContact O-N 3.18Å; L174-I176 HydrophobicContact CD2-CD1 4.49Å; L174-I176 HydrophobicContact CD2-CG1 3.97Å; L174-L201 HydrophobicContact CD2-CD2 4.28Å; L174-V224 HydrophobicContact CD1-CG1 4.4Å; L174-V224 HydrophobicContact CD2-CG1 4.34Å; L174-V224 HydrophobicContact CG-CG1 4.26Å; L174-F225 CarbonylContact C-O 3.51Å; L174-F225 VanDerWaalsContact CA-O 3.27Å; L174-F225 WeakPolarHBondContact CA-O 3.47Å; L174-K226 HydrophobicContact CD1-CD 4.42Å; L174-K226 HydrophobicContact CD1-CG 4.45Å; L174-H253 HydrophobicContact CD1-CB 3.91Å
175	V	98.1	Very high	96.4	Very high	0 Å²	0	49 Å²	49	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	138.6	172	-175.2	0	0	0	0	108.8	F168 V169 R172 V177 T202 F225	F168-V175 HydrophobicContact CD1-CG1 4.05Å; F168-V175 HydrophobicContact CD1-CG2 3.97Å; F168-V175 HydrophobicContact CE1-CG1 3.85Å; F168-V175 HydrophobicContact CE1-CG2 3.85Å; V169-V175 HydrophobicContact CG1-CB 4.11Å; V169-V175 HydrophobicContact CG1-CG1 4.32Å; V169-V175 HydrophobicContact CG1-CG2 4.45Å; R172-V175 HydrophobicContact CB-CG2 3.68Å; R172-V175 HydrophobicContact CG-CG2 4.45Å; V175-V177 HydrophobicContact CG1-CG2 3.77Å; V175-T202 WeakPolarHBondContact CA-O 3.38Å; V175-T202 HydrophobicContact CG1-CG2 4.31Å; V175-T202 HydrophobicContact CG2-CG2 4.41Å; V175-F225 PolarHBondContact N-O 2.91Å; V175-F225 PolarHBondContact O-N 3.42Å
176	I	98.6	Very high	96.4	Very high	0 Å²	0	56.6 Å²	56.6	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	123.2	171.1	-54.6	-172.9	0	0	0	107.8	L174 L201 T202 F203 G204 V224 I250	L174-I176 HydrophobicContact CD2-CD1 4.49Å; L174-I176 HydrophobicContact CD2-CG1 3.97Å; I176-L201 HydrophobicContact CD1-CD1 4.09Å; I176-T202 PolarHBondContact N-O 3Å; I176-F203 HydrophobicContact CB-CD1 3.7Å; I176-F203 HydrophobicContact CB-CE1 3.78Å; I176-F203 HydrophobicContact CD1-CE1 3.86Å; I176-F203 HydrophobicContact CD1-CZ 4.39Å; I176-F203 HydrophobicContact CG1-CE1 4.24Å; I176-F203 HydrophobicContact CG2-CD1 4Å; I176-F203 HydrophobicContact CG2-CE1 3.97Å; I176-F203 CarbonylContact O-C 3.59Å; I176-F203 VanDerWaalsContact O-CA 3.24Å; I176-F203 WeakPolarHBondContact O-CA 3.29Å; I176-G204 PolarHBondContact O-N 3.33Å; I176-V224 HydrophobicContact CD1-CG2 4.3Å; I176-V224 HydrophobicContact CG1-CG1 4.17Å; I176-V224 HydrophobicContact CG1-CG2 4.09Å; I176-V224 HydrophobicContact CG2-CG2 4.34Å; I176-I250 HydrophobicContact CD1-CB 4.48Å; I176-I250 HydrophobicContact CD1-CG1 4Å; I176-I250 HydrophobicContact CD1-CG2 4.47Å
177	V	98.6	Very high	96.5	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	124	-178	-175.2	0	0	0	0	109.7	F159 V165 V169 V175 F179 G204 I206 I222 L223 F225	F159-V177 HydrophobicContact CD2-CG1 4.43Å; F159-V177 HydrophobicContact CE2-CG1 4.39Å; F159-V177 HydrophobicContact CE2-CG2 4.28Å; V165-V177 HydrophobicContact CG1-CG2 4.43Å; V169-V177 HydrophobicContact CG1-CG2 4.2Å; V175-V177 HydrophobicContact CG1-CG2 3.77Å; V177-F179 HydrophobicContact CB-CD2 4.4Å; V177-F179 HydrophobicContact CB-CE2 3.78Å; V177-F179 HydrophobicContact CG1-CD2 4.04Å; V177-F179 HydrophobicContact CG1-CE2 3.57Å; V177-F179 HydrophobicContact CG1-CZ 4.05Å; V177-F179 WeakPolarHBondContact O-CD2 3.48Å; V177-G204 WeakPolarHBondContact CA-O 3.12Å; V177-I206 HydrophobicContact CG1-CG2 4Å; V177-I222 WeakPolarHBondContact O-CA 3.31Å; V177-L223 PolarHBondContact N-O 3.34Å; V177-L223 PolarHBondContact O-N 2.89Å; V177-F225 HydrophobicContact CB-CE2 4.07Å; V177-F225 HydrophobicContact CG2-CD2 4.02Å; V177-F225 HydrophobicContact CG2-CE2 3.91Å
178	G	98.4	Very high	96.6	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	133.8	167	0	0	0	0	0	110.9	G204 V205 I206	G178-G204 PolarHBondContact N-O 2.97Å; G178-V205 CarbonylContact O-C 3.57Å; G178-V205 WeakPolarHBondContact O-CA 3.13Å; G178-I206 PolarHBondContact O-N 2.98Å
179	F	98.3	Very high	96.6	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	115	175.2	-69	-106.7	0	0	0	106.7	V177 I206 I208 A211 F215 V217 D220 S221 L223 F225	V177-F179 HydrophobicContact CB-CD2 4.4Å; V177-F179 HydrophobicContact CB-CE2 3.78Å; V177-F179 HydrophobicContact CG1-CD2 4.04Å; V177-F179 HydrophobicContact CG1-CE2 3.57Å; V177-F179 HydrophobicContact CG1-CZ 4.05Å; V177-F179 WeakPolarHBondContact O-CD2 3.48Å; F179-I206 WeakPolarHBondContact CA-O 3.39Å; F179-I206 HydrophobicContact CD1-CG2 3.38Å; F179-I206 HydrophobicContact CD2-CG2 4.31Å; F179-I206 HydrophobicContact CE1-CG2 3.5Å; F179-I206 HydrophobicContact CE2-CG2 4.4Å; F179-I206 HydrophobicContact CG-CG2 3.81Å; F179-I206 HydrophobicContact CZ-CG2 4.02Å; F179-I208 HydrophobicContact CB-CG1 3.99Å; F179-A211 HydrophobicContact CD1-CB 3.84Å; F179-A211 HydrophobicContact CE1-CB 3.76Å; F179-F215 HydrophobicContact CE1-CB 4.38Å; F179-F215 AromaticContact CE1-CD2 3.95Å; F179-F215 HydrophobicContact CE1-CD2 3.95Å; F179-F215 HydrophobicContact CE1-CG 4.4Å; F179-F215 HydrophobicContact CZ-CB 4.39Å; F179-F215 HydrophobicContact CZ-CD2 4.03Å; F179-F215 HydrophobicContact CZ-CG 4.23Å; F179-V217 HydrophobicContact CB-CG1 3.76Å; F179-V217 HydrophobicContact CD1-CB 4.13Å; F179-V217 HydrophobicContact CD1-CG1 4.3Å; F179-V217 HydrophobicContact CD1-CG2 4.04Å; F179-V217 HydrophobicContact CE1-CG2 4.27Å; F179-V217 HydrophobicContact CG-CB 4.4Å; F179-V217 HydrophobicContact CG-CG1 4.13Å; F179-V217 HydrophobicContact CG-CG2 4.21Å; F179-D220 WeakPolarHBondContact O-CA 3.41Å; F179-S221 PolarHBondContact N-O 3.23Å; F179-S221 PolarHBondContact O-N 3.44Å; F179-L223 HydrophobicContact CD2-CB 4.47Å; F179-L223 HydrophobicContact CD2-CD1 4.26Å; F179-L223 HydrophobicContact CD2-CG 4.02Å; F179-L223 HydrophobicContact CE2-CB 3.91Å; F179-L223 HydrophobicContact CE2-CD1 3.6Å; F179-L223 HydrophobicContact CE2-CG 3.69Å; F179-L223 HydrophobicContact CZ-CD1 3.85Å; F179-L223 HydrophobicContact CZ-CG 4.44Å; F179-F225 HydrophobicContact CE2-CE2 4.34Å; F179-F225 HydrophobicContact CZ-CZ 4.44Å
180	F	98.1	Very high	96.7	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	154.3	-175	-52.6	-64.9	0	0	0	112.1	D182 L183 V187 A188 F191 V205 I206 T207 I208 D220 L236	F180-D182 VanDerWaalsContact CB-O 3.24Å; F180-D182 WeakPolarHBondContact CB-O 3.41Å; F180-L183 HydrophobicContact CB-CD2 4.21Å; F180-L183 HydrophobicContact CD2-CD2 4.21Å; F180-V187 HydrophobicContact CD1-CG1 3.97Å; F180-V187 HydrophobicContact CD1-CG2 4.36Å; F180-V187 HydrophobicContact CE1-CG2 4.13Å; F180-A188 HydrophobicContact CB-CB 4.34Å; F180-A188 HydrophobicContact CD2-CB 3.88Å; F180-A188 HydrophobicContact CE2-CB 4.35Å; F180-A188 HydrophobicContact CG-CB 3.99Å; F180-F191 HydrophobicContact CE1-CB 4.46Å; F180-F191 HydrophobicContact CE2-CB 3.98Å; F180-F191 HydrophobicContact CE2-CD1 4.06Å; F180-F191 HydrophobicContact CE2-CD2 4.4Å; F180-F191 AromaticContact CE2-CG 3.91Å; F180-F191 HydrophobicContact CE2-CG 3.91Å; F180-F191 HydrophobicContact CZ-CB 3.53Å; F180-F191 HydrophobicContact CZ-CD1 4.24Å; F180-F191 AromaticContact CZ-CD2 3.82Å; F180-F191 HydrophobicContact CZ-CD2 3.82Å; F180-F191 AromaticContact CZ-CG 3.61Å; F180-F191 HydrophobicContact CZ-CG 3.61Å; F180-V205 HydrophobicContact CD2-CG1 4.02Å; F180-V205 HydrophobicContact CE2-CG1 4.25Å; F180-I206 PolarHBondContact N-O 3.19Å; F180-T207 CarbonylContact O-C 3.49Å; F180-T207 WeakPolarHBondContact O-CA 3.48Å; F180-I208 PolarHBondContact O-N 3.41Å; F180-D220 WeakPolarHBondContact CA-OD1 3.38Å; F180-D220 HydrophobicContact CD1-CB 4.21Å; F180-L236 HydrophobicContact CE1-CD1 4.39Å
181	Q	96.9	Very high	96.9	Very high	85 Å²	85	51.4 Å²	51.4	40%	0.397	26%	0.262	S	S	.	.	S	Bend	trans	-68.4	-50	176.2	-55.2	-64.4	-0.8	0	0	111.1	T207 I208 T218 D220	Q181-T207 WeakPolarHBondContact O-CG2 3.47Å; Q181-I208 HydrophobicContact CG-CD1 4.28Å; Q181-T218 PolarHBondContact NE2-O 3.41Å; Q181-D220 WeakPolarHBondContact CG-OD2 3.23Å; Q181-D220 PolarHBondContact N-OD1 3.28Å
182	D	96.5	Very high	97.1	Very high	81 Å²	81	50 Å²	50	43%	0.433	24%	0.244	S	C	.	.			trans	-122.3	157.8	167.8	-156.2	-48.7	0	0	0	109.5	F180 E184 E185	F180-D182 VanDerWaalsContact CB-O 3.24Å; F180-D182 WeakPolarHBondContact CB-O 3.41Å; D182-E184 PolarHBondContact OD1-N 2.68Å; D182-E185 HydrophobicContact CB-CB 4.44Å; D182-E185 HydrophobicContact CB-CG 3.93Å
183	L	96.4	Very high	97.2	Very high	34 Å²	34	49.9 Å²	49.9	18%	0.178	25%	0.247	C	C	.	.	S	Bend	trans	-93.7	-13.1	176.5	-53.7	-169.5	0	0	0	112.7	L158 F180 A188 V205	L158-L183 HydrophobicContact CD1-CD1 3.63Å; F180-L183 HydrophobicContact CB-CD2 4.21Å; F180-L183 HydrophobicContact CD2-CD2 4.21Å; L183-A188 VanDerWaalsContact O-CB 3.32Å; L183-A188 WeakPolarHBondContact O-CB 3.48Å; L183-V205 HydrophobicContact CD1-CG1 4.15Å; L183-V205 HydrophobicContact CD2-CG1 3.5Å; L183-V205 HydrophobicContact CG-CG1 4.44Å
184	E	95.4	Very high	97.4	Very high	179 Å²	179	45.4 Å²	45.4	84%	0.836	22%	0.218	S	C	*	.	S	Bend	trans	-95.7	2.3	176.9	-53.2	-67.2	140.9	0	0	112.9	D182	D182-E184 PolarHBondContact OD1-N 2.68Å
185	E	94.3	Very high	97.5	Very high	90 Å²	90	44.3 Å²	44.3	42%	0.421	21%	0.212	S	C	.	.	S	Bend	trans	-80.1	155.9	176.8	-85.4	175.6	176.3	0	0	113.3	D182 V187 A188 E189	D182-E185 HydrophobicContact CB-CB 4.44Å; D182-E185 HydrophobicContact CB-CG 3.93Å; E185-V187 PolarHBondContact O-N 3.14Å; E185-V187 VanDerWaalsContact O-N 3.12Å; E185-A188 WeakPolarHBondContact O-CA 3.24Å; E185-A188 WeakPolarHBondContact O-CB 3.36Å; E185-A188 PolarHBondContact O-N 2.7Å; E185-E189 PolarHBondContact O-N 2.89Å
186	E	96.2	Very high	97.4	Very high	160 Å²	160	46.3 Å²	46.3	75%	0.748	22%	0.221	S	C	*	.	H	α-helix	trans	-56.4	-33.9	-174	-64.5	-169.7	-164.6	0	0	113.7	L190	E186-L190 WeakPolarHBondContact O-CB 3.32Å; E186-L190 PolarHBondContact O-N 2.95Å
187	V	97.1	Very high	97.3	Very high	12 Å²	12	49.2 Å²	49.2	7%	0.073	24%	0.237	C	C	.	.	H	α-helix	trans	-68.8	-33.3	176.8	67.3	0	0	0	0	112.5	F180 E185 F191 D220 L236	F180-V187 HydrophobicContact CD1-CG1 3.97Å; F180-V187 HydrophobicContact CD1-CG2 4.36Å; F180-V187 HydrophobicContact CE1-CG2 4.13Å; E185-V187 PolarHBondContact O-N 3.14Å; E185-V187 VanDerWaalsContact O-N 3.12Å; V187-F191 PolarHBondContact O-N 3.01Å; V187-F191 VanDerWaalsContact O-N 3.1Å; V187-D220 HydrophobicContact CG1-CB 4.17Å; V187-D220 HydrophobicContact CG2-CB 4.43Å; V187-L236 HydrophobicContact CG2-CB 3.7Å; V187-L236 HydrophobicContact CG2-CD1 4.26Å
188	A	97.7	Very high	97.2	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-76.8	-42.8	175.2	0	0	0	0	0	111	F180 L183 E185 L190 F191 Y192	F180-A188 HydrophobicContact CB-CB 4.34Å; F180-A188 HydrophobicContact CD2-CB 3.88Å; F180-A188 HydrophobicContact CE2-CB 4.35Å; F180-A188 HydrophobicContact CG-CB 3.99Å; L183-A188 VanDerWaalsContact O-CB 3.32Å; L183-A188 WeakPolarHBondContact O-CB 3.48Å; E185-A188 WeakPolarHBondContact O-CA 3.24Å; E185-A188 WeakPolarHBondContact O-CB 3.36Å; E185-A188 PolarHBondContact O-N 2.7Å; A188-L190 VanDerWaalsContact C-N 3.31Å; A188-L190 PolarHBondContact O-N 3.14Å; A188-F191 WeakPolarHBondContact O-CB 3.38Å; A188-F191 PolarHBondContact O-N 2.87Å; A188-F191 VanDerWaalsContact O-N 3.14Å; A188-Y192 VanDerWaalsContact O-CD2 3.24Å; A188-Y192 WeakPolarHBondContact O-CD2 3.24Å; A188-Y192 PolarHBondContact O-N 3.47Å
189	E	97.6	Very high	97.2	Very high	139 Å²	139	49.7 Å²	49.7	65%	0.65	24%	0.239	S	C	*	.	H	α-helix	trans	-59.2	-43.9	172.2	-171.8	-178.5	-169.8	0	0	110.9	E185 F191 Y192 D193	E185-E189 PolarHBondContact O-N 2.89Å; E189-F191 VanDerWaalsContact C-N 3.3Å; E189-F191 PolarHBondContact O-N 2.85Å; E189-Y192 CarbonylContact O-C 3.58Å; E189-Y192 PolarHBondContact O-N 2.91Å; E189-Y192 VanDerWaalsContact O-N 3.16Å; E189-D193 PolarHBondContact O-N 3.08Å
190	L	98.1	Very high	97.1	Very high	36 Å²	36	50.9 Å²	50.9	19%	0.188	24%	0.244	C	C	.	.	H	α-helix	trans	-58.1	-40.5	174.9	173.3	62.2	0	0	0	112.2	E186 A188 D193 V194 N242 K243	E186-L190 WeakPolarHBondContact O-CB 3.32Å; E186-L190 PolarHBondContact O-N 2.95Å; A188-L190 VanDerWaalsContact C-N 3.31Å; A188-L190 PolarHBondContact O-N 3.14Å; L190-D193 PolarHBondContact O-N 2.9Å; L190-V194 HydrophobicContact CD1-CG2 3.94Å; L190-V194 WeakPolarHBondContact O-CG2 3.37Å; L190-V194 PolarHBondContact O-N 3.4Å; L190-N242 HydrophobicContact CD2-CB 3.74Å; L190-K243 HydrophobicContact CD1-CB 3.89Å; L190-K243 HydrophobicContact CD1-CD 3.81Å; L190-K243 HydrophobicContact CD1-CG 3.89Å; L190-K243 HydrophobicContact CD2-CB 4.18Å
191	F	98.5	Very high	97.1	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-62.5	-51.8	172.7	-180	-89.8	0	0	0	111.1	F180 V187 A188 E189 D193 V194 I195 F203 V205 I222 L246	F180-F191 HydrophobicContact CE1-CB 4.46Å; F180-F191 HydrophobicContact CE2-CB 3.98Å; F180-F191 HydrophobicContact CE2-CD1 4.06Å; F180-F191 HydrophobicContact CE2-CD2 4.4Å; F180-F191 AromaticContact CE2-CG 3.91Å; F180-F191 HydrophobicContact CE2-CG 3.91Å; F180-F191 HydrophobicContact CZ-CB 3.53Å; F180-F191 HydrophobicContact CZ-CD1 4.24Å; F180-F191 AromaticContact CZ-CD2 3.82Å; F180-F191 HydrophobicContact CZ-CD2 3.82Å; F180-F191 AromaticContact CZ-CG 3.61Å; F180-F191 HydrophobicContact CZ-CG 3.61Å; V187-F191 PolarHBondContact O-N 3.01Å; V187-F191 VanDerWaalsContact O-N 3.1Å; A188-F191 WeakPolarHBondContact O-CB 3.38Å; A188-F191 PolarHBondContact O-N 2.87Å; A188-F191 VanDerWaalsContact O-N 3.14Å; E189-F191 VanDerWaalsContact C-N 3.3Å; E189-F191 PolarHBondContact O-N 2.85Å; F191-D193 PolarHBondContact O-N 2.73Å; F191-V194 PolarHBondContact O-N 2.92Å; F191-I195 HydrophobicContact CD1-CD1 4.46Å; F191-I195 HydrophobicContact CD1-CG2 4.23Å; F191-I195 HydrophobicContact CE1-CD1 4.21Å; F191-I195 HydrophobicContact CE1-CG2 3.94Å; F191-I195 HydrophobicContact CE2-CG2 4.26Å; F191-I195 HydrophobicContact CZ-CG2 3.97Å; F191-I195 WeakPolarHBondContact O-CG1 3.28Å; F191-I195 WeakPolarHBondContact O-CG2 3.49Å; F191-I195 PolarHBondContact O-N 2.89Å; F191-I195 VanDerWaalsContact O-N 3.09Å; F191-F203 HydrophobicContact CE2-CD1 4.35Å; F191-F203 HydrophobicContact CZ-CB 4.31Å; F191-F203 AromaticContact CZ-CD1 3.85Å; F191-F203 HydrophobicContact CZ-CD1 3.85Å; F191-F203 HydrophobicContact CZ-CG 4.46Å; F191-V205 HydrophobicContact CD1-CG2 3.93Å; F191-V205 HydrophobicContact CE1-CG2 3.5Å; F191-V205 VanDerWaalsContact CE1-CG2 3.5Å; F191-V205 HydrophobicContact CZ-CG2 4.41Å; F191-I222 HydrophobicContact CD2-CG2 3.89Å; F191-I222 HydrophobicContact CE2-CG2 3.77Å; F191-L246 HydrophobicContact CB-CD2 4.41Å; F191-L246 HydrophobicContact CD2-CD1 3.84Å; F191-L246 HydrophobicContact CD2-CD2 4.29Å; F191-L246 HydrophobicContact CE2-CD1 4.24Å
192	Y	98.4	Very high	97.1	Very high	56 Å²	56	47.9 Å²	47.9	22%	0.22	23%	0.232	C	C	.	.	H	α-helix	trans	-59.9	-26.9	176.9	-81	-70	0	0	0	113.2	S153 A156 A188 E189 I195 K196 V205	S153-Y192 WeakPolarHBondContact CB-O 3.44Å; S153-Y192 PolarHBondContact OG-O 2.87Å; A156-Y192 HydrophobicContact CB-CE1 4.04Å; A188-Y192 VanDerWaalsContact O-CD2 3.24Å; A188-Y192 WeakPolarHBondContact O-CD2 3.24Å; A188-Y192 PolarHBondContact O-N 3.47Å; E189-Y192 CarbonylContact O-C 3.58Å; E189-Y192 PolarHBondContact O-N 2.91Å; E189-Y192 VanDerWaalsContact O-N 3.16Å; Y192-I195 HydrophobicContact CD1-CD1 4.13Å; Y192-I195 WeakPolarHBondContact O-CG1 3.4Å; Y192-K196 VanDerWaalsContact O-CE 3.27Å; Y192-K196 WeakPolarHBondContact O-CE 3.28Å; Y192-V205 HydrophobicContact CE1-CG2 4.28Å; Y192-V205 HydrophobicContact CE2-CG2 4.34Å
193	D	97.9	Very high	97.2	Very high	53 Å²	53	44.4 Å²	44.4	28%	0.283	21%	0.213	S	C	.	.	H	α-helix	trans	-73.7	-53.1	171.4	-169.3	57.6	0	0	0	113.1	E189 L190 F191 I195 K196 K243	E189-D193 PolarHBondContact O-N 3.08Å; L190-D193 PolarHBondContact O-N 2.9Å; F191-D193 PolarHBondContact O-N 2.73Å; D193-I195 VanDerWaalsContact C-N 3.32Å; D193-I195 PolarHBondContact O-N 3.33Å; D193-K196 WeakPolarHBondContact O-CB 3.31Å; D193-K196 WeakPolarHBondContact O-CD 3.4Å; D193-K196 WeakPolarHBondContact O-CG 3.45Å; D193-K196 PolarHBondContact O-N 2.87Å; D193-K196 VanDerWaalsContact O-N 3.12Å; D193-K196 WeakPolarHBondContact OD1-CD 3.29Å; D193-K196 IonicContact OD1-NZ 3.24Å; D193-K196 PolarHBondContact OD1-NZ 3.35Å; D193-K243 IonicContact OD2-NZ 2.77Å
194	V	97.8	Very high	97.3	Very high	3 Å²	3	42.8 Å²	42.8	2%	0.018	20%	0.204	C	C	.	.	H	α-helix	trans	-66.1	-32.5	-174.1	171.5	0	0	0	0	112.3	L190 F191 K196 D197 F198 K243 L246 N247 I250	L190-V194 HydrophobicContact CD1-CG2 3.94Å; L190-V194 WeakPolarHBondContact O-CG2 3.37Å; L190-V194 PolarHBondContact O-N 3.4Å; F191-V194 PolarHBondContact O-N 2.92Å; V194-K196 PolarHBondContact O-N 2.99Å; V194-K196 VanDerWaalsContact O-N 3.16Å; V194-D197 PolarHBondContact O-N 3.44Å; V194-F198 HydrophobicContact CG1-CD2 4.43Å; V194-F198 HydrophobicContact CG1-CE2 3.81Å; V194-F198 VanDerWaalsContact O-CD2 3.24Å; V194-F198 WeakPolarHBondContact O-CD2 3.5Å; V194-F198 WeakPolarHBondContact O-CE2 3.5Å; V194-K243 HydrophobicContact CG2-CG 4.29Å; V194-L246 HydrophobicContact CB-CD2 3.69Å; V194-L246 HydrophobicContact CB-CG 4.32Å; V194-L246 HydrophobicContact CG1-CD2 3.91Å; V194-L246 HydrophobicContact CG1-CG 3.97Å; V194-L246 HydrophobicContact CG2-CD2 3.96Å; V194-N247 WeakPolarHBondContact CG1-ND2 3.42Å; V194-I250 HydrophobicContact CG1-CD1 4.03Å
195	I	97.8	Very high	97.4	Very high	2 Å²	2	34.3 Å²	34.3	1%	0.01	16%	0.164	C	C	.	.	G	3₁₀ helix	trans	-66.1	-15.4	177	65.9	174.7	0	0	0	114	A156 F191 Y192 D193 D197 F198 F203	A156-I195 HydrophobicContact CB-CD1 3.77Å; F191-I195 HydrophobicContact CD1-CD1 4.46Å; F191-I195 HydrophobicContact CD1-CG2 4.23Å; F191-I195 HydrophobicContact CE1-CD1 4.21Å; F191-I195 HydrophobicContact CE1-CG2 3.94Å; F191-I195 HydrophobicContact CE2-CG2 4.26Å; F191-I195 HydrophobicContact CZ-CG2 3.97Å; F191-I195 WeakPolarHBondContact O-CG1 3.28Å; F191-I195 WeakPolarHBondContact O-CG2 3.49Å; F191-I195 PolarHBondContact O-N 2.89Å; F191-I195 VanDerWaalsContact O-N 3.09Å; Y192-I195 HydrophobicContact CD1-CD1 4.13Å; Y192-I195 WeakPolarHBondContact O-CG1 3.4Å; D193-I195 VanDerWaalsContact C-N 3.32Å; D193-I195 PolarHBondContact O-N 3.33Å; I195-D197 PolarHBondContact O-N 3.32Å; I195-F198 PolarHBondContact O-N 3.2Å; I195-F198 VanDerWaalsContact O-N 3.14Å; I195-F203 HydrophobicContact CB-CD1 4.36Å; I195-F203 HydrophobicContact CB-CD2 3.79Å; I195-F203 HydrophobicContact CB-CE1 4.46Å; I195-F203 HydrophobicContact CB-CE2 3.9Å; I195-F203 HydrophobicContact CB-CG 4.03Å; I195-F203 HydrophobicContact CB-CZ 4.25Å; I195-F203 HydrophobicContact CD1-CB 4.38Å; I195-F203 HydrophobicContact CG2-CB 4.27Å; I195-F203 HydrophobicContact CG2-CD1 3.41Å; I195-F203 VanDerWaalsContact CG2-CD1 3.41Å; I195-F203 HydrophobicContact CG2-CD2 3.77Å; I195-F203 HydrophobicContact CG2-CE1 3.55Å; I195-F203 HydrophobicContact CG2-CE2 3.89Å; I195-F203 HydrophobicContact CG2-CG 3.53Å; I195-F203 HydrophobicContact CG2-CZ 3.79Å
196	K	97.8	Very high	97.6	Very high	42 Å²	42	30 Å²	30	18%	0.183	14%	0.144	C	C	.	.	G	3₁₀ helix	trans	-59.9	-25	175.3	-63.2	167.8	-170.3	156.3	0	112.2	R149 Y192 D193 V194	R149-K196 HydrophobicContact CB-CB 4.16Å; R149-K196 HydrophobicContact CB-CG 4.4Å; R149-K196 HydrophobicContact CG-CB 4.44Å; Y192-K196 VanDerWaalsContact O-CE 3.27Å; Y192-K196 WeakPolarHBondContact O-CE 3.28Å; D193-K196 WeakPolarHBondContact O-CB 3.31Å; D193-K196 WeakPolarHBondContact O-CD 3.4Å; D193-K196 WeakPolarHBondContact O-CG 3.45Å; D193-K196 PolarHBondContact O-N 2.87Å; D193-K196 VanDerWaalsContact O-N 3.12Å; D193-K196 WeakPolarHBondContact OD1-CD 3.29Å; D193-K196 IonicContact OD1-NZ 3.24Å; D193-K196 PolarHBondContact OD1-NZ 3.35Å; V194-K196 PolarHBondContact O-N 2.99Å; V194-K196 VanDerWaalsContact O-N 3.16Å
197	D	96.1	Very high	97.7	Very high	62 Å²	62	24.2 Å²	24.2	33%	0.332	12%	0.12	S	C	.	.	G	3₁₀ helix	trans	-87.1	-9	-179.7	-73.5	-65.3	0	0	0	114.4	K93 R149 V194 I195 P199	K93-D197 WeakPolarHBondContact CE-O 3.32Å; K93-D197 PolarHBondContact NZ-O 2.82Å; R149-D197 IonicContact CZ-OD1 2.83Å; R149-D197 IonicContact CZ-OD2 2.82Å; R149-D197 IonicContact NH1-OD1 2.69Å; R149-D197 PolarHBondContact NH1-OD1 3.43Å; R149-D197 IonicContact NH1-OD2 3.64Å; R149-D197 IonicContact NH2-OD1 3.59Å; R149-D197 PolarHBondContact NH2-OD1 2.88Å; R149-D197 IonicContact NH2-OD2 3.57Å; R149-D197 PolarHBondContact NH2-OD2 3.04Å; V194-D197 PolarHBondContact O-N 3.44Å; I195-D197 PolarHBondContact O-N 3.32Å; D197-P199 WeakPolarHBondContact O-CD 3.4Å
198	F	97	Very high	97.7	Very high	8 Å²	8	24.3 Å²	24.3	4%	0.035	12%	0.12	C	C	.	.			trans	-125.8	49.3	-170.9	-53.3	-70.2	0	0	0	114.6	V194 I195 E200 L201 F203 I250 K251 L254	V194-F198 HydrophobicContact CG1-CD2 4.43Å; V194-F198 HydrophobicContact CG1-CE2 3.81Å; V194-F198 VanDerWaalsContact O-CD2 3.24Å; V194-F198 WeakPolarHBondContact O-CD2 3.5Å; V194-F198 WeakPolarHBondContact O-CE2 3.5Å; I195-F198 PolarHBondContact O-N 3.2Å; I195-F198 VanDerWaalsContact O-N 3.14Å; F198-E200 VanDerWaalsContact CA-OE2 3.29Å; F198-E200 WeakPolarHBondContact CA-OE2 3.42Å; F198-E200 PolarHBondContact O-N 3.46Å; F198-L201 HydrophobicContact CB-CD1 4.47Å; F198-L201 PolarHBondContact O-N 3.25Å; F198-F203 HydrophobicContact CB-CE2 3.8Å; F198-F203 HydrophobicContact CB-CZ 3.86Å; F198-F203 WeakPolarHBondContact O-CE2 3.48Å; F198-I250 HydrophobicContact CB-CG2 4.22Å; F198-I250 HydrophobicContact CD1-CG2 3.84Å; F198-I250 HydrophobicContact CD2-CD1 4.12Å; F198-I250 HydrophobicContact CD2-CG2 3.62Å; F198-I250 HydrophobicContact CE1-CG2 4.06Å; F198-I250 HydrophobicContact CE2-CB 4.41Å; F198-I250 HydrophobicContact CE2-CD1 4.19Å; F198-I250 HydrophobicContact CE2-CG2 3.85Å; F198-I250 HydrophobicContact CG-CG2 3.6Å; F198-I250 HydrophobicContact CZ-CG2 4.07Å; F198-K251 HydrophobicContact CE1-CG 4.26Å; F198-K251 HydrophobicContact CZ-CG 4.29Å; F198-L254 HydrophobicContact CD1-CD1 3.75Å; F198-L254 HydrophobicContact CE1-CD1 3.71Å
199	P	97.4	Very high	97.5	Very high	1 Å²	1	26.4 Å²	26.4	1%	0.006	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-20.6	-178.8	22.7	-33.3	0	0	0	115.1	R61 F62 I96 I152 D197 L201	R61-P199 WeakPolarHBondContact CD-O 3.45Å; R61-P199 PolarHBondContact NH1-O 3.31Å; F62-P199 HydrophobicContact CD2-CB 3.63Å; F62-P199 HydrophobicContact CE2-CB 3.77Å; F62-P199 WeakPolarHBondContact CE2-O 3.28Å; I96-P199 HydrophobicContact CG2-CB 3.84Å; I96-P199 HydrophobicContact CG2-CG 3.7Å; I152-P199 HydrophobicContact CD1-CB 3.83Å; I152-P199 HydrophobicContact CD1-CG 4.11Å; I152-P199 HydrophobicContact CG1-CB 4.06Å; I152-P199 HydrophobicContact CG2-CB 3.99Å; D197-P199 WeakPolarHBondContact O-CD 3.4Å; P199-L201 VanDerWaalsContact C-N 3.32Å
200	E	96.3	Very high	97.3	Very high	26 Å²	26	23.2 Å²	23.2	12%	0.121	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-18.7	174.8	61.5	-93.1	-113.9	0	0	114.8	K93 N94 F198 L254 F257	K93-E200 IonicContact NZ-OE2 3.6Å; N94-E200 HydrophobicContact CB-CB 3.62Å; N94-E200 HydrophobicContact CB-CG 3.95Å; F198-E200 VanDerWaalsContact CA-OE2 3.29Å; F198-E200 WeakPolarHBondContact CA-OE2 3.42Å; F198-E200 PolarHBondContact O-N 3.46Å; E200-L254 HydrophobicContact CG-CD2 3.8Å; E200-F257 HydrophobicContact CB-CE1 4Å; E200-F257 HydrophobicContact CB-CZ 4.47Å; E200-F257 HydrophobicContact CG-CE1 4.24Å; E200-F257 HydrophobicContact CG-CZ 4.47Å
201	L	97.4	Very high	96.9	Very high	5 Å²	5	21.7 Å²	21.7	3%	0.026	12%	0.122	C	C	.	.	S	Bend	trans	-103.6	141.1	-178.8	-61.6	179.1	0	0	0	111.9	R61 L174 I176 F198 P199 F203 I250 L254 F257	R61-L201 PolarHBondContact NH1-O 3.01Å; L174-L201 HydrophobicContact CD2-CD2 4.28Å; I176-L201 HydrophobicContact CD1-CD1 4.09Å; F198-L201 HydrophobicContact CB-CD1 4.47Å; F198-L201 PolarHBondContact O-N 3.25Å; P199-L201 VanDerWaalsContact C-N 3.32Å; L201-F203 HydrophobicContact CB-CE2 3.76Å; L201-F203 HydrophobicContact CB-CZ 3.89Å; L201-F203 HydrophobicContact CD1-CZ 4.34Å; L201-F203 VanDerWaalsContact O-CD2 3.32Å; L201-F203 WeakPolarHBondContact O-CD2 3.34Å; L201-I250 HydrophobicContact CD1-CG2 3.63Å; L201-L254 HydrophobicContact CD1-CD2 3.7Å; L201-L254 HydrophobicContact CD1-CG 4.37Å; L201-L254 HydrophobicContact CD2-CD2 4.2Å; L201-L254 HydrophobicContact CG-CD2 3.9Å; L201-F257 HydrophobicContact CD2-CE2 4.05Å; L201-F257 HydrophobicContact CD2-CZ 4.08Å
202	T	98	Very high	96.1	Very high	17 Å²	17	28.1 Å²	28.1	10%	0.104	16%	0.155	C	C	.	.			trans	-83.1	119.4	175.6	-58.6	0	0	0	0	109.8	F157 F168 R172 V175 I176	F157-T202 HydrophobicContact CD2-CG2 4.05Å; F157-T202 HydrophobicContact CE2-CG2 3.98Å; F168-T202 HydrophobicContact CE1-CG2 3.64Å; F168-T202 HydrophobicContact CZ-CG2 3.74Å; R172-T202 PolarHBondContact NH1-OG1 2.88Å; V175-T202 WeakPolarHBondContact CA-O 3.38Å; V175-T202 HydrophobicContact CG1-CG2 4.31Å; V175-T202 HydrophobicContact CG2-CG2 4.41Å; I176-T202 PolarHBondContact N-O 3Å
203	F	98.6	Very high	95.2	Very high	8 Å²	8	29 Å²	29	4%	0.035	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	149.5	175.1	-64.1	-81.1	0	0	0	111.7	A156 F157 I176 F191 I195 F198 L201 I250	A156-F203 WeakPolarHBondContact CA-O 3.34Å; A156-F203 HydrophobicContact CB-CB 4.19Å; F157-F203 WeakPolarHBondContact CD2-O 3.43Å; F157-F203 PolarHBondContact N-O 3.02Å; I176-F203 HydrophobicContact CB-CD1 3.7Å; I176-F203 HydrophobicContact CB-CE1 3.78Å; I176-F203 HydrophobicContact CD1-CE1 3.86Å; I176-F203 HydrophobicContact CD1-CZ 4.39Å; I176-F203 HydrophobicContact CG1-CE1 4.24Å; I176-F203 HydrophobicContact CG2-CD1 4Å; I176-F203 HydrophobicContact CG2-CE1 3.97Å; I176-F203 CarbonylContact O-C 3.59Å; I176-F203 VanDerWaalsContact O-CA 3.24Å; I176-F203 WeakPolarHBondContact O-CA 3.29Å; F191-F203 HydrophobicContact CE2-CD1 4.35Å; F191-F203 HydrophobicContact CZ-CB 4.31Å; F191-F203 AromaticContact CZ-CD1 3.85Å; F191-F203 HydrophobicContact CZ-CD1 3.85Å; F191-F203 HydrophobicContact CZ-CG 4.46Å; I195-F203 HydrophobicContact CB-CD1 4.36Å; I195-F203 HydrophobicContact CB-CD2 3.79Å; I195-F203 HydrophobicContact CB-CE1 4.46Å; I195-F203 HydrophobicContact CB-CE2 3.9Å; I195-F203 HydrophobicContact CB-CG 4.03Å; I195-F203 HydrophobicContact CB-CZ 4.25Å; I195-F203 HydrophobicContact CD1-CB 4.38Å; I195-F203 HydrophobicContact CG2-CB 4.27Å; I195-F203 HydrophobicContact CG2-CD1 3.41Å; I195-F203 VanDerWaalsContact CG2-CD1 3.41Å; I195-F203 HydrophobicContact CG2-CD2 3.77Å; I195-F203 HydrophobicContact CG2-CE1 3.55Å; I195-F203 HydrophobicContact CG2-CE2 3.89Å; I195-F203 HydrophobicContact CG2-CG 3.53Å; I195-F203 HydrophobicContact CG2-CZ 3.79Å; F198-F203 HydrophobicContact CB-CE2 3.8Å; F198-F203 HydrophobicContact CB-CZ 3.86Å; F198-F203 WeakPolarHBondContact O-CE2 3.48Å; L201-F203 HydrophobicContact CB-CE2 3.76Å; L201-F203 HydrophobicContact CB-CZ 3.89Å; L201-F203 HydrophobicContact CD1-CZ 4.34Å; L201-F203 VanDerWaalsContact O-CD2 3.32Å; L201-F203 WeakPolarHBondContact O-CD2 3.34Å; F203-I250 HydrophobicContact CE1-CD1 3.87Å; F203-I250 HydrophobicContact CE1-CG1 4.09Å; F203-I250 HydrophobicContact CZ-CD1 4.09Å; F203-I250 HydrophobicContact CZ-CG1 4.38Å; F203-I250 HydrophobicContact CZ-CG2 4.19Å
204	G	98.3	Very high	94.5	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	168.3	166.5	0	0	0	0	0	111.9	F157 I176 V177 G178	F157-G204 CarbonylContact O-C 3.56Å; F157-G204 WeakPolarHBondContact O-CA 3.38Å; I176-G204 PolarHBondContact O-N 3.33Å; V177-G204 WeakPolarHBondContact CA-O 3.12Å; G178-G204 PolarHBondContact N-O 2.97Å
205	V	98.4	Very high	94.2	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	139.1	-175.4	177.3	0	0	0	0	109.5	A156 F157 L158 F159 G178 F180 L183 F191 Y192	A156-V205 HydrophobicContact CB-CG2 4.29Å; F157-V205 PolarHBondContact O-N 2.99Å; L158-V205 WeakPolarHBondContact CA-O 3.05Å; F159-V205 PolarHBondContact N-O 3.43Å; G178-V205 CarbonylContact O-C 3.57Å; G178-V205 WeakPolarHBondContact O-CA 3.13Å; F180-V205 HydrophobicContact CD2-CG1 4.02Å; F180-V205 HydrophobicContact CE2-CG1 4.25Å; L183-V205 HydrophobicContact CD1-CG1 4.15Å; L183-V205 HydrophobicContact CD2-CG1 3.5Å; L183-V205 HydrophobicContact CG-CG1 4.44Å; F191-V205 HydrophobicContact CD1-CG2 3.93Å; F191-V205 HydrophobicContact CE1-CG2 3.5Å; F191-V205 VanDerWaalsContact CE1-CG2 3.5Å; F191-V205 HydrophobicContact CZ-CG2 4.41Å; Y192-V205 HydrophobicContact CE1-CG2 4.28Å; Y192-V205 HydrophobicContact CE2-CG2 4.34Å
206	I	98.2	Very high	93.9	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	138.7	174.6	-174.2	163.1	0	0	0	110.7	F159 V165 V177 G178 F179 F180 N210 A211	F159-I206 HydrophobicContact CB-CB 4.24Å; F159-I206 HydrophobicContact CB-CD1 4.12Å; F159-I206 HydrophobicContact CB-CG1 4.4Å; V165-I206 HydrophobicContact CG2-CB 4.43Å; V165-I206 HydrophobicContact CG2-CD1 3.63Å; V165-I206 HydrophobicContact CG2-CG2 4.37Å; V177-I206 HydrophobicContact CG1-CG2 4Å; G178-I206 PolarHBondContact O-N 2.98Å; F179-I206 WeakPolarHBondContact CA-O 3.39Å; F179-I206 HydrophobicContact CD1-CG2 3.38Å; F179-I206 HydrophobicContact CD2-CG2 4.31Å; F179-I206 HydrophobicContact CE1-CG2 3.5Å; F179-I206 HydrophobicContact CE2-CG2 4.4Å; F179-I206 HydrophobicContact CG-CG2 3.81Å; F179-I206 HydrophobicContact CZ-CG2 4.02Å; F180-I206 PolarHBondContact N-O 3.19Å; I206-N210 HydrophobicContact CD1-CB 4.03Å; I206-N210 HydrophobicContact CG1-CB 3.9Å; I206-A211 HydrophobicContact CD1-CB 4.27Å
207	T	97.9	Very high	93.7	Very high	39 Å²	39	39 Å²	39	24%	0.239	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69	134	169.8	-43.1	0	0	0	0	109.7	F180 Q181 G209 N210	F180-T207 CarbonylContact O-C 3.49Å; F180-T207 WeakPolarHBondContact O-CA 3.48Å; Q181-T207 WeakPolarHBondContact O-CG2 3.47Å; T207-G209 PolarHBondContact O-N 3.36Å; T207-G209 VanDerWaalsContact O-N 3.15Å; T207-N210 WeakPolarHBondContact O-CA 3.36Å; T207-N210 WeakPolarHBondContact O-CB 3.42Å; T207-N210 PolarHBondContact O-N 2.73Å
208	I	96.7	Very high	93.6	Very high	13 Å²	13	41.4 Å²	41.4	7%	0.067	24%	0.238	C	C	.	.	G	3₁₀ helix	trans	-56.6	-36.1	-174.2	-75.6	166.6	0	0	0	112.3	F179 F180 Q181 N210 A211 V217	F179-I208 HydrophobicContact CB-CG1 3.99Å; F180-I208 PolarHBondContact O-N 3.41Å; Q181-I208 HydrophobicContact CG-CD1 4.28Å; I208-N210 PolarHBondContact O-N 2.89Å; I208-A211 WeakPolarHBondContact O-CB 3.46Å; I208-A211 PolarHBondContact O-N 2.95Å; I208-V217 HydrophobicContact CD1-CG1 4.35Å; I208-V217 HydrophobicContact CG1-CG1 4.32Å
209	G	94.4	Very high	93.5	Very high	45 Å²	45	44.3 Å²	44.3	46%	0.464	25%	0.254	S	S	.	.	G	3₁₀ helix	trans	-58.4	-27.9	173.4	0	0	0	0	0	114.8	T207 I212	T207-G209 PolarHBondContact O-N 3.36Å; T207-G209 VanDerWaalsContact O-N 3.15Å; G209-I212 VanDerWaalsContact O-CD1 3.31Å; G209-I212 WeakPolarHBondContact O-CD1 3.29Å; G209-I212 WeakPolarHBondContact O-CG1 3.32Å
210	N	93.5	Very high	93.5	Very high	72 Å²	72	45.3 Å²	45.3	39%	0.385	26%	0.259	S	S	.	.	G	3₁₀ helix	trans	-86.3	-8.7	177.5	-62.2	-16	0	0	0	112.8	S161 S162 I206 T207 I208	S161-N210 CarbonylContact C-O 3.53Å; S161-N210 WeakPolarHBondContact CA-O 3.43Å; S162-N210 PolarHBondContact N-O 2.93Å; S162-N210 VanDerWaalsContact N-O 3.07Å; I206-N210 HydrophobicContact CD1-CB 4.03Å; I206-N210 HydrophobicContact CG1-CB 3.9Å; T207-N210 WeakPolarHBondContact O-CA 3.36Å; T207-N210 WeakPolarHBondContact O-CB 3.42Å; T207-N210 PolarHBondContact O-N 2.73Å; I208-N210 PolarHBondContact O-N 2.89Å
211	A	89	Confident	93.6	Very high	3 Å²	3	44.1 Å²	44.1	3%	0.025	25%	0.254	C	S	.	.	G	3₁₀ helix	trans	-95.9	-2.9	-179.6	0	0	0	0	0	114	F179 I206 I208 G213 R214	F179-A211 HydrophobicContact CD1-CB 3.84Å; F179-A211 HydrophobicContact CE1-CB 3.76Å; I206-A211 HydrophobicContact CD1-CB 4.27Å; I208-A211 WeakPolarHBondContact O-CB 3.46Å; I208-A211 PolarHBondContact O-N 2.95Å; A211-G213 PolarHBondContact O-N 2.87Å; A211-R214 PolarHBondContact O-N 3.04Å
212	I	82.1	Confident	93.6	Very high	136 Å²	136	43.9 Å²	43.9	70%	0.697	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.6	137.6	-176.3	-64.5	173.2	0	0	0	111.4	G209 R214	G209-I212 VanDerWaalsContact O-CD1 3.31Å; G209-I212 WeakPolarHBondContact O-CD1 3.29Å; G209-I212 WeakPolarHBondContact O-CG1 3.32Å; I212-R214 VanDerWaalsContact C-N 3.34Å; I212-R214 PolarHBondContact O-N 2.85Å
213	G	78.4	Confident	93.7	Very high	73 Å²	73	43.1 Å²	43.1	75%	0.753	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	87.3	-11.8	178.8	0	0	0	0	0	115.2	A211	A211-G213 PolarHBondContact O-N 2.87Å
214	R	84.1	Confident	93.6	Very high	106 Å²	106	42.7 Å²	42.7	40%	0.4	25%	0.246	S	C	.	.	S	Bend	trans	-132.5	168.4	169.3	-59.9	-171.4	-166.1	-169.3	-4.2	111.5	S162 E163 A166 A211 I212 H216	S162-R214 WeakPolarHBondContact OG-CD 3.24Å; S162-R214 VanDerWaalsContact OG-CG 3.23Å; S162-R214 WeakPolarHBondContact OG-CG 3.29Å; S162-R214 PolarHBondContact OG-NE 2.81Å; E163-R214 IonicContact OE1-CZ 3.4Å; E163-R214 IonicContact OE1-NE 3.28Å; E163-R214 PolarHBondContact OE1-NE 3.48Å; E163-R214 IonicContact OE1-NH2 3.3Å; E163-R214 PolarHBondContact OE1-NH2 2.84Å; A166-R214 VanDerWaalsContact CB-NH1 3.33Å; A211-R214 PolarHBondContact O-N 3.04Å; I212-R214 VanDerWaalsContact C-N 3.34Å; I212-R214 PolarHBondContact O-N 2.85Å; R214-H216 PolarHBondContact O-N 3.3Å
215	F	90.4	Very high	93.6	Very high	31 Å²	31	42.8 Å²	42.8	14%	0.136	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.6	-20.6	175.9	-44.4	-63.9	0	0	0	117.5	S162 V165 A166 F179 V217 L223 F225 I230 R233	S162-F215 WeakPolarHBondContact O-CE2 3.12Å; V165-F215 HydrophobicContact CB-CE2 3.79Å; V165-F215 HydrophobicContact CB-CZ 3.87Å; V165-F215 HydrophobicContact CG1-CE1 4.37Å; V165-F215 HydrophobicContact CG1-CE2 3.73Å; V165-F215 HydrophobicContact CG1-CZ 3.59Å; V165-F215 HydrophobicContact CG2-CE2 4.49Å; A166-F215 HydrophobicContact CB-CZ 4.12Å; F179-F215 HydrophobicContact CE1-CB 4.38Å; F179-F215 AromaticContact CE1-CD2 3.95Å; F179-F215 HydrophobicContact CE1-CD2 3.95Å; F179-F215 HydrophobicContact CE1-CG 4.4Å; F179-F215 HydrophobicContact CZ-CB 4.39Å; F179-F215 HydrophobicContact CZ-CD2 4.03Å; F179-F215 HydrophobicContact CZ-CG 4.23Å; F215-V217 HydrophobicContact CB-CG2 4.2Å; F215-L223 HydrophobicContact CB-CD1 4.06Å; F215-F225 AromaticContact CD1-CE1 3.8Å; F215-F225 HydrophobicContact CD1-CE1 3.8Å; F215-F225 AromaticContact CD1-CZ 3.76Å; F215-F225 HydrophobicContact CD1-CZ 3.76Å; F215-F225 AromaticContact CE1-CE1 3.62Å; F215-F225 HydrophobicContact CE1-CE1 3.62Å; F215-F225 AromaticContact CE1-CZ 3.78Å; F215-F225 HydrophobicContact CE1-CZ 3.78Å; F215-F225 HydrophobicContact CG-CZ 4.43Å; F215-F225 HydrophobicContact CZ-CZ 4.47Å; F215-I230 HydrophobicContact CD1-CD1 4.36Å; F215-R233 PolarHBondContact O-NH2 3.32Å
216	H	91.2	Very high	93.4	Very high	160 Å²	160	46 Å²	46	74%	0.741	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.4	66.6	-178.7	-48.7	98.3	0	0	0	111.3	R214 R233	R214-H216 PolarHBondContact O-N 3.3Å; H216-R233 PolarHBondContact O-NH1 3.34Å; H216-R233 PolarHBondContact O-NH2 3.2Å; H216-R233 VanDerWaalsContact O-NH2 3.15Å
217	V	94.1	Very high	93.2	Very high	15 Å²	15	54 Å²	54	9%	0.091	30%	0.295	C	S	.	.			trans	-120.6	132.1	175.3	-175.3	0	0	0	0	108.3	F179 I208 F215 L219 L223	F179-V217 HydrophobicContact CB-CG1 3.76Å; F179-V217 HydrophobicContact CD1-CB 4.13Å; F179-V217 HydrophobicContact CD1-CG1 4.3Å; F179-V217 HydrophobicContact CD1-CG2 4.04Å; F179-V217 HydrophobicContact CE1-CG2 4.27Å; F179-V217 HydrophobicContact CG-CB 4.4Å; F179-V217 HydrophobicContact CG-CG1 4.13Å; F179-V217 HydrophobicContact CG-CG2 4.21Å; I208-V217 HydrophobicContact CD1-CG1 4.35Å; I208-V217 HydrophobicContact CG1-CG1 4.32Å; F215-V217 HydrophobicContact CB-CG2 4.2Å; V217-L219 VanDerWaalsContact CG1-O 3.29Å; V217-L219 WeakPolarHBondContact CG1-O 3.48Å; V217-L223 HydrophobicContact CG2-CD1 3.81Å; V217-L223 HydrophobicContact CG2-CG 4.36Å
218	T	93.7	Very high	92.9	Very high	111 Å²	111	53.4 Å²	53.4	68%	0.681	30%	0.297	S	S	*	.			trans	-134.5	-7.7	-177	53.4	0	0	0	0	113.2	Q181	Q181-T218 PolarHBondContact NE2-O 3.41Å
219	L	95.9	Very high	92.8	Very high	70 Å²	70	60.3 Å²	60.3	37%	0.366	33%	0.326	S	S	.	.	S	Bend	trans	-135	154	-178.6	-62.1	175.2	0	0	0	108.1	V217 S221 I237	V217-L219 VanDerWaalsContact CG1-O 3.29Å; V217-L219 WeakPolarHBondContact CG1-O 3.48Å; L219-S221 WeakPolarHBondContact O-CB 3.44Å; L219-S221 PolarHBondContact O-N 3.21Å; L219-S221 PolarHBondContact O-OG 2.88Å; L219-I237 HydrophobicContact CB-CG2 4.06Å; L219-I237 HydrophobicContact CD1-CG2 4.38Å
220	D	98	Very high	92.9	Very high	22 Å²	22	61.6 Å²	61.6	12%	0.118	32%	0.322	C	S	.	.	S	Bend	trans	-53.6	121.5	-179.7	-56.6	-83.5	0	0	0	110.7	F179 F180 Q181 V187 E235 L236	F179-D220 WeakPolarHBondContact O-CA 3.41Å; F180-D220 WeakPolarHBondContact CA-OD1 3.38Å; F180-D220 HydrophobicContact CD1-CB 4.21Å; Q181-D220 WeakPolarHBondContact CG-OD2 3.23Å; Q181-D220 PolarHBondContact N-OD1 3.28Å; V187-D220 HydrophobicContact CG1-CB 4.17Å; V187-D220 HydrophobicContact CG2-CB 4.43Å; D220-E235 CarbonylContact O-C 3.57Å; D220-E235 WeakPolarHBondContact O-CA 3.25Å; D220-L236 PolarHBondContact O-N 3.47Å
221	S	97.6	Very high	93	Very high	1 Å²	1	61.9 Å²	61.9	1%	0.007	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	152.9	-162.5	-69.8	0	0	0	0	112.7	F179 L219 Q234	F179-S221 PolarHBondContact N-O 3.23Å; F179-S221 PolarHBondContact O-N 3.44Å; L219-S221 WeakPolarHBondContact O-CB 3.44Å; L219-S221 PolarHBondContact O-N 3.21Å; L219-S221 PolarHBondContact O-OG 2.88Å; S221-Q234 CarbonylContact C-O 3.57Å; S221-Q234 VanDerWaalsContact CA-O 3.28Å; S221-Q234 WeakPolarHBondContact CA-O 3.34Å
222	I	98.1	Very high	93.4	Very high	0 Å²	0	63.3 Å²	63.3	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	131.2	161.3	57.2	-175.6	0	0	0	110.4	V177 F191 Q234 L236 L246 V249	V177-I222 WeakPolarHBondContact O-CA 3.31Å; F191-I222 HydrophobicContact CD2-CG2 3.89Å; F191-I222 HydrophobicContact CE2-CG2 3.77Å; I222-Q234 HydrophobicContact CD1-CB 4.19Å; I222-Q234 HydrophobicContact CD1-CG 4.47Å; I222-Q234 HydrophobicContact CG1-CB 3.77Å; I222-Q234 HydrophobicContact CG1-CG 4.41Å; I222-Q234 PolarHBondContact N-O 2.89Å; I222-Q234 PolarHBondContact O-N 3.35Å; I222-L236 HydrophobicContact CG2-CD1 3.87Å; I222-L246 HydrophobicContact CD1-CB 4.47Å; I222-L246 HydrophobicContact CD1-CD1 3.54Å; I222-L246 HydrophobicContact CG2-CD1 3.92Å; I222-V249 HydrophobicContact CD1-CB 3.79Å; I222-V249 HydrophobicContact CD1-CG1 3.78Å; I222-V249 HydrophobicContact CD1-CG2 4.17Å; I222-V249 HydrophobicContact CG1-CG1 4.34Å
223	L	98.3	Very high	94.1	Very high	0 Å²	0	61.4 Å²	61.4	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	131.2	169.4	-58.3	-172.5	0	0	0	109.6	V177 F179 F215 V217 F225 I230 N232 R233	V177-L223 PolarHBondContact N-O 3.34Å; V177-L223 PolarHBondContact O-N 2.89Å; F179-L223 HydrophobicContact CD2-CB 4.47Å; F179-L223 HydrophobicContact CD2-CD1 4.26Å; F179-L223 HydrophobicContact CD2-CG 4.02Å; F179-L223 HydrophobicContact CE2-CB 3.91Å; F179-L223 HydrophobicContact CE2-CD1 3.6Å; F179-L223 HydrophobicContact CE2-CG 3.69Å; F179-L223 HydrophobicContact CZ-CD1 3.85Å; F179-L223 HydrophobicContact CZ-CG 4.44Å; F215-L223 HydrophobicContact CB-CD1 4.06Å; V217-L223 HydrophobicContact CG2-CD1 3.81Å; V217-L223 HydrophobicContact CG2-CG 4.36Å; L223-F225 HydrophobicContact CB-CD2 4.28Å; L223-F225 HydrophobicContact CB-CE2 3.63Å; L223-F225 HydrophobicContact CB-CZ 4.1Å; L223-F225 HydrophobicContact CD1-CE2 4.31Å; L223-F225 HydrophobicContact CD1-CZ 3.98Å; L223-I230 HydrophobicContact CD1-CD1 3.95Å; L223-I230 HydrophobicContact CD1-CG1 4.43Å; L223-I230 HydrophobicContact CD2-CG2 4.48Å; L223-N232 WeakPolarHBondContact CA-O 3.21Å; L223-R233 HydrophobicContact CD2-CB 3.65Å; L223-R233 HydrophobicContact CD2-CG 3.68Å
224	V	98.3	Very high	95	Very high	0 Å²	0	60 Å²	60	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	119.5	170.4	-174.8	0	0	0	0	108.4	L174 I176 I230 V231 N232 V249 H253	L174-V224 HydrophobicContact CD1-CG1 4.4Å; L174-V224 HydrophobicContact CD2-CG1 4.34Å; L174-V224 HydrophobicContact CG-CG1 4.26Å; I176-V224 HydrophobicContact CD1-CG2 4.3Å; I176-V224 HydrophobicContact CG1-CG1 4.17Å; I176-V224 HydrophobicContact CG1-CG2 4.09Å; I176-V224 HydrophobicContact CG2-CG2 4.34Å; V224-I230 CarbonylContact O-C 3.52Å; V224-I230 WeakPolarHBondContact O-CA 3.34Å; V224-V231 HydrophobicContact CB-CG2 4.18Å; V224-V231 HydrophobicContact CG1-CG2 3.94Å; V224-V231 WeakPolarHBondContact O-CG2 3.46Å; V224-V231 PolarHBondContact O-N 3.2Å; V224-N232 HydrophobicContact CB-CB 4.07Å; V224-N232 HydrophobicContact CG2-CB 4Å; V224-N232 PolarHBondContact N-O 3.37Å; V224-V249 HydrophobicContact CG2-CG1 3.59Å; V224-H253 VanDerWaalsContact CG1-CD2 3.49Å; V224-H253 WeakPolarHBondContact CG1-CD2 3.24Å; V224-H253 WeakPolarHBondContact CG1-NE2 3.44Å
225	F	97.8	Very high	95.6	Very high	2 Å²	2	58.7 Å²	58.7	1%	0.009	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	128.9	172.6	-61.1	-98.3	0	0	0	109.5	V165 V169 L174 V175 V177 F179 F215 L223 K229 I230	V165-F225 HydrophobicContact CG1-CE2 4.46Å; V165-F225 HydrophobicContact CG1-CZ 4.29Å; V169-F225 HydrophobicContact CB-CB 3.71Å; V169-F225 HydrophobicContact CB-CD1 3.93Å; V169-F225 HydrophobicContact CB-CD2 4.32Å; V169-F225 HydrophobicContact CB-CG 3.74Å; V169-F225 HydrophobicContact CG1-CB 3.89Å; V169-F225 HydrophobicContact CG1-CD1 4.02Å; V169-F225 HydrophobicContact CG1-CD2 3.63Å; V169-F225 HydrophobicContact CG1-CE1 4.45Å; V169-F225 HydrophobicContact CG1-CE2 4.09Å; V169-F225 HydrophobicContact CG1-CG 3.58Å; V169-F225 HydrophobicContact CG1-CZ 4.48Å; V169-F225 HydrophobicContact CG2-CB 4.35Å; V169-F225 HydrophobicContact CG2-CD1 3.68Å; V169-F225 HydrophobicContact CG2-CE1 4.12Å; V169-F225 HydrophobicContact CG2-CG 4.05Å; L174-F225 CarbonylContact C-O 3.51Å; L174-F225 VanDerWaalsContact CA-O 3.27Å; L174-F225 WeakPolarHBondContact CA-O 3.47Å; V175-F225 PolarHBondContact N-O 2.91Å; V175-F225 PolarHBondContact O-N 3.42Å; V177-F225 HydrophobicContact CB-CE2 4.07Å; V177-F225 HydrophobicContact CG2-CD2 4.02Å; V177-F225 HydrophobicContact CG2-CE2 3.91Å; F179-F225 HydrophobicContact CE2-CE2 4.34Å; F179-F225 HydrophobicContact CZ-CZ 4.44Å; F215-F225 AromaticContact CD1-CE1 3.8Å; F215-F225 HydrophobicContact CD1-CE1 3.8Å; F215-F225 AromaticContact CD1-CZ 3.76Å; F215-F225 HydrophobicContact CD1-CZ 3.76Å; F215-F225 AromaticContact CE1-CE1 3.62Å; F215-F225 HydrophobicContact CE1-CE1 3.62Å; F215-F225 AromaticContact CE1-CZ 3.78Å; F215-F225 HydrophobicContact CE1-CZ 3.78Å; F215-F225 HydrophobicContact CG-CZ 4.43Å; F215-F225 HydrophobicContact CZ-CZ 4.47Å; L223-F225 HydrophobicContact CB-CD2 4.28Å; L223-F225 HydrophobicContact CB-CE2 3.63Å; L223-F225 HydrophobicContact CB-CZ 4.1Å; L223-F225 HydrophobicContact CD1-CE2 4.31Å; L223-F225 HydrophobicContact CD1-CZ 3.98Å; F225-K229 CarbonylContact C-O 3.55Å; F225-K229 VanDerWaalsContact CA-O 3.31Å; F225-K229 WeakPolarHBondContact CA-O 3.29Å; F225-I230 HydrophobicContact CD1-CG1 3.77Å; F225-I230 HydrophobicContact CE1-CD1 4.11Å; F225-I230 HydrophobicContact CE1-CG1 3.41Å; F225-I230 VanDerWaalsContact CE1-CG1 3.41Å; F225-I230 HydrophobicContact CZ-CD1 4.43Å; F225-I230 HydrophobicContact CZ-CG1 3.96Å
226	K	95	Very high	95.9	Very high	66 Å²	66	57.4 Å²	57.4	29%	0.287	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	114.9	174.5	-166.2	170.8	-173.4	168.9	0	108.5	P173 L174 K229 V231	P173-K226 CarbonylContact O-C 3.55Å; P173-K226 WeakPolarHBondContact O-CA 3.29Å; L174-K226 HydrophobicContact CD1-CD 4.42Å; L174-K226 HydrophobicContact CD1-CG 4.45Å; K226-K229 PolarHBondContact N-O 2.7Å; K226-K229 PolarHBondContact O-N 3.47Å; K226-V231 HydrophobicContact CB-CB 4.45Å; K226-V231 HydrophobicContact CB-CG1 3.83Å; K226-V231 HydrophobicContact CB-CG2 3.73Å
227	K	92.1	Very high	96	Very high	168 Å²	168	54.8 Å²	54.8	73%	0.73	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.7	56.1	-170.6	-55.6	-177.3	178.6	-174.6	0	112	P173 K229	P173-K227 PolarHBondContact O-N 2.68Å; K227-K229 PolarHBondContact O-N 3.06Å
228	G	91.9	Very high	96	Very high	27 Å²	27	57.7 Å²	57.7	28%	0.278	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.8	-16.1	-178	0	0	0	0	0	116.9	V169	V169-G228 VanDerWaalsContact O-CA 3.3Å; V169-G228 WeakPolarHBondContact O-CA 3.48Å; V169-G228 PolarHBondContact O-N 3.31Å; V169-G228 VanDerWaalsContact O-N 3.09Å
229	K	95.1	Very high	95.9	Very high	158 Å²	158	57.9 Å²	57.9	69%	0.687	29%	0.286	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.2	135.6	-177.4	-62.4	-173.6	179.4	-173.5	0	111.7	F225 K226 K227 V231	F225-K229 CarbonylContact C-O 3.55Å; F225-K229 VanDerWaalsContact CA-O 3.31Å; F225-K229 WeakPolarHBondContact CA-O 3.29Å; K226-K229 PolarHBondContact N-O 2.7Å; K226-K229 PolarHBondContact O-N 3.47Å; K227-K229 PolarHBondContact O-N 3.06Å; K229-V231 PolarHBondContact O-N 3.39Å
230	I	96.7	Very high	95.7	Very high	72 Å²	72	59 Å²	59	37%	0.369	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.4	124.7	168.8	-58.8	165.2	0	0	0	108.2	F215 L223 V224 F225	F215-I230 HydrophobicContact CD1-CD1 4.36Å; L223-I230 HydrophobicContact CD1-CD1 3.95Å; L223-I230 HydrophobicContact CD1-CG1 4.43Å; L223-I230 HydrophobicContact CD2-CG2 4.48Å; V224-I230 CarbonylContact O-C 3.52Å; V224-I230 WeakPolarHBondContact O-CA 3.34Å; F225-I230 HydrophobicContact CD1-CG1 3.77Å; F225-I230 HydrophobicContact CE1-CD1 4.11Å; F225-I230 HydrophobicContact CE1-CG1 3.41Å; F225-I230 VanDerWaalsContact CE1-CG1 3.41Å; F225-I230 HydrophobicContact CZ-CD1 4.43Å; F225-I230 HydrophobicContact CZ-CG1 3.96Å
231	V	96.1	Very high	95.6	Very high	79 Å²	79	60.2 Å²	60.2	48%	0.479	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	-17.9	176.2	-66.1	0	0	0	0	113.4	V224 K226 K229	V224-V231 HydrophobicContact CB-CG2 4.18Å; V224-V231 HydrophobicContact CG1-CG2 3.94Å; V224-V231 WeakPolarHBondContact O-CG2 3.46Å; V224-V231 PolarHBondContact O-N 3.2Å; K226-V231 HydrophobicContact CB-CB 4.45Å; K226-V231 HydrophobicContact CB-CG1 3.83Å; K226-V231 HydrophobicContact CB-CG2 3.73Å; K229-V231 PolarHBondContact O-N 3.39Å
232	N	96.5	Very high	95.5	Very high	32 Å²	32	60.2 Å²	60.2	17%	0.171	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	142.6	169.6	-168.3	87	0	0	0	110.1	L223 V224 V249	L223-N232 WeakPolarHBondContact CA-O 3.21Å; V224-N232 HydrophobicContact CB-CB 4.07Å; V224-N232 HydrophobicContact CG2-CB 4Å; V224-N232 PolarHBondContact N-O 3.37Å; N232-V249 HydrophobicContact CB-CG1 4.48Å; N232-V249 WeakPolarHBondContact ND2-CG1 3.46Å; N232-V249 WeakPolarHBondContact ND2-CG2 3.43Å
233	R	97.1	Very high	95.4	Very high	97 Å²	97	65.3 Å²	65.3	37%	0.366	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	136.8	165.4	170	-178.8	-63.3	-113.2	-0.3	107.4	F215 H216 L223	F215-R233 PolarHBondContact O-NH2 3.32Å; H216-R233 PolarHBondContact O-NH1 3.34Å; H216-R233 PolarHBondContact O-NH2 3.2Å; H216-R233 VanDerWaalsContact O-NH2 3.15Å; L223-R233 HydrophobicContact CD2-CB 3.65Å; L223-R233 HydrophobicContact CD2-CG 3.68Å
234	Q	97.8	Very high	95.2	Very high	42 Å²	42	71.6 Å²	71.6	20%	0.196	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	125.4	172	178.3	61.4	52.8	0	0	109	S221 I222 L236 E245 V249	S221-Q234 CarbonylContact C-O 3.57Å; S221-Q234 VanDerWaalsContact CA-O 3.28Å; S221-Q234 WeakPolarHBondContact CA-O 3.34Å; I222-Q234 HydrophobicContact CD1-CB 4.19Å; I222-Q234 HydrophobicContact CD1-CG 4.47Å; I222-Q234 HydrophobicContact CG1-CB 3.77Å; I222-Q234 HydrophobicContact CG1-CG 4.41Å; I222-Q234 PolarHBondContact N-O 2.89Å; I222-Q234 PolarHBondContact O-N 3.35Å; Q234-L236 HydrophobicContact CG-CD2 4.32Å; Q234-E245 HydrophobicContact CG-CB 4.06Å; Q234-E245 PolarHBondContact OE1-OE2 3.17Å; Q234-V249 HydrophobicContact CB-CG2 3.79Å; Q234-V249 HydrophobicContact CG-CG2 4.02Å
235	E	96.9	Very high	95.1	Very high	80 Å²	80	74 Å²	74	37%	0.374	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	145.8	171.7	-72.4	162.6	-159.6	0	0	109.4	D220 I237	D220-E235 CarbonylContact O-C 3.57Å; D220-E235 WeakPolarHBondContact O-CA 3.25Å; E235-I237 HydrophobicContact CB-CG2 4.46Å
236	L	95.8	Very high	95.1	Very high	4 Å²	4	74 Å²	74	2%	0.021	37%	0.371	C	S	.	.			trans	-122.3	54	-176.4	-63.7	-179.1	0	0	0	110.4	F180 V187 D220 I222 Q234 N242 E245 L246	F180-L236 HydrophobicContact CE1-CD1 4.39Å; V187-L236 HydrophobicContact CG2-CB 3.7Å; V187-L236 HydrophobicContact CG2-CD1 4.26Å; D220-L236 PolarHBondContact O-N 3.47Å; I222-L236 HydrophobicContact CG2-CD1 3.87Å; Q234-L236 HydrophobicContact CG-CD2 4.32Å; L236-N242 VanDerWaalsContact C-CG 3.5Å; L236-N242 WeakPolarHBondContact CA-OD1 3.44Å; L236-N242 HydrophobicContact CD2-CB 4.45Å; L236-N242 PolarHBondContact O-ND2 3.4Å; L236-N242 PolarHBondContact O-OD1 3.3Å; L236-E245 HydrophobicContact CD2-CB 4.29Å; L236-L246 HydrophobicContact CD2-CB 4.34Å
237	I	93.5	Very high	95.1	Very high	104 Å²	104	72.3 Å²	72.3	53%	0.533	37%	0.365	S	S	.	.			trans	-101	14.1	-172.9	61.5	171.4	0	0	0	114.3	L219 E235 N242	L219-I237 HydrophobicContact CB-CG2 4.06Å; L219-I237 HydrophobicContact CD1-CG2 4.38Å; E235-I237 HydrophobicContact CB-CG2 4.46Å; I237-N242 PolarHBondContact N-OD1 3.28Å
238	N	93.4	Very high	95.2	Very high	76 Å²	76	68.5 Å²	68.5	41%	0.406	35%	0.346	S	S	.	.			trans	-147.5	102	-179.7	172.5	8.6	0	0	0	111.3	S240 T241 N242	N238-S240 PolarHBondContact ND2-OG 2.83Å; N238-S240 PolarHBondContact O-N 2.98Å; N238-S240 VanDerWaalsContact O-N 3.1Å; N238-S240 PolarHBondContact OD1-N 2.8Å; N238-S240 PolarHBondContact OD1-OG 3.25Å; N238-T241 WeakPolarHBondContact CB-OG1 3.26Å; N238-T241 PolarHBondContact ND2-OG1 2.92Å; N238-T241 CarbonylContact O-C 3.58Å; N238-T241 WeakPolarHBondContact O-CA 3.45Å; N238-T241 PolarHBondContact O-N 3.45Å; N238-T241 PolarHBondContact O-OG1 3.18Å; N238-N242 PolarHBondContact N-OD1 3.34Å; N238-N242 PolarHBondContact O-N 3.31Å; N238-N242 PolarHBondContact O-OD1 2.94Å
239	D	91.8	Very high	95.4	Very high	115 Å²	115	67.2 Å²	67.2	62%	0.615	33%	0.333	S	S	*	.	H	α-helix	trans	-54.9	-35.6	-170.8	-46.6	-50.8	0	0	0	113.7	T241 N242	D239-T241 PolarHBondContact O-N 2.85Å; D239-T241 VanDerWaalsContact O-N 3.17Å; D239-N242 PolarHBondContact N-ND2 2.74Å; D239-N242 PolarHBondContact OD1-ND2 2.87Å
240	S	92.6	Very high	95.4	Very high	94 Å²	94	59.7 Å²	59.7	66%	0.657	30%	0.3	S	S	*	.	H	α-helix	trans	-61.9	-23	176.7	70.4	0	0	0	0	113.6	N238	N238-S240 PolarHBondContact ND2-OG 2.83Å; N238-S240 PolarHBondContact O-N 2.98Å; N238-S240 VanDerWaalsContact O-N 3.1Å; N238-S240 PolarHBondContact OD1-N 2.8Å; N238-S240 PolarHBondContact OD1-OG 3.25Å
241	T	94.8	Very high	95.3	Very high	47 Å²	47	57.4 Å²	57.4	29%	0.288	29%	0.288	S	S	.	.	H	α-helix	trans	-116.1	-22.9	-178.8	54.8	0	0	0	0	114	N238 D239 K243 Q244 E245	N238-T241 WeakPolarHBondContact CB-OG1 3.26Å; N238-T241 PolarHBondContact ND2-OG1 2.92Å; N238-T241 CarbonylContact O-C 3.58Å; N238-T241 WeakPolarHBondContact O-CA 3.45Å; N238-T241 PolarHBondContact O-N 3.45Å; N238-T241 PolarHBondContact O-OG1 3.18Å; D239-T241 PolarHBondContact O-N 2.85Å; D239-T241 VanDerWaalsContact O-N 3.17Å; T241-K243 VanDerWaalsContact C-N 3.29Å; T241-K243 PolarHBondContact O-N 2.82Å; T241-K243 VanDerWaalsContact O-N 3.13Å; T241-Q244 WeakPolarHBondContact O-CA 3.34Å; T241-Q244 WeakPolarHBondContact O-CB 3.43Å; T241-Q244 PolarHBondContact O-N 2.96Å; T241-E245 PolarHBondContact O-N 3.5Å
242	N	96.1	Very high	95.1	Very high	2 Å²	2	57.4 Å²	57.4	1%	0.011	28%	0.283	C	S	.	.	H	α-helix	trans	-50.8	-44.4	-172	-78.6	-9	0	0	0	113.1	L190 L236 I237 N238 D239 Q244 L246	L190-N242 HydrophobicContact CD2-CB 3.74Å; L236-N242 VanDerWaalsContact C-CG 3.5Å; L236-N242 WeakPolarHBondContact CA-OD1 3.44Å; L236-N242 HydrophobicContact CD2-CB 4.45Å; L236-N242 PolarHBondContact O-ND2 3.4Å; L236-N242 PolarHBondContact O-OD1 3.3Å; I237-N242 PolarHBondContact N-OD1 3.28Å; N238-N242 PolarHBondContact N-OD1 3.34Å; N238-N242 PolarHBondContact O-N 3.31Å; N238-N242 PolarHBondContact O-OD1 2.94Å; D239-N242 PolarHBondContact N-ND2 2.74Å; D239-N242 PolarHBondContact OD1-ND2 2.87Å; N242-Q244 VanDerWaalsContact C-N 3.34Å; N242-Q244 PolarHBondContact O-N 2.87Å; N242-L246 WeakPolarHBondContact O-CB 3.25Å; N242-L246 PolarHBondContact O-N 2.86Å
243	K	96.1	Very high	95	Very high	106 Å²	106	56.8 Å²	56.8	46%	0.461	28%	0.278	S	S	.	.	H	α-helix	trans	-65.5	-34.9	178.8	-172.4	160.1	-171	152	0	112.9	L190 D193 V194 T241 N247	L190-K243 HydrophobicContact CD1-CB 3.89Å; L190-K243 HydrophobicContact CD1-CD 3.81Å; L190-K243 HydrophobicContact CD1-CG 3.89Å; L190-K243 HydrophobicContact CD2-CB 4.18Å; D193-K243 IonicContact OD2-NZ 2.77Å; V194-K243 HydrophobicContact CG2-CG 4.29Å; T241-K243 VanDerWaalsContact C-N 3.29Å; T241-K243 PolarHBondContact O-N 2.82Å; T241-K243 VanDerWaalsContact O-N 3.13Å; K243-N247 WeakPolarHBondContact O-CB 3.34Å; K243-N247 PolarHBondContact O-N 3.15Å; K243-N247 PolarHBondContact O-ND2 2.89Å
244	Q	94.6	Very high	94.9	Very high	133 Å²	133	52.2 Å²	52.2	62%	0.621	26%	0.262	S	S	*	.	H	α-helix	trans	-74.6	-46.9	179.5	-62	-177.6	-6.2	0	0	110.7	T241 N242 N247 R248	T241-Q244 WeakPolarHBondContact O-CA 3.34Å; T241-Q244 WeakPolarHBondContact O-CB 3.43Å; T241-Q244 PolarHBondContact O-N 2.96Å; N242-Q244 VanDerWaalsContact C-N 3.34Å; N242-Q244 PolarHBondContact O-N 2.87Å; Q244-N247 PolarHBondContact O-N 3.04Å; Q244-R248 WeakPolarHBondContact O-CB 3.44Å; Q244-R248 PolarHBondContact O-N 3.44Å
245	E	96.1	Very high	94.6	Very high	50 Å²	50	50.5 Å²	50.5	23%	0.234	25%	0.254	C	S	.	.	H	α-helix	trans	-64.9	-42.8	179.7	-70.1	-55.4	129.1	0	0	112.5	Q234 L236 T241 N247 R248 V249	Q234-E245 HydrophobicContact CG-CB 4.06Å; Q234-E245 PolarHBondContact OE1-OE2 3.17Å; L236-E245 HydrophobicContact CD2-CB 4.29Å; T241-E245 PolarHBondContact O-N 3.5Å; E245-N247 PolarHBondContact O-N 3.18Å; E245-R248 PolarHBondContact O-N 3.33Å; E245-R248 IonicContact OE1-NE 3.64Å; E245-R248 IonicContact OE2-CZ 2.73Å; E245-R248 IonicContact OE2-NE 2.79Å; E245-R248 PolarHBondContact OE2-NE 3.05Å; E245-R248 IonicContact OE2-NH2 2.67Å; E245-R248 PolarHBondContact OE2-NH2 2.88Å; E245-V249 WeakPolarHBondContact O-CG2 3.46Å; E245-V249 PolarHBondContact O-N 3.45Å
246	L	96.8	Very high	94.4	Very high	1 Å²	1	47.6 Å²	47.6	1%	0.005	24%	0.241	C	C	.	.	H	α-helix	trans	-58.1	-47.7	172.5	177	60.6	0	0	0	111.7	F191 V194 I222 L236 N242 I250	F191-L246 HydrophobicContact CB-CD2 4.41Å; F191-L246 HydrophobicContact CD2-CD1 3.84Å; F191-L246 HydrophobicContact CD2-CD2 4.29Å; F191-L246 HydrophobicContact CE2-CD1 4.24Å; V194-L246 HydrophobicContact CB-CD2 3.69Å; V194-L246 HydrophobicContact CB-CG 4.32Å; V194-L246 HydrophobicContact CG1-CD2 3.91Å; V194-L246 HydrophobicContact CG1-CG 3.97Å; V194-L246 HydrophobicContact CG2-CD2 3.96Å; I222-L246 HydrophobicContact CD1-CB 4.47Å; I222-L246 HydrophobicContact CD1-CD1 3.54Å; I222-L246 HydrophobicContact CG2-CD1 3.92Å; L236-L246 HydrophobicContact CD2-CB 4.34Å; N242-L246 WeakPolarHBondContact O-CB 3.25Å; N242-L246 PolarHBondContact O-N 2.86Å; L246-I250 HydrophobicContact CD1-CD1 3.65Å; L246-I250 HydrophobicContact CD1-CG1 4.26Å; L246-I250 HydrophobicContact CG-CD1 3.95Å; L246-I250 VanDerWaalsContact O-CG1 3.26Å; L246-I250 WeakPolarHBondContact O-CG1 3.36Å; L246-I250 PolarHBondContact O-N 3.38Å; L246-I250 VanDerWaalsContact O-N 3.08Å
247	N	95.1	Very high	94.5	Very high	31 Å²	31	49.6 Å²	49.6	17%	0.166	25%	0.249	C	C	.	.	H	α-helix	trans	-62.3	-43.8	176.2	-91.4	-89.5	0	0	0	112.2	V194 K243 Q244 E245 V249 I250 K251	V194-N247 WeakPolarHBondContact CG1-ND2 3.42Å; K243-N247 WeakPolarHBondContact O-CB 3.34Å; K243-N247 PolarHBondContact O-N 3.15Å; K243-N247 PolarHBondContact O-ND2 2.89Å; Q244-N247 PolarHBondContact O-N 3.04Å; E245-N247 PolarHBondContact O-N 3.18Å; N247-V249 PolarHBondContact O-N 2.82Å; N247-I250 PolarHBondContact O-N 2.92Å; N247-K251 WeakPolarHBondContact O-CB 3.32Å; N247-K251 WeakPolarHBondContact O-CG 3.38Å; N247-K251 PolarHBondContact O-N 3.48Å; N247-K251 WeakPolarHBondContact OD1-CE 3.45Å; N247-K251 PolarHBondContact OD1-NZ 3.25Å
248	R	94.3	Very high	94.7	Very high	89 Å²	89	45 Å²	45	34%	0.336	23%	0.227	S	C	.	.	H	α-helix	trans	-58.4	-48.6	179.6	-174.8	-172.7	62.7	67.5	-7	111.3	Q244 E245 Q252	Q244-R248 WeakPolarHBondContact O-CB 3.44Å; Q244-R248 PolarHBondContact O-N 3.44Å; E245-R248 PolarHBondContact O-N 3.33Å; E245-R248 IonicContact OE1-NE 3.64Å; E245-R248 IonicContact OE2-CZ 2.73Å; E245-R248 IonicContact OE2-NE 2.79Å; E245-R248 PolarHBondContact OE2-NE 3.05Å; E245-R248 IonicContact OE2-NH2 2.67Å; E245-R248 PolarHBondContact OE2-NH2 2.88Å; R248-Q252 VanDerWaalsContact O-CG 3.29Å; R248-Q252 WeakPolarHBondContact O-CG 3.27Å; R248-Q252 PolarHBondContact O-N 3.15Å
249	V	96	Very high	94.9	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-65.9	-42.2	179.9	171	0	0	0	0	111.6	I222 V224 N232 Q234 E245 N247 H253	I222-V249 HydrophobicContact CD1-CB 3.79Å; I222-V249 HydrophobicContact CD1-CG1 3.78Å; I222-V249 HydrophobicContact CD1-CG2 4.17Å; I222-V249 HydrophobicContact CG1-CG1 4.34Å; V224-V249 HydrophobicContact CG2-CG1 3.59Å; N232-V249 HydrophobicContact CB-CG1 4.48Å; N232-V249 WeakPolarHBondContact ND2-CG1 3.46Å; N232-V249 WeakPolarHBondContact ND2-CG2 3.43Å; Q234-V249 HydrophobicContact CB-CG2 3.79Å; Q234-V249 HydrophobicContact CG-CG2 4.02Å; E245-V249 WeakPolarHBondContact O-CG2 3.46Å; E245-V249 PolarHBondContact O-N 3.45Å; N247-V249 PolarHBondContact O-N 2.82Å; V249-H253 PolarHBondContact O-CD2 3.29Å; V249-H253 VanDerWaalsContact O-CD2 3.22Å
250	I	96.4	Very high	95.2	Very high	0 Å²	0	37 Å²	37	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-65.2	-47.6	178	-66.8	169.4	0	0	0	111	I176 V194 F198 L201 F203 L246 N247 Q252 H253	I176-I250 HydrophobicContact CD1-CB 4.48Å; I176-I250 HydrophobicContact CD1-CG1 4Å; I176-I250 HydrophobicContact CD1-CG2 4.47Å; V194-I250 HydrophobicContact CG1-CD1 4.03Å; F198-I250 HydrophobicContact CB-CG2 4.22Å; F198-I250 HydrophobicContact CD1-CG2 3.84Å; F198-I250 HydrophobicContact CD2-CD1 4.12Å; F198-I250 HydrophobicContact CD2-CG2 3.62Å; F198-I250 HydrophobicContact CE1-CG2 4.06Å; F198-I250 HydrophobicContact CE2-CB 4.41Å; F198-I250 HydrophobicContact CE2-CD1 4.19Å; F198-I250 HydrophobicContact CE2-CG2 3.85Å; F198-I250 HydrophobicContact CG-CG2 3.6Å; F198-I250 HydrophobicContact CZ-CG2 4.07Å; L201-I250 HydrophobicContact CD1-CG2 3.63Å; F203-I250 HydrophobicContact CE1-CD1 3.87Å; F203-I250 HydrophobicContact CE1-CG1 4.09Å; F203-I250 HydrophobicContact CZ-CD1 4.09Å; F203-I250 HydrophobicContact CZ-CG1 4.38Å; F203-I250 HydrophobicContact CZ-CG2 4.19Å; L246-I250 HydrophobicContact CD1-CD1 3.65Å; L246-I250 HydrophobicContact CD1-CG1 4.26Å; L246-I250 HydrophobicContact CG-CD1 3.95Å; L246-I250 VanDerWaalsContact O-CG1 3.26Å; L246-I250 WeakPolarHBondContact O-CG1 3.36Å; L246-I250 PolarHBondContact O-N 3.38Å; L246-I250 VanDerWaalsContact O-N 3.08Å; N247-I250 PolarHBondContact O-N 2.92Å; I250-Q252 VanDerWaalsContact C-N 3.29Å; I250-Q252 PolarHBondContact O-N 3.14Å; I250-H253 PolarHBondContact O-N 3.37Å
251	K	94.6	Very high	95.3	Very high	24 Å²	24	36 Å²	36	10%	0.104	17%	0.165	C	C	.	.	H	α-helix	trans	-63.8	-31.6	-176.2	-69.8	174.9	-167.4	-172.1	0	112.6	F198 N247 H253 L254 L268 E271 L272	F198-K251 HydrophobicContact CE1-CG 4.26Å; F198-K251 HydrophobicContact CZ-CG 4.29Å; N247-K251 WeakPolarHBondContact O-CB 3.32Å; N247-K251 WeakPolarHBondContact O-CG 3.38Å; N247-K251 PolarHBondContact O-N 3.48Å; N247-K251 WeakPolarHBondContact OD1-CE 3.45Å; N247-K251 PolarHBondContact OD1-NZ 3.25Å; K251-H253 PolarHBondContact O-N 2.89Å; K251-L254 HydrophobicContact CG-CD1 4.29Å; K251-L254 PolarHBondContact O-N 3.07Å; K251-L268 HydrophobicContact CD-CD1 4.1Å; K251-L268 HydrophobicContact CG-CD1 4.06Å; K251-E271 HydrophobicContact CD-CB 4.35Å; K251-E271 IonicContact NZ-OE1 3.5Å; K251-E271 PolarHBondContact NZ-OE1 2.83Å; K251-E271 IonicContact NZ-OE2 3.15Å; K251-E271 PolarHBondContact NZ-OE2 3.18Å; K251-L272 HydrophobicContact CB-CD2 4Å; K251-L272 WeakPolarHBondContact O-CD2 3.36Å
252	Q	91.6	Very high	95.3	Very high	79 Å²	79	34.2 Å²	34.2	37%	0.369	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-13.2	171.4	-76.5	174.3	-6.7	0	0	114.6	R248 I250 T255	R248-Q252 VanDerWaalsContact O-CG 3.29Å; R248-Q252 WeakPolarHBondContact O-CG 3.27Å; R248-Q252 PolarHBondContact O-N 3.15Å; I250-Q252 VanDerWaalsContact C-N 3.29Å; I250-Q252 PolarHBondContact O-N 3.14Å; Q252-T255 PolarHBondContact O-OG1 2.91Å
253	H	93.6	Very high	95	Very high	18 Å²	18	37.3 Å²	37.3	8%	0.083	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110.9	9.5	177.9	-60.6	-46.3	0	0	0	114.5	L174 V224 V249 I250 K251	L174-H253 HydrophobicContact CD1-CB 3.91Å; V224-H253 VanDerWaalsContact CG1-CD2 3.49Å; V224-H253 WeakPolarHBondContact CG1-CD2 3.24Å; V224-H253 WeakPolarHBondContact CG1-NE2 3.44Å; V249-H253 PolarHBondContact O-CD2 3.29Å; V249-H253 VanDerWaalsContact O-CD2 3.22Å; I250-H253 PolarHBondContact O-N 3.37Å; K251-H253 PolarHBondContact O-N 2.89Å
254	L	94.5	Very high	94.8	Very high	2 Å²	2	35.9 Å²	35.9	1%	0.01	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97	-11.5	169.6	-57.4	173.2	0	0	0	112.5	F198 E200 L201 K251 D256 F257 L268 L272	F198-L254 HydrophobicContact CD1-CD1 3.75Å; F198-L254 HydrophobicContact CE1-CD1 3.71Å; E200-L254 HydrophobicContact CG-CD2 3.8Å; L201-L254 HydrophobicContact CD1-CD2 3.7Å; L201-L254 HydrophobicContact CD1-CG 4.37Å; L201-L254 HydrophobicContact CD2-CD2 4.2Å; L201-L254 HydrophobicContact CG-CD2 3.9Å; K251-L254 HydrophobicContact CG-CD1 4.29Å; K251-L254 PolarHBondContact O-N 3.07Å; L254-D256 PolarHBondContact O-N 3.34Å; L254-D256 VanDerWaalsContact O-N 3.09Å; L254-F257 WeakPolarHBondContact O-CB 3.36Å; L254-F257 PolarHBondContact O-N 2.87Å; L254-L268 HydrophobicContact CD1-CD1 4Å; L254-L268 HydrophobicContact CD1-CD2 4.38Å; L254-L272 HydrophobicContact CB-CD2 4.29Å
255	T	92.8	Very high	94.5	Very high	6 Å²	6	30.1 Å²	30.1	4%	0.037	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-8.3	-172	53.1	0	0	0	0	116	Q252 L272 I274 Q304 N305	Q252-T255 PolarHBondContact O-OG1 2.91Å; T255-L272 HydrophobicContact CG2-CD2 3.87Å; T255-I274 HydrophobicContact CG2-CD1 3.85Å; T255-Q304 WeakPolarHBondContact OG1-CG 3.47Å; T255-Q304 PolarHBondContact OG1-NE2 3.19Å; T255-Q304 VanDerWaalsContact OG1-NE2 3.15Å; T255-N305 WeakPolarHBondContact CB-OD1 3.01Å; T255-N305 WeakPolarHBondContact CG2-OD1 3.35Å; T255-N305 PolarHBondContact OG1-OD1 2.8Å
256	D	93.2	Very high	94.1	Very high	19 Å²	19	32 Å²	32	10%	0.102	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.8	7.6	172.7	66.7	-62.8	0	0	0	113.3	L254 S300 K301 Q304	L254-D256 PolarHBondContact O-N 3.34Å; L254-D256 VanDerWaalsContact O-N 3.09Å; D256-S300 WeakPolarHBondContact O-CB 3.41Å; D256-S300 PolarHBondContact O-OG 3.2Å; D256-K301 HydrophobicContact CB-CD 3.97Å; D256-K301 WeakPolarHBondContact O-CD 3.37Å; D256-K301 WeakPolarHBondContact O-CE 3.27Å; D256-K301 PolarHBondContact O-NZ 2.87Å; D256-K301 WeakPolarHBondContact OD2-CD 3.44Å; D256-K301 WeakPolarHBondContact OD2-CE 3.27Å; D256-K301 IonicContact OD2-NZ 2.79Å; D256-K301 PolarHBondContact OD2-NZ 3.39Å; D256-Q304 HydrophobicContact CB-CB 3.88Å; D256-Q304 HydrophobicContact CB-CG 3.89Å; D256-Q304 PolarHBondContact OD1-NE2 2.88Å
257	F	96.2	Very high	93.7	Very high	45 Å²	45	37 Å²	37	20%	0.197	18%	0.182	C	C	.	.	S	Bend	trans	-86.6	160.4	170.9	-73.4	-107.4	0	0	0	111.3	N94 E200 L201 L254	N94-F257 HydrophobicContact CB-CD1 4.42Å; E200-F257 HydrophobicContact CB-CE1 4Å; E200-F257 HydrophobicContact CB-CZ 4.47Å; E200-F257 HydrophobicContact CG-CE1 4.24Å; E200-F257 HydrophobicContact CG-CZ 4.47Å; L201-F257 HydrophobicContact CD2-CE2 4.05Å; L201-F257 HydrophobicContact CD2-CZ 4.08Å; L254-F257 WeakPolarHBondContact O-CB 3.36Å; L254-F257 PolarHBondContact O-N 2.87Å
258	V	97.9	Very high	93.5	Very high	9 Å²	9	36.5 Å²	36.5	6%	0.055	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	128.4	163	174.6	0	0	0	0	107.2	N94 I293 Y296 K297 F309 L311	N94-V258 PolarHBondContact ND2-O 2.91Å; V258-I293 HydrophobicContact CG1-CD1 4.17Å; V258-Y296 HydrophobicContact CB-CD1 4.32Å; V258-Y296 HydrophobicContact CG1-CD1 3.76Å; V258-Y296 HydrophobicContact CG1-CE1 3.81Å; V258-Y296 HydrophobicContact CG2-CD1 3.54Å; V258-Y296 HydrophobicContact CG2-CE1 3.96Å; V258-Y296 HydrophobicContact CG2-CG 4.44Å; V258-K297 HydrophobicContact CB-CG 4.23Å; V258-K297 HydrophobicContact CG2-CB 4.41Å; V258-K297 HydrophobicContact CG2-CG 3.71Å; V258-F309 WeakPolarHBondContact CA-O 3.41Å; V258-F309 HydrophobicContact CG2-CB 4.15Å; V258-L311 HydrophobicContact CG1-CB 4Å
259	I	97.6	Very high	93.3	Very high	5 Å²	5	32.8 Å²	32.8	3%	0.026	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	124.8	178.6	-56.2	-178	0	0	0	108.9	N265 L268 I269 L272 L308 F309 I310 L311	I259-N265 HydrophobicContact CG2-CB 4.03Å; I259-L268 HydrophobicContact CD1-CD2 4.45Å; I259-I269 HydrophobicContact CG2-CD1 4.04Å; I259-I269 HydrophobicContact CG2-CG1 3.99Å; I259-L272 HydrophobicContact CD1-CD1 3.5Å; I259-L272 VanDerWaalsContact CD1-CD1 3.5Å; I259-L308 HydrophobicContact CD1-CD1 4.08Å; I259-F309 PolarHBondContact N-O 3.01Å; I259-I310 CarbonylContact O-C 3.56Å; I259-I310 WeakPolarHBondContact O-CA 3.42Å; I259-L311 PolarHBondContact O-N 3.23Å
260	E	97.8	Very high	92.7	Very high	17 Å²	17	39.4 Å²	39.4	8%	0.079	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	124.3	172.1	-174.1	160.4	150.3	0	0	109.7	K91 G92 N262 N265 K284 L311	K91-E260 WeakPolarHBondContact O-CG 3.46Å; G92-E260 WeakPolarHBondContact CA-OE2 3.21Å; E260-N262 PolarHBondContact O-N 2.95Å; E260-N265 PolarHBondContact O-ND2 2.8Å; E260-K284 IonicContact OE1-NZ 2.71Å; E260-K284 PolarHBondContact OE1-NZ 3.38Å; E260-K284 IonicContact OE2-NZ 3.86Å; E260-K284 PolarHBondContact OE2-NZ 2.82Å; E260-L311 HydrophobicContact CB-CD2 4.37Å; E260-L311 HydrophobicContact CG-CD2 3.74Å
261	Y	96.4	Very high	92.4	Very high	72 Å²	72	43.5 Å²	43.5	28%	0.282	21%	0.212	S	C	.	.			trans	-73.4	121.7	177.1	176.9	-89.4	0	0	0	110.1	I269 L311 N319 V322	Y261-I269 HydrophobicContact CD2-CD1 4.2Å; Y261-L311 WeakPolarHBondContact CB-O 3.48Å; Y261-L311 PolarHBondContact N-O 3.11Å; Y261-N319 WeakPolarHBondContact CD1-OD1 3.46Å; Y261-V322 HydrophobicContact CD1-CG1 3.99Å; Y261-V322 HydrophobicContact CE1-CB 4.39Å; Y261-V322 HydrophobicContact CE1-CG1 3.71Å
262	N	93.1	Very high	92.2	Very high	10 Å²	10	43.1 Å²	43.1	5%	0.053	21%	0.211	C	C	.	.	S	Bend	trans	-152.6	-172.5	175.8	59.3	32.8	0	0	0	107.4	K91 E260 E264 N265	K91-N262 PolarHBondContact N-ND2 2.9Å; K91-N262 PolarHBondContact O-ND2 3.38Å; E260-N262 PolarHBondContact O-N 2.95Å; N262-E264 VanDerWaalsContact CB-OE2 3.24Å; N262-E264 WeakPolarHBondContact CB-OE2 3.3Å; N262-E264 PolarHBondContact OD1-N 2.92Å; N262-E264 VanDerWaalsContact OD1-N 3.08Å; N262-E264 PolarHBondContact OD1-OE2 2.9Å; N262-N265 PolarHBondContact ND2-ND2 3.36Å; N262-N265 VanDerWaalsContact OD1-CB 3.25Å; N262-N265 WeakPolarHBondContact OD1-CB 3.42Å; N262-N265 PolarHBondContact OD1-N 3.44Å; N262-N265 PolarHBondContact OD1-ND2 3.23Å
263	A	89.5	Confident	91.9	Very high	68 Å²	68	48 Å²	48	56%	0.562	23%	0.227	S	C	*	.	S	Bend	trans	-77.1	-28.5	-179.3	0	0	0	0	0	112.2	K266	A263-K266 WeakPolarHBondContact O-CB 3.41Å
264	E	91.9	Very high	91.8	Very high	76 Å²	76	47.8 Å²	47.8	36%	0.355	23%	0.226	S	C	.	.	S	Bend	trans	-82.6	-33.8	-168.6	-55.4	71.7	-151.6	0	0	112.2	N262	N262-E264 VanDerWaalsContact CB-OE2 3.24Å; N262-E264 WeakPolarHBondContact CB-OE2 3.3Å; N262-E264 PolarHBondContact OD1-N 2.92Å; N262-E264 VanDerWaalsContact OD1-N 3.08Å; N262-E264 PolarHBondContact OD1-OE2 2.9Å
265	N	89.9	Confident	91.5	Very high	11 Å²	11	51.9 Å²	51.9	6%	0.059	25%	0.246	C	C	.	.	S	Bend	trans	-88.1	-5	174.2	-67.3	-30.7	0	0	0	112.8	I259 E260 N262 D267 L268 I269	I259-N265 HydrophobicContact CG2-CB 4.03Å; E260-N265 PolarHBondContact O-ND2 2.8Å; N262-N265 PolarHBondContact ND2-ND2 3.36Å; N262-N265 VanDerWaalsContact OD1-CB 3.25Å; N262-N265 WeakPolarHBondContact OD1-CB 3.42Å; N262-N265 PolarHBondContact OD1-N 3.44Å; N262-N265 PolarHBondContact OD1-ND2 3.23Å; N265-D267 PolarHBondContact O-N 2.95Å; N265-L268 WeakPolarHBondContact O-CB 3.39Å; N265-L268 PolarHBondContact O-N 3.35Å; N265-I269 WeakPolarHBondContact O-CG1 3.39Å; N265-I269 PolarHBondContact O-N 3.11Å; N265-I269 VanDerWaalsContact O-N 3.08Å
266	K	86.4	Confident	91.6	Very high	89 Å²	89	52.2 Å²	52.2	39%	0.387	25%	0.249	S	C	.	.	H	α-helix	trans	-58.2	-47.5	-173.6	179.2	-176.2	169.3	-166.3	0	111.8	A263 I269 Y270	A263-K266 WeakPolarHBondContact O-CB 3.41Å; K266-I269 WeakPolarHBondContact O-CB 3.45Å; K266-I269 PolarHBondContact O-N 2.8Å; K266-Y270 HydrophobicContact CD-CE2 4.44Å; K266-Y270 HydrophobicContact CG-CD2 4.27Å; K266-Y270 HydrophobicContact CG-CE2 3.81Å; K266-Y270 WeakPolarHBondContact O-CD2 3.4Å; K266-Y270 PolarHBondContact O-N 3.41Å
267	D	88.3	Confident	91.8	Very high	106 Å²	106	52 Å²	52	57%	0.567	25%	0.247	S	C	*	.	H	α-helix	trans	-69.1	-39.6	-176.4	-63.4	-17.9	0	0	0	110.9	N265 I269 Y270 E271	N265-D267 PolarHBondContact O-N 2.95Å; D267-I269 VanDerWaalsContact C-N 3.28Å; D267-I269 PolarHBondContact O-N 2.71Å; D267-Y270 PolarHBondContact O-N 2.89Å; D267-E271 WeakPolarHBondContact O-CG 3.41Å; D267-E271 PolarHBondContact O-N 2.67Å
268	L	91.4	Very high	91.9	Very high	22 Å²	22	49.9 Å²	49.9	12%	0.115	24%	0.238	C	C	.	.	H	α-helix	trans	-54.8	-41.7	171.3	174.8	63	0	0	0	112.1	K251 L254 I259 N265 Y270 E271 L272	K251-L268 HydrophobicContact CD-CD1 4.1Å; K251-L268 HydrophobicContact CG-CD1 4.06Å; L254-L268 HydrophobicContact CD1-CD1 4Å; L254-L268 HydrophobicContact CD1-CD2 4.38Å; I259-L268 HydrophobicContact CD1-CD2 4.45Å; N265-L268 WeakPolarHBondContact O-CB 3.39Å; N265-L268 PolarHBondContact O-N 3.35Å; L268-Y270 VanDerWaalsContact C-N 3.29Å; L268-Y270 PolarHBondContact O-N 2.92Å; L268-E271 PolarHBondContact O-N 2.74Å; L268-L272 HydrophobicContact CD1-CD1 4.42Å; L268-L272 HydrophobicContact CD1-CD2 4.43Å; L268-L272 HydrophobicContact CD1-CG 4.23Å; L268-L272 HydrophobicContact CG-CD1 4.38Å; L268-L272 VanDerWaalsContact O-CG 3.29Å; L268-L272 WeakPolarHBondContact O-CG 3.33Å; L268-L272 PolarHBondContact O-N 3.19Å; L268-L272 VanDerWaalsContact O-N 3.14Å
269	I	90.8	Very high	92	Very high	11 Å²	11	49.9 Å²	49.9	6%	0.056	24%	0.238	C	C	.	.	H	α-helix	trans	-61.4	-37.1	177.9	-71.2	164.8	0	0	0	111.4	I259 Y261 N265 K266 D267 L308 I310	I259-I269 HydrophobicContact CG2-CD1 4.04Å; I259-I269 HydrophobicContact CG2-CG1 3.99Å; Y261-I269 HydrophobicContact CD2-CD1 4.2Å; N265-I269 WeakPolarHBondContact O-CG1 3.39Å; N265-I269 PolarHBondContact O-N 3.11Å; N265-I269 VanDerWaalsContact O-N 3.08Å; K266-I269 WeakPolarHBondContact O-CB 3.45Å; K266-I269 PolarHBondContact O-N 2.8Å; D267-I269 VanDerWaalsContact C-N 3.28Å; D267-I269 PolarHBondContact O-N 2.71Å; I269-L308 HydrophobicContact CG2-CD2 4.11Å; I269-I310 HydrophobicContact CD1-CD1 4.33Å; I269-I310 HydrophobicContact CG2-CD1 3.84Å
270	Y	83	Confident	92	Very high	139 Å²	139	49.6 Å²	49.6	55%	0.545	24%	0.236	S	C	.	.	H	α-helix	trans	-73.6	-42.6	173.8	-69.5	-73.3	0	0	0	112.5	K266 D267 L268 L272 Y273	K266-Y270 HydrophobicContact CD-CE2 4.44Å; K266-Y270 HydrophobicContact CG-CD2 4.27Å; K266-Y270 HydrophobicContact CG-CE2 3.81Å; K266-Y270 WeakPolarHBondContact O-CD2 3.4Å; K266-Y270 PolarHBondContact O-N 3.41Å; D267-Y270 PolarHBondContact O-N 2.89Å; L268-Y270 VanDerWaalsContact C-N 3.29Å; L268-Y270 PolarHBondContact O-N 2.92Å; Y270-L272 PolarHBondContact O-N 3.5Å; Y270-L272 VanDerWaalsContact O-N 3.16Å; Y270-Y273 PolarHBondContact O-N 3.17Å
271	E	88.9	Confident	92	Very high	86 Å²	86	48.9 Å²	48.9	40%	0.402	23%	0.233	S	C	.	.	H	α-helix	trans	-65.1	-13.4	179.9	-70.1	-178.4	107.4	0	0	114.6	K251 D267 L268 Y273	K251-E271 HydrophobicContact CD-CB 4.35Å; K251-E271 IonicContact NZ-OE1 3.5Å; K251-E271 PolarHBondContact NZ-OE1 2.83Å; K251-E271 IonicContact NZ-OE2 3.15Å; K251-E271 PolarHBondContact NZ-OE2 3.18Å; D267-E271 WeakPolarHBondContact O-CG 3.41Å; D267-E271 PolarHBondContact O-N 2.67Å; L268-E271 PolarHBondContact O-N 2.74Å; E271-Y273 VanDerWaalsContact C-N 3.32Å; E271-Y273 WeakPolarHBondContact O-CD2 3.47Å; E271-Y273 VanDerWaalsContact O-CE2 3.32Å; E271-Y273 WeakPolarHBondContact O-CE2 3.32Å
272	L	90.7	Very high	92.1	Very high	16 Å²	16	45.4 Å²	45.4	8%	0.084	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.4	-12.4	172.1	-68.4	170.6	0	0	0	113.1	K251 L254 T255 I259 L268 Y270 I274 L308	K251-L272 HydrophobicContact CB-CD2 4Å; K251-L272 WeakPolarHBondContact O-CD2 3.36Å; L254-L272 HydrophobicContact CB-CD2 4.29Å; T255-L272 HydrophobicContact CG2-CD2 3.87Å; I259-L272 HydrophobicContact CD1-CD1 3.5Å; I259-L272 VanDerWaalsContact CD1-CD1 3.5Å; L268-L272 HydrophobicContact CD1-CD1 4.42Å; L268-L272 HydrophobicContact CD1-CD2 4.43Å; L268-L272 HydrophobicContact CD1-CG 4.23Å; L268-L272 HydrophobicContact CG-CD1 4.38Å; L268-L272 VanDerWaalsContact O-CG 3.29Å; L268-L272 WeakPolarHBondContact O-CG 3.33Å; L268-L272 PolarHBondContact O-N 3.19Å; L268-L272 VanDerWaalsContact O-N 3.14Å; Y270-L272 PolarHBondContact O-N 3.5Å; Y270-L272 VanDerWaalsContact O-N 3.16Å; L272-I274 WeakPolarHBondContact O-CG1 3.3Å; L272-I274 PolarHBondContact O-N 3.4Å; L272-L308 HydrophobicContact CD1-CD1 3.86Å; L272-L308 HydrophobicContact CD1-CD2 4.07Å
273	Y	86.4	Confident	92.3	Very high	180 Å²	180	46.1 Å²	46.1	71%	0.706	23%	0.225	S	C	*	.			trans	52.4	23.1	173.5	-62.3	-77.1	0	0	0	116.6	Y270 E271 M275	Y270-Y273 PolarHBondContact O-N 3.17Å; E271-Y273 VanDerWaalsContact C-N 3.32Å; E271-Y273 WeakPolarHBondContact O-CD2 3.47Å; E271-Y273 VanDerWaalsContact O-CE2 3.32Å; E271-Y273 WeakPolarHBondContact O-CE2 3.32Å; Y273-M275 VanDerWaalsContact O-CE 3.24Å; Y273-M275 WeakPolarHBondContact O-CE 3.46Å; Y273-M275 PolarHBondContact O-N 2.99Å
274	I	91.4	Very high	92.5	Very high	14 Å²	14	44.6 Å²	44.6	7%	0.072	21%	0.206	C	C	.	.			trans	-84.5	108.9	177.2	-55.9	-173.2	0	0	0	109.9	T255 L272 S276 H277 L308	T255-I274 HydrophobicContact CG2-CD1 3.85Å; L272-I274 WeakPolarHBondContact O-CG1 3.3Å; L272-I274 PolarHBondContact O-N 3.4Å; I274-S276 WeakPolarHBondContact CG2-O 3.36Å; I274-S276 PolarHBondContact O-N 2.78Å; I274-H277 PolarHBondContact O-CD2 3.39Å; I274-H277 VanDerWaalsContact O-CD2 3.24Å; I274-H277 PolarHBondContact O-NE2 3.3Å; I274-L308 HydrophobicContact CB-CB 4.14Å; I274-L308 HydrophobicContact CD1-CB 4.16Å; I274-L308 HydrophobicContact CD1-CD1 4.44Å; I274-L308 HydrophobicContact CG2-CB 4.3Å
275	M	88.6	Confident	92.5	Very high	88 Å²	88	44.4 Å²	44.4	43%	0.433	21%	0.213	S	C	.	.	S	Bend	trans	-68.1	8.8	-175.9	-60.8	-62.6	105.3	0	0	115.6	Y273 L341	Y273-M275 VanDerWaalsContact O-CE 3.24Å; Y273-M275 WeakPolarHBondContact O-CE 3.46Å; Y273-M275 PolarHBondContact O-N 2.99Å; M275-L341 PolarHBondContact O-N 3.04Å
276	S	94	Very high	92.7	Very high	13 Å²	13	45.5 Å²	45.5	9%	0.091	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144	118.4	179	-66.2	0	0	0	0	110.5	I274 I307 L308 L339 N340 F366	I274-S276 WeakPolarHBondContact CG2-O 3.36Å; I274-S276 PolarHBondContact O-N 2.78Å; S276-I307 VanDerWaalsContact O-CA 3.31Å; S276-I307 WeakPolarHBondContact O-CA 3.3Å; S276-L308 PolarHBondContact O-N 2.92Å; S276-L339 CarbonylContact C-O 3.56Å; S276-L339 VanDerWaalsContact CA-O 3.32Å; S276-L339 WeakPolarHBondContact CA-O 3.32Å; S276-N340 PolarHBondContact OG-ND2 3.35Å; S276-F366 WeakPolarHBondContact OG-CZ 3.35Å
277	H	97.8	Very high	93	Very high	15 Å²	15	47 Å²	47	7%	0.069	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	130.1	-178.8	-64.5	177	0	0	0	109.1	I274 L279 L308 I310 I338 L339 L341	I274-H277 PolarHBondContact O-CD2 3.39Å; I274-H277 VanDerWaalsContact O-CD2 3.24Å; I274-H277 PolarHBondContact O-NE2 3.3Å; H277-L279 HydrophobicContact CB-CD1 3.88Å; H277-L308 CarbonylContact C-O 3.58Å; H277-L308 WeakPolarHBondContact CA-O 3.34Å; H277-I310 HydrophobicContact CB-CD1 3.93Å; H277-I310 VanDerWaalsContact ND1-CD1 3.34Å; H277-I310 WeakPolarHBondContact ND1-CD1 3.4Å; H277-I338 CarbonylContact O-C 3.44Å; H277-I338 VanDerWaalsContact O-CA 3.26Å; H277-I338 WeakPolarHBondContact O-CA 3.43Å; H277-L339 PolarHBondContact N-O 2.9Å; H277-L339 PolarHBondContact O-N 3.04Å; H277-L341 HydrophobicContact CB-CD1 4.31Å
278	M	98.6	Very high	93.2	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	132.6	159.7	-170.8	-179.6	-72.4	0	0	107.6	Y296 I307 L308 F309 I310 V336 Q337 I338 L359 F362	M278-Y296 HydrophobicContact CG-CE2 4.16Å; M278-Y296 PolarHBondContact O-OH 2.73Å; M278-Y296 HydrophobicContact SD-CE2 3.76Å; M278-I307 HydrophobicContact CB-CG2 3.73Å; M278-L308 PolarHBondContact N-O 2.84Å; M278-F309 HydrophobicContact CB-CD2 4.41Å; M278-F309 HydrophobicContact CB-CE2 4.36Å; M278-F309 HydrophobicContact CE-CE1 4.37Å; M278-F309 HydrophobicContact CE-CE2 4.4Å; M278-F309 HydrophobicContact CE-CZ 3.81Å; M278-F309 HydrophobicContact SD-CD1 4.2Å; M278-F309 HydrophobicContact SD-CE1 3.5Å; M278-F309 VanDerWaalsContact SD-CE1 3.5Å; M278-F309 HydrophobicContact SD-CE2 4.27Å; M278-F309 HydrophobicContact SD-CZ 3.54Å; M278-F309 VanDerWaalsContact SD-CZ 3.54Å; M278-I310 PolarHBondContact O-N 3.05Å; M278-V336 HydrophobicContact CG-CG1 3.52Å; M278-V336 HydrophobicContact SD-CG1 3.76Å; M278-Q337 CarbonylContact C-O 3.49Å; M278-Q337 WeakPolarHBondContact CA-O 3.25Å; M278-I338 HydrophobicContact CB-CG1 4.01Å; M278-I338 HydrophobicContact CE-CD1 3.85Å; M278-I338 HydrophobicContact CE-CG1 4.07Å; M278-I338 HydrophobicContact CG-CG1 3.99Å; M278-L359 HydrophobicContact SD-CD2 3.78Å; M278-F362 HydrophobicContact CE-CD1 4.03Å
279	L	98.4	Very high	93.4	Very high	9 Å²	9	46 Å²	46	5%	0.047	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	123.3	179.4	-62.5	91.5	0	0	0	109.6	H277 F281 I310 V312 F326 V336 Q337 L339	H277-L279 HydrophobicContact CB-CD1 3.88Å; L279-F281 HydrophobicContact CB-CD2 4.44Å; L279-F281 HydrophobicContact CB-CE2 3.66Å; L279-F281 HydrophobicContact CB-CZ 3.87Å; L279-F281 HydrophobicContact CD2-CZ 4.04Å; L279-I310 CarbonylContact C-O 3.44Å; L279-I310 WeakPolarHBondContact CA-O 3.46Å; L279-I310 HydrophobicContact CG-CB 4.33Å; L279-V312 HydrophobicContact CD2-CG2 4.05Å; L279-F326 HydrophobicContact CD1-CE1 3.87Å; L279-F326 HydrophobicContact CD1-CE2 4.25Å; L279-F326 HydrophobicContact CD1-CZ 3.47Å; L279-F326 VanDerWaalsContact CD1-CZ 3.47Å; L279-F326 HydrophobicContact CD2-CD2 4.24Å; L279-F326 HydrophobicContact CD2-CE1 4.46Å; L279-F326 HydrophobicContact CD2-CE2 3.51Å; L279-F326 HydrophobicContact CD2-CZ 3.63Å; L279-F326 HydrophobicContact CG-CZ 4.17Å; L279-V336 VanDerWaalsContact O-CA 3.3Å; L279-V336 WeakPolarHBondContact O-CA 3.49Å; L279-Q337 PolarHBondContact N-O 2.95Å; L279-Q337 PolarHBondContact O-N 3.48Å; L279-L339 HydrophobicContact CD1-CB 4.13Å
280	L	98.7	Very high	93.5	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	114.3	169.1	167.6	63.7	0	0	0	109	V282 I292 Y296 I310 L311 V312 V336 I354	L280-V282 HydrophobicContact CD1-CB 4.15Å; L280-V282 HydrophobicContact CD1-CG1 4.45Å; L280-V282 HydrophobicContact CD2-CG1 4.03Å; L280-V282 HydrophobicContact CG-CB 4.1Å; L280-V282 HydrophobicContact CG-CG1 3.86Å; L280-I292 HydrophobicContact CD1-CG2 3.87Å; L280-I292 HydrophobicContact CD2-CG2 3.79Å; L280-I292 HydrophobicContact CG-CG2 4.48Å; L280-Y296 HydrophobicContact CB-CD1 4.15Å; L280-Y296 HydrophobicContact CB-CD2 4.15Å; L280-Y296 HydrophobicContact CB-CE1 3.75Å; L280-Y296 HydrophobicContact CB-CE2 3.75Å; L280-Y296 HydrophobicContact CB-CG 4.36Å; L280-Y296 HydrophobicContact CD2-CD1 3.73Å; L280-Y296 HydrophobicContact CD2-CD2 4.12Å; L280-Y296 HydrophobicContact CD2-CE1 4.2Å; L280-Y296 HydrophobicContact CD2-CG 3.72Å; L280-Y296 PolarHBondContact N-OH 2.73Å; L280-I310 PolarHBondContact N-O 3.36Å; L280-L311 HydrophobicContact CD2-CD1 4.28Å; L280-V312 PolarHBondContact O-N 3.27Å; L280-V336 HydrophobicContact CD1-CG2 3.85Å; L280-I354 HydrophobicContact CD1-CD1 3.87Å; L280-I354 HydrophobicContact CD1-CG2 4.49Å
281	F	98	Very high	94.1	Very high	1 Å²	1	42.5 Å²	42.5	0%	0.004	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	116.6	171.6	-59.5	-88.5	0	0	0	108.2	L279 V312 I323 F326 V328 P334 S335 Q337	L279-F281 HydrophobicContact CB-CD2 4.44Å; L279-F281 HydrophobicContact CB-CE2 3.66Å; L279-F281 HydrophobicContact CB-CZ 3.87Å; L279-F281 HydrophobicContact CD2-CZ 4.04Å; F281-V312 HydrophobicContact CD1-CB 3.73Å; F281-V312 HydrophobicContact CD1-CG1 3.86Å; F281-V312 HydrophobicContact CD1-CG2 4.2Å; F281-V312 HydrophobicContact CE1-CB 3.92Å; F281-V312 HydrophobicContact CE1-CG1 3.99Å; F281-V312 HydrophobicContact CE1-CG2 3.88Å; F281-V312 HydrophobicContact CZ-CG2 4.44Å; F281-I323 HydrophobicContact CD1-CG1 4.14Å; F281-I323 HydrophobicContact CE1-CG1 4.41Å; F281-F326 HydrophobicContact CE1-CB 4.26Å; F281-F326 HydrophobicContact CE1-CD2 4.33Å; F281-F326 HydrophobicContact CE1-CG 4.41Å; F281-F326 HydrophobicContact CE2-CB 4.26Å; F281-F326 HydrophobicContact CE2-CD1 4.4Å; F281-F326 HydrophobicContact CE2-CG 4.21Å; F281-F326 HydrophobicContact CZ-CB 3.65Å; F281-F326 HydrophobicContact CZ-CD1 4.11Å; F281-F326 AromaticContact CZ-CD2 3.67Å; F281-F326 HydrophobicContact CZ-CD2 3.67Å; F281-F326 HydrophobicContact CZ-CE2 4.34Å; F281-F326 AromaticContact CZ-CG 3.53Å; F281-F326 HydrophobicContact CZ-CG 3.53Å; F281-V328 HydrophobicContact CB-CG1 4.09Å; F281-V328 HydrophobicContact CD1-CG1 4.36Å; F281-V328 HydrophobicContact CD1-CG2 4.28Å; F281-V328 HydrophobicContact CD2-CG2 3.9Å; F281-V328 HydrophobicContact CE1-CG2 4.38Å; F281-V328 HydrophobicContact CE2-CG2 4.01Å; F281-V328 HydrophobicContact CG-CG1 4.12Å; F281-V328 HydrophobicContact CG-CG2 4.05Å; F281-V328 HydrophobicContact CZ-CG2 4.26Å; F281-P334 CarbonylContact O-C 3.52Å; F281-P334 WeakPolarHBondContact O-CA 3.41Å; F281-P334 WeakPolarHBondContact O-CB 3.24Å; F281-S335 PolarHBondContact N-O 2.99Å; F281-S335 PolarHBondContact O-N 2.69Å; F281-Q337 HydrophobicContact CE2-CB 4.37Å; F281-Q337 HydrophobicContact CE2-CG 4.28Å
282	V	97.9	Very high	94.5	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	142.3	-172.5	63.3	0	0	0	0	111.7	L280 F289 I292 L311 V312 N313 A314 P334	L280-V282 HydrophobicContact CD1-CB 4.15Å; L280-V282 HydrophobicContact CD1-CG1 4.45Å; L280-V282 HydrophobicContact CD2-CG1 4.03Å; L280-V282 HydrophobicContact CG-CB 4.1Å; L280-V282 HydrophobicContact CG-CG1 3.86Å; V282-F289 HydrophobicContact CG1-CD2 4.08Å; V282-F289 HydrophobicContact CG1-CE2 4.25Å; V282-F289 HydrophobicContact CG2-CB 4.43Å; V282-F289 HydrophobicContact CG2-CD2 3.93Å; V282-I292 HydrophobicContact CG2-CD1 4.44Å; V282-L311 HydrophobicContact CG1-CD1 3.74Å; V282-L311 HydrophobicContact CG1-CD2 4.46Å; V282-L311 HydrophobicContact CG1-CG 3.95Å; V282-V312 PolarHBondContact N-O 3.04Å; V282-V312 VanDerWaalsContact N-O 3.16Å; V282-N313 WeakPolarHBondContact O-CA 3.13Å; V282-N313 PolarHBondContact O-OD1 2.76Å; V282-A314 PolarHBondContact O-N 3.05Å; V282-P334 HydrophobicContact CB-CB 4.22Å; V282-P334 HydrophobicContact CG2-CB 4.06Å
283	S	96.8	Very high	94.8	Very high	25 Å²	25	39.5 Å²	39.5	18%	0.175	21%	0.208	C	C	.	.			trans	-76.7	115.8	164.8	170.6	0	0	0	0	109.1	S285 S286 D315	S283-S285 PolarHBondContact O-N 2.92Å; S283-S285 PolarHBondContact OG-N 3.08Å; S283-S286 WeakPolarHBondContact O-CB 3.48Å; S283-S286 PolarHBondContact O-N 3.18Å; S283-S286 PolarHBondContact O-OG 3.2Å; S283-S286 PolarHBondContact OG-N 3.46Å; S283-D315 VanDerWaalsContact CA-OD1 3.29Å; S283-D315 WeakPolarHBondContact CA-OD1 3.39Å; S283-D315 WeakPolarHBondContact CB-OD1 3.16Å; S283-D315 VanDerWaalsContact OG-CG 3.31Å; S283-D315 PolarHBondContact OG-OD1 2.89Å; S283-D315 PolarHBondContact OG-OD2 3.45Å
284	K	95.2	Very high	95.3	Very high	35 Å²	35	33.7 Å²	33.7	15%	0.152	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-25.1	175.7	-75.3	175.5	53.4	175.2	0	112	E260 S286 F289 L311 N313 D315	E260-K284 IonicContact OE1-NZ 2.71Å; E260-K284 PolarHBondContact OE1-NZ 3.38Å; E260-K284 IonicContact OE2-NZ 3.86Å; E260-K284 PolarHBondContact OE2-NZ 2.82Å; K284-S286 VanDerWaalsContact C-N 3.27Å; K284-S286 PolarHBondContact O-N 3.03Å; K284-F289 HydrophobicContact CB-CD1 4.21Å; K284-F289 HydrophobicContact CB-CE1 4.22Å; K284-F289 HydrophobicContact CD-CZ 4.47Å; K284-F289 HydrophobicContact CG-CD1 4.34Å; K284-F289 HydrophobicContact CG-CD2 4.35Å; K284-F289 HydrophobicContact CG-CE1 4Å; K284-F289 HydrophobicContact CG-CE2 4.03Å; K284-F289 HydrophobicContact CG-CZ 3.84Å; K284-F289 WeakPolarHBondContact O-CD1 3.43Å; K284-L311 HydrophobicContact CD-CD2 4.15Å; K284-N313 HydrophobicContact CD-CB 3.86Å; K284-N313 HydrophobicContact CG-CB 4.28Å; K284-N313 PolarHBondContact N-OD1 2.95Å; K284-D315 PolarHBondContact N-OD2 2.67Å
285	S	92	Very high	95.6	Very high	73 Å²	73	34.4 Å²	34.4	51%	0.51	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-9.4	176	-50.5	0	0	0	0	113.8	H38 S283 D315	H38-S285 PolarHBondContact CE1-O 3.49Å; H38-S285 VanDerWaalsContact CE1-O 3.29Å; S283-S285 PolarHBondContact O-N 2.92Å; S283-S285 PolarHBondContact OG-N 3.08Å; S285-D315 VanDerWaalsContact CB-OD2 3.3Å; S285-D315 WeakPolarHBondContact CB-OD2 3.3Å; S285-D315 PolarHBondContact N-OD2 2.69Å; S285-D315 PolarHBondContact OG-OD2 3.45Å
286	S	94.2	Very high	96	Very high	33 Å²	33	30.2 Å²	30.2	23%	0.231	17%	0.17	C	C	.	.	S	Bend	trans	-77.3	144.3	178.3	69.9	0	0	0	0	112.9	S283 K284 S288 F289	S283-S286 WeakPolarHBondContact O-CB 3.48Å; S283-S286 PolarHBondContact O-N 3.18Å; S283-S286 PolarHBondContact O-OG 3.2Å; S283-S286 PolarHBondContact OG-N 3.46Å; K284-S286 VanDerWaalsContact C-N 3.27Å; K284-S286 PolarHBondContact O-N 3.03Å; S286-S288 PolarHBondContact O-N 2.76Å; S286-F289 VanDerWaalsContact O-CB 3.3Å; S286-F289 WeakPolarHBondContact O-CB 3.27Å; S286-F289 PolarHBondContact O-N 2.94Å; S286-F289 VanDerWaalsContact O-N 3.14Å; S286-F289 PolarHBondContact OG-N 3.43Å
287	E	91.6	Very high	96.2	Very high	122 Å²	122	34.6 Å²	34.6	57%	0.57	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.3	-33.5	171.9	-79.1	-162.6	-137	0	0	112.8	K35 F289	K35-E287 IonicContact NZ-OE2 2.63Å; K35-E287 PolarHBondContact NZ-OE2 2.62Å; E287-F289 VanDerWaalsContact C-N 3.26Å; E287-F289 PolarHBondContact O-N 2.96Å
288	S	92.5	Very high	96.2	Very high	67 Å²	67	37.4 Å²	37.4	47%	0.469	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64	-29	179.5	-50.3	0	0	0	0	113.2	S286 G290 I291 I292	S286-S288 PolarHBondContact O-N 2.76Å; S288-G290 VanDerWaalsContact C-N 3.29Å; S288-G290 PolarHBondContact O-N 2.81Å; S288-I291 PolarHBondContact O-N 2.81Å; S288-I291 VanDerWaalsContact O-N 3.14Å; S288-I292 WeakPolarHBondContact O-CG1 3.42Å; S288-I292 PolarHBondContact O-N 3.32Å; S288-I292 VanDerWaalsContact O-N 3.13Å
289	F	95.3	Very high	96.1	Very high	40 Å²	40	37.4 Å²	37.4	18%	0.175	20%	0.203	C	C	.	.	H	α-helix	trans	-52.8	-45.3	-172.8	171.5	-123.1	0	0	0	112.7	V282 K284 S286 E287 I291 I292 I293 L311	V282-F289 HydrophobicContact CG1-CD2 4.08Å; V282-F289 HydrophobicContact CG1-CE2 4.25Å; V282-F289 HydrophobicContact CG2-CB 4.43Å; V282-F289 HydrophobicContact CG2-CD2 3.93Å; K284-F289 HydrophobicContact CB-CD1 4.21Å; K284-F289 HydrophobicContact CB-CE1 4.22Å; K284-F289 HydrophobicContact CD-CZ 4.47Å; K284-F289 HydrophobicContact CG-CD1 4.34Å; K284-F289 HydrophobicContact CG-CD2 4.35Å; K284-F289 HydrophobicContact CG-CE1 4Å; K284-F289 HydrophobicContact CG-CE2 4.03Å; K284-F289 HydrophobicContact CG-CZ 3.84Å; K284-F289 WeakPolarHBondContact O-CD1 3.43Å; S286-F289 VanDerWaalsContact O-CB 3.3Å; S286-F289 WeakPolarHBondContact O-CB 3.27Å; S286-F289 PolarHBondContact O-N 2.94Å; S286-F289 VanDerWaalsContact O-N 3.14Å; S286-F289 PolarHBondContact OG-N 3.43Å; E287-F289 VanDerWaalsContact C-N 3.26Å; E287-F289 PolarHBondContact O-N 2.96Å; F289-I291 VanDerWaalsContact C-N 3.25Å; F289-I291 PolarHBondContact O-N 2.88Å; F289-I292 PolarHBondContact O-N 2.82Å; F289-I293 HydrophobicContact CD2-CB 4.21Å; F289-I293 HydrophobicContact CE2-CB 3.65Å; F289-I293 HydrophobicContact CE2-CD1 4.28Å; F289-I293 HydrophobicContact CE2-CG1 3.98Å; F289-I293 HydrophobicContact CE2-CG2 4.21Å; F289-I293 HydrophobicContact CZ-CB 3.99Å; F289-I293 HydrophobicContact CZ-CG1 4.04Å; F289-I293 HydrophobicContact CZ-CG2 4.19Å; F289-I293 VanDerWaalsContact O-CG2 3.3Å; F289-I293 WeakPolarHBondContact O-CG2 3.14Å; F289-I293 PolarHBondContact O-N 3.26Å; F289-L311 HydrophobicContact CE2-CD1 3.65Å; F289-L311 HydrophobicContact CZ-CD1 4.25Å
290	G	93.8	Very high	96.1	Very high	17 Å²	17	37 Å²	37	18%	0.175	20%	0.201	C	C	.	.	H	α-helix	trans	-63.8	-24.6	-175.7	0	0	0	0	0	114.9	S288 Q294	S288-G290 VanDerWaalsContact C-N 3.29Å; S288-G290 PolarHBondContact O-N 2.81Å; G290-Q294 WeakPolarHBondContact O-CG 3.38Å; G290-Q294 PolarHBondContact O-NE2 3.1Å
291	I	95.5	Very high	95.9	Very high	59 Å²	59	41.9 Å²	41.9	30%	0.303	22%	0.222	S	C	.	.	H	α-helix	trans	-86.3	-45.8	173.5	-64.5	174.9	0	0	0	109.7	I33 K35 S288 F289 I293 Q294 H295	I33-I291 HydrophobicContact CG2-CG2 4.18Å; K35-I291 HydrophobicContact CB-CD1 4.16Å; K35-I291 HydrophobicContact CG-CD1 4.15Å; S288-I291 PolarHBondContact O-N 2.81Å; S288-I291 VanDerWaalsContact O-N 3.14Å; F289-I291 VanDerWaalsContact C-N 3.25Å; F289-I291 PolarHBondContact O-N 2.88Å; I291-I293 PolarHBondContact O-N 3.5Å; I291-Q294 PolarHBondContact O-N 3.15Å; I291-H295 PolarHBondContact O-N 3.15Å
292	I	97.2	Very high	95.8	Very high	17 Å²	17	45 Å²	45	9%	0.087	24%	0.237	C	C	.	.	H	α-helix	trans	-57.1	-46.6	-179.8	-66.5	167.5	0	0	0	111	L280 V282 S288 F289 Q294 H295 Y296 P334 I354	L280-I292 HydrophobicContact CD1-CG2 3.87Å; L280-I292 HydrophobicContact CD2-CG2 3.79Å; L280-I292 HydrophobicContact CG-CG2 4.48Å; V282-I292 HydrophobicContact CG2-CD1 4.44Å; S288-I292 WeakPolarHBondContact O-CG1 3.42Å; S288-I292 PolarHBondContact O-N 3.32Å; S288-I292 VanDerWaalsContact O-N 3.13Å; F289-I292 PolarHBondContact O-N 2.82Å; I292-Q294 VanDerWaalsContact C-N 3.29Å; I292-Q294 PolarHBondContact O-N 3.02Å; I292-H295 PolarHBondContact O-N 2.99Å; I292-Y296 WeakPolarHBondContact O-CB 3.3Å; I292-Y296 PolarHBondContact O-N 3.45Å; I292-P334 HydrophobicContact CD1-CB 4.13Å; I292-P334 HydrophobicContact CD1-CG 3.75Å; I292-I354 HydrophobicContact CD1-CD1 4.45Å; I292-I354 HydrophobicContact CG1-CB 4.49Å; I292-I354 HydrophobicContact CG2-CB 4.22Å; I292-I354 HydrophobicContact CG2-CD1 4.22Å; I292-I354 HydrophobicContact CG2-CG2 3.91Å
293	I	96.9	Very high	95.8	Very high	21 Å²	21	45.3 Å²	45.3	11%	0.108	24%	0.238	C	C	.	.	H	α-helix	trans	-66.8	-28.9	-178	-167	53.9	0	0	0	113	V258 F289 I291 Y296 K297 L311	V258-I293 HydrophobicContact CG1-CD1 4.17Å; F289-I293 HydrophobicContact CD2-CB 4.21Å; F289-I293 HydrophobicContact CE2-CB 3.65Å; F289-I293 HydrophobicContact CE2-CD1 4.28Å; F289-I293 HydrophobicContact CE2-CG1 3.98Å; F289-I293 HydrophobicContact CE2-CG2 4.21Å; F289-I293 HydrophobicContact CZ-CB 3.99Å; F289-I293 HydrophobicContact CZ-CG1 4.04Å; F289-I293 HydrophobicContact CZ-CG2 4.19Å; F289-I293 VanDerWaalsContact O-CG2 3.3Å; F289-I293 WeakPolarHBondContact O-CG2 3.14Å; F289-I293 PolarHBondContact O-N 3.26Å; I291-I293 PolarHBondContact O-N 3.5Å; I293-Y296 HydrophobicContact CD1-CD1 4.48Å; I293-K297 HydrophobicContact CD1-CG 4.24Å; I293-K297 HydrophobicContact CG1-CD 4.19Å; I293-K297 HydrophobicContact CG1-CG 4.37Å; I293-K297 VanDerWaalsContact O-CB 3.29Å; I293-K297 WeakPolarHBondContact O-CB 3.44Å; I293-K297 VanDerWaalsContact O-CG 3.29Å; I293-K297 WeakPolarHBondContact O-CG 3.23Å; I293-K297 PolarHBondContact O-N 3.48Å; I293-L311 HydrophobicContact CD1-CD1 3.88Å
294	Q	96.3	Very high	95.6	Very high	58 Å²	58	46 Å²	46	27%	0.271	24%	0.238	S	C	.	.	H	α-helix	trans	-70.7	-47.2	174.3	-69.8	-179.6	68.1	0	0	110.8	I33 T34 G290 I291 I292 Y296 K297 L298	I33-Q294 HydrophobicContact CD1-CB 3.81Å; I33-Q294 HydrophobicContact CG2-CB 4.22Å; T34-Q294 PolarHBondContact O-NE2 3.32Å; G290-Q294 WeakPolarHBondContact O-CG 3.38Å; G290-Q294 PolarHBondContact O-NE2 3.1Å; I291-Q294 PolarHBondContact O-N 3.15Å; I292-Q294 VanDerWaalsContact C-N 3.29Å; I292-Q294 PolarHBondContact O-N 3.02Å; Q294-Y296 VanDerWaalsContact C-N 3.27Å; Q294-Y296 PolarHBondContact O-N 3.06Å; Q294-K297 PolarHBondContact O-N 3.36Å; Q294-L298 WeakPolarHBondContact O-CG 3.15Å; Q294-L298 PolarHBondContact O-N 3.19Å
295	H	98	Very high	95.5	Very high	30 Å²	30	49.3 Å²	49.3	14%	0.139	26%	0.258	C	S	.	.	H	α-helix	trans	-57.6	-40.5	171.9	-80.1	-50.5	0	0	0	112.4	I33 I291 I292 L298 A299 I354 Y356 L359	I33-H295 HydrophobicContact CD1-CB 4.39Å; I33-H295 WeakPolarHBondContact CD1-CE1 3.37Å; I33-H295 WeakPolarHBondContact CD1-ND1 3.31Å; I291-H295 PolarHBondContact O-N 3.15Å; I292-H295 PolarHBondContact O-N 2.99Å; H295-L298 PolarHBondContact O-N 3.37Å; H295-A299 WeakPolarHBondContact O-CB 3.4Å; H295-A299 PolarHBondContact O-N 3.22Å; H295-I354 PolarHBondContact CD2-O 2.62Å; H295-Y356 PolarHBondContact ND1-N 2.74Å; H295-Y356 VanDerWaalsContact ND1-N 3.14Å; H295-L359 HydrophobicContact CB-CD1 4.37Å
296	Y	98.4	Very high	95.6	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-69.4	-43	-179.5	-159.5	-115.7	0	0	0	112.7	V258 M278 L280 I292 I293 Q294 L298 A299 S300 F309 I310 L359	V258-Y296 HydrophobicContact CB-CD1 4.32Å; V258-Y296 HydrophobicContact CG1-CD1 3.76Å; V258-Y296 HydrophobicContact CG1-CE1 3.81Å; V258-Y296 HydrophobicContact CG2-CD1 3.54Å; V258-Y296 HydrophobicContact CG2-CE1 3.96Å; V258-Y296 HydrophobicContact CG2-CG 4.44Å; M278-Y296 HydrophobicContact CG-CE2 4.16Å; M278-Y296 PolarHBondContact O-OH 2.73Å; M278-Y296 HydrophobicContact SD-CE2 3.76Å; L280-Y296 HydrophobicContact CB-CD1 4.15Å; L280-Y296 HydrophobicContact CB-CD2 4.15Å; L280-Y296 HydrophobicContact CB-CE1 3.75Å; L280-Y296 HydrophobicContact CB-CE2 3.75Å; L280-Y296 HydrophobicContact CB-CG 4.36Å; L280-Y296 HydrophobicContact CD2-CD1 3.73Å; L280-Y296 HydrophobicContact CD2-CD2 4.12Å; L280-Y296 HydrophobicContact CD2-CE1 4.2Å; L280-Y296 HydrophobicContact CD2-CG 3.72Å; L280-Y296 PolarHBondContact N-OH 2.73Å; I292-Y296 WeakPolarHBondContact O-CB 3.3Å; I292-Y296 PolarHBondContact O-N 3.45Å; I293-Y296 HydrophobicContact CD1-CD1 4.48Å; Q294-Y296 VanDerWaalsContact C-N 3.27Å; Q294-Y296 PolarHBondContact O-N 3.06Å; Y296-L298 VanDerWaalsContact C-N 3.33Å; Y296-L298 PolarHBondContact O-N 2.84Å; Y296-A299 PolarHBondContact O-N 2.91Å; Y296-S300 PolarHBondContact O-N 3.1Å; Y296-F309 HydrophobicContact CD1-CD1 4.16Å; Y296-F309 AromaticContact CD2-CD1 3.88Å; Y296-F309 HydrophobicContact CD2-CD1 3.88Å; Y296-F309 HydrophobicContact CD2-CE1 4.07Å; Y296-F309 HydrophobicContact CE1-CB 3.96Å; Y296-F309 AromaticContact CE1-CD1 3.79Å; Y296-F309 HydrophobicContact CE1-CD1 3.79Å; Y296-F309 HydrophobicContact CE1-CG 4.33Å; Y296-F309 AromaticContact CE2-CD1 3.49Å; Y296-F309 HydrophobicContact CE2-CD1 3.49Å; Y296-F309 VanDerWaalsContact CE2-CD1 3.49Å; Y296-F309 AromaticContact CE2-CE1 3.78Å; Y296-F309 HydrophobicContact CE2-CE1 3.78Å; Y296-F309 HydrophobicContact CE2-CG 4.48Å; Y296-F309 HydrophobicContact CG-CD1 4.18Å; Y296-F309 AromaticContact CZ-CD1 3.42Å; Y296-F309 VanDerWaalsContact CZ-CD1 3.42Å; Y296-I310 PolarHBondContact OH-N 2.94Å; Y296-I310 PolarHBondContact OH-O 2.8Å; Y296-L359 HydrophobicContact CD2-CD1 3.86Å; Y296-L359 HydrophobicContact CD2-CD2 3.81Å; Y296-L359 HydrophobicContact CE2-CD2 4.02Å
297	K	97.3	Very high	95.8	Very high	104 Å²	104	50.2 Å²	50.2	45%	0.452	25%	0.248	S	C	.	.	H	α-helix	trans	-67.4	-27.2	173.5	-76.1	178.8	175.8	-176.7	0	113.7	V258 I293 Q294 S300	V258-K297 HydrophobicContact CB-CG 4.23Å; V258-K297 HydrophobicContact CG2-CB 4.41Å; V258-K297 HydrophobicContact CG2-CG 3.71Å; I293-K297 HydrophobicContact CD1-CG 4.24Å; I293-K297 HydrophobicContact CG1-CD 4.19Å; I293-K297 HydrophobicContact CG1-CG 4.37Å; I293-K297 VanDerWaalsContact O-CB 3.29Å; I293-K297 WeakPolarHBondContact O-CB 3.44Å; I293-K297 VanDerWaalsContact O-CG 3.29Å; I293-K297 WeakPolarHBondContact O-CG 3.23Å; I293-K297 PolarHBondContact O-N 3.48Å; Q294-K297 PolarHBondContact O-N 3.36Å; K297-S300 PolarHBondContact O-OG 2.86Å
298	L	96.8	Very high	96.1	Very high	75 Å²	75	44.4 Å²	44.4	39%	0.393	22%	0.221	S	C	.	.	H	α-helix	trans	-73.5	-41.8	170.4	-72.7	170.3	0	0	0	111.2	I31 I33 Q294 H295 Y296 K301 Y356	I31-L298 HydrophobicContact CG2-CD1 3.68Å; I33-L298 HydrophobicContact CD1-CD1 4.11Å; Q294-L298 WeakPolarHBondContact O-CG 3.15Å; Q294-L298 PolarHBondContact O-N 3.19Å; H295-L298 PolarHBondContact O-N 3.37Å; Y296-L298 VanDerWaalsContact C-N 3.33Å; Y296-L298 PolarHBondContact O-N 2.84Å; L298-K301 PolarHBondContact O-N 3.13Å; L298-Y356 HydrophobicContact CB-CD2 3.8Å; L298-Y356 HydrophobicContact CB-CE2 4.46Å; L298-Y356 HydrophobicContact CB-CG 4.44Å
299	A	98	Very high	96.4	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-68.3	-34.5	-178.6	0	0	0	0	0	113	H295 Y296 K301 E302 F303 F309 Y356 L359	H295-A299 WeakPolarHBondContact O-CB 3.4Å; H295-A299 PolarHBondContact O-N 3.22Å; Y296-A299 PolarHBondContact O-N 2.91Å; A299-K301 PolarHBondContact O-N 3.14Å; A299-K301 VanDerWaalsContact O-N 3.14Å; A299-E302 WeakPolarHBondContact O-CB 3.43Å; A299-E302 PolarHBondContact O-N 3.22Å; A299-E302 VanDerWaalsContact O-N 3.09Å; A299-F303 WeakPolarHBondContact O-CD2 3.38Å; A299-F309 HydrophobicContact CB-CE1 3.75Å; A299-F309 HydrophobicContact CB-CZ 4.18Å; A299-Y356 HydrophobicContact CB-CD2 4.19Å; A299-L359 HydrophobicContact CB-CB 3.65Å; A299-L359 HydrophobicContact CB-CD1 3.77Å; A299-L359 HydrophobicContact CB-CG 4.34Å
300	S	97.7	Very high	96.6	Very high	1 Å²	1	39.5 Å²	39.5	1%	0.007	19%	0.192	C	C	.	.	G	3₁₀ helix	trans	-58.9	-28.2	178.8	71.8	0	0	0	0	113.2	D256 Y296 K297 E302 F303 F309	D256-S300 WeakPolarHBondContact O-CB 3.41Å; D256-S300 PolarHBondContact O-OG 3.2Å; Y296-S300 PolarHBondContact O-N 3.1Å; K297-S300 PolarHBondContact O-OG 2.86Å; S300-E302 VanDerWaalsContact C-N 3.28Å; S300-E302 PolarHBondContact O-N 3.36Å; S300-F303 PolarHBondContact O-N 3.14Å; S300-F309 VanDerWaalsContact CB-CG 3.45Å
301	K	95.4	Very high	96.8	Very high	101 Å²	101	38.9 Å²	38.9	44%	0.439	18%	0.184	S	C	.	.	G	3₁₀ helix	trans	-69.7	-20.3	178.9	-54.4	-53	-179.3	-169.7	0	114	D256 L298 A299	D256-K301 HydrophobicContact CB-CD 3.97Å; D256-K301 WeakPolarHBondContact O-CD 3.37Å; D256-K301 WeakPolarHBondContact O-CE 3.27Å; D256-K301 PolarHBondContact O-NZ 2.87Å; D256-K301 WeakPolarHBondContact OD2-CD 3.44Å; D256-K301 WeakPolarHBondContact OD2-CE 3.27Å; D256-K301 IonicContact OD2-NZ 2.79Å; D256-K301 PolarHBondContact OD2-NZ 3.39Å; L298-K301 PolarHBondContact O-N 3.13Å; A299-K301 PolarHBondContact O-N 3.14Å; A299-K301 VanDerWaalsContact O-N 3.14Å
302	E	96.1	Very high	96.9	Very high	68 Å²	68	36 Å²	36	32%	0.318	17%	0.17	S	C	.	.	G	3₁₀ helix	trans	-76.7	-23.7	176.6	-64	-87.9	142.8	0	0	113	A299 S300 Y356 K360 R364	A299-E302 WeakPolarHBondContact O-CB 3.43Å; A299-E302 PolarHBondContact O-N 3.22Å; A299-E302 VanDerWaalsContact O-N 3.09Å; S300-E302 VanDerWaalsContact C-N 3.28Å; S300-E302 PolarHBondContact O-N 3.36Å; E302-Y356 HydrophobicContact CG-CE2 3.88Å; E302-Y356 PolarHBondContact OE1-OH 3.45Å; E302-K360 HydrophobicContact CG-CD 4.28Å; E302-K360 HydrophobicContact CG-CG 4.46Å; E302-R364 IonicContact OE2-CZ 2.73Å; E302-R364 IonicContact OE2-NE 2.71Å; E302-R364 IonicContact OE2-NH2 2.67Å; E302-R364 PolarHBondContact OE2-NH2 3.13Å
303	F	96.4	Very high	96.9	Very high	5 Å²	5	35.7 Å²	35.7	2%	0.022	17%	0.168	C	C	.	.	S	Bend	trans	-120.2	20.5	-164.7	-58.9	-74	0	0	0	114.5	A299 S300 N305 K306 I307 F309 R364 L367	A299-F303 WeakPolarHBondContact O-CD2 3.38Å; S300-F303 PolarHBondContact O-N 3.14Å; F303-N305 PolarHBondContact O-N 2.91Å; F303-K306 WeakPolarHBondContact O-CA 3.35Å; F303-K306 WeakPolarHBondContact O-CB 3.33Å; F303-K306 PolarHBondContact O-N 3.36Å; F303-I307 HydrophobicContact CB-CB 3.95Å; F303-I307 HydrophobicContact CB-CD1 4.43Å; F303-I307 HydrophobicContact CB-CG1 4.22Å; F303-I307 HydrophobicContact CD1-CD1 3.85Å; F303-I307 HydrophobicContact CD1-CG1 4.33Å; F303-I307 HydrophobicContact CE1-CD1 4.29Å; F303-I307 HydrophobicContact CG-CB 4.48Å; F303-I307 HydrophobicContact CG-CD1 4.09Å; F303-I307 HydrophobicContact CG-CG1 4.41Å; F303-I307 PolarHBondContact O-N 3.46Å; F303-F309 HydrophobicContact CB-CE2 3.96Å; F303-F309 AromaticContact CD2-CE2 3.68Å; F303-F309 HydrophobicContact CD2-CE2 3.68Å; F303-F309 AromaticContact CD2-CZ 3.61Å; F303-F309 HydrophobicContact CD2-CZ 3.61Å; F303-F309 HydrophobicContact CE2-CZ 4.18Å; F303-F309 HydrophobicContact CG-CE2 4.17Å; F303-R364 HydrophobicContact CE1-CG 4.06Å; F303-R364 HydrophobicContact CZ-CG 4.12Å; F303-L367 HydrophobicContact CD1-CD1 3.77Å; F303-L367 HydrophobicContact CE1-CD1 4.02Å
304	Q	93	Very high	96.9	Very high	40 Å²	40	36 Å²	36	19%	0.187	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-47.3	131.4	176.9	-171.7	155.2	31.5	0	0	112	T255 D256 K306	T255-Q304 WeakPolarHBondContact OG1-CG 3.47Å; T255-Q304 PolarHBondContact OG1-NE2 3.19Å; T255-Q304 VanDerWaalsContact OG1-NE2 3.15Å; D256-Q304 HydrophobicContact CB-CB 3.88Å; D256-Q304 HydrophobicContact CB-CG 3.89Å; D256-Q304 PolarHBondContact OD1-NE2 2.88Å; Q304-K306 PolarHBondContact O-N 2.81Å; Q304-K306 VanDerWaalsContact O-N 3.17Å
305	N	92.6	Very high	96.8	Very high	104 Å²	104	36.3 Å²	36.3	56%	0.556	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.1	13.8	-177.2	-55.6	-14.6	0	0	0	115.2	T255 F303	T255-N305 WeakPolarHBondContact CB-OD1 3.01Å; T255-N305 WeakPolarHBondContact CG2-OD1 3.35Å; T255-N305 PolarHBondContact OG1-OD1 2.8Å; F303-N305 PolarHBondContact O-N 2.91Å
306	K	95.4	Very high	96.6	Very high	125 Å²	125	35.8 Å²	35.8	54%	0.543	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-124.6	-42.3	-179.6	-61.1	173.3	-174.7	172.8	0	113	F303 Q304 L367	F303-K306 WeakPolarHBondContact O-CA 3.35Å; F303-K306 WeakPolarHBondContact O-CB 3.33Å; F303-K306 PolarHBondContact O-N 3.36Å; Q304-K306 PolarHBondContact O-N 2.81Å; Q304-K306 VanDerWaalsContact O-N 3.17Å; K306-L367 HydrophobicContact CB-CD1 4.17Å; K306-L367 HydrophobicContact CB-CD2 4.46Å; K306-L367 HydrophobicContact CD-CD1 4.2Å
307	I	97.9	Very high	96.3	Very high	0 Å²	0	40 Å²	40	0%	0	20%	0.202	C	C	.	.			trans	-138.8	123.3	175.4	-49.6	177.2	0	0	0	107.7	S276 M278 F303 F309 I338 F366 L367	S276-I307 VanDerWaalsContact O-CA 3.31Å; S276-I307 WeakPolarHBondContact O-CA 3.3Å; M278-I307 HydrophobicContact CB-CG2 3.73Å; F303-I307 HydrophobicContact CB-CB 3.95Å; F303-I307 HydrophobicContact CB-CD1 4.43Å; F303-I307 HydrophobicContact CB-CG1 4.22Å; F303-I307 HydrophobicContact CD1-CD1 3.85Å; F303-I307 HydrophobicContact CD1-CG1 4.33Å; F303-I307 HydrophobicContact CE1-CD1 4.29Å; F303-I307 HydrophobicContact CG-CB 4.48Å; F303-I307 HydrophobicContact CG-CD1 4.09Å; F303-I307 HydrophobicContact CG-CG1 4.41Å; F303-I307 PolarHBondContact O-N 3.46Å; I307-F309 HydrophobicContact CB-CE2 4.22Å; I307-F309 HydrophobicContact CG2-CD2 4.43Å; I307-F309 HydrophobicContact CG2-CE2 4.17Å; I307-I338 HydrophobicContact CD1-CD1 4.42Å; I307-F366 HydrophobicContact CD1-CD1 4.06Å; I307-L367 HydrophobicContact CD1-CD1 4.11Å; I307-L367 HydrophobicContact CD1-CD2 4.45Å; I307-L367 HydrophobicContact CD1-CG 4.06Å; I307-L367 HydrophobicContact CG1-CD1 4.29Å; I307-L367 HydrophobicContact CG1-CD2 4.22Å; I307-L367 HydrophobicContact CG1-CG 4.33Å
308	L	98.2	Very high	96.1	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	137.1	173.3	-174.1	60.3	0	0	0	109.5	I259 I269 L272 I274 S276 H277 M278 I310	I259-L308 HydrophobicContact CD1-CD1 4.08Å; I269-L308 HydrophobicContact CG2-CD2 4.11Å; L272-L308 HydrophobicContact CD1-CD1 3.86Å; L272-L308 HydrophobicContact CD1-CD2 4.07Å; I274-L308 HydrophobicContact CB-CB 4.14Å; I274-L308 HydrophobicContact CD1-CB 4.16Å; I274-L308 HydrophobicContact CD1-CD1 4.44Å; I274-L308 HydrophobicContact CG2-CB 4.3Å; S276-L308 PolarHBondContact O-N 2.92Å; H277-L308 CarbonylContact C-O 3.58Å; H277-L308 WeakPolarHBondContact CA-O 3.34Å; M278-L308 PolarHBondContact N-O 2.84Å; L308-I310 HydrophobicContact CD2-CD1 4.24Å; L308-I310 HydrophobicContact CD2-CG1 4.33Å; L308-I310 HydrophobicContact CG-CG1 4.17Å
309	F	98.6	Very high	95.9	Very high	2 Å²	2	37.6 Å²	37.6	1%	0.009	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	116.5	-178.6	-84.3	-123.2	0	0	0	110	V258 I259 M278 Y296 A299 S300 F303 I307	V258-F309 WeakPolarHBondContact CA-O 3.41Å; V258-F309 HydrophobicContact CG2-CB 4.15Å; I259-F309 PolarHBondContact N-O 3.01Å; M278-F309 HydrophobicContact CB-CD2 4.41Å; M278-F309 HydrophobicContact CB-CE2 4.36Å; M278-F309 HydrophobicContact CE-CE1 4.37Å; M278-F309 HydrophobicContact CE-CE2 4.4Å; M278-F309 HydrophobicContact CE-CZ 3.81Å; M278-F309 HydrophobicContact SD-CD1 4.2Å; M278-F309 HydrophobicContact SD-CE1 3.5Å; M278-F309 VanDerWaalsContact SD-CE1 3.5Å; M278-F309 HydrophobicContact SD-CE2 4.27Å; M278-F309 HydrophobicContact SD-CZ 3.54Å; M278-F309 VanDerWaalsContact SD-CZ 3.54Å; Y296-F309 HydrophobicContact CD1-CD1 4.16Å; Y296-F309 AromaticContact CD2-CD1 3.88Å; Y296-F309 HydrophobicContact CD2-CD1 3.88Å; Y296-F309 HydrophobicContact CD2-CE1 4.07Å; Y296-F309 HydrophobicContact CE1-CB 3.96Å; Y296-F309 AromaticContact CE1-CD1 3.79Å; Y296-F309 HydrophobicContact CE1-CD1 3.79Å; Y296-F309 HydrophobicContact CE1-CG 4.33Å; Y296-F309 AromaticContact CE2-CD1 3.49Å; Y296-F309 HydrophobicContact CE2-CD1 3.49Å; Y296-F309 VanDerWaalsContact CE2-CD1 3.49Å; Y296-F309 AromaticContact CE2-CE1 3.78Å; Y296-F309 HydrophobicContact CE2-CE1 3.78Å; Y296-F309 HydrophobicContact CE2-CG 4.48Å; Y296-F309 HydrophobicContact CG-CD1 4.18Å; Y296-F309 AromaticContact CZ-CD1 3.42Å; Y296-F309 VanDerWaalsContact CZ-CD1 3.42Å; A299-F309 HydrophobicContact CB-CE1 3.75Å; A299-F309 HydrophobicContact CB-CZ 4.18Å; S300-F309 VanDerWaalsContact CB-CG 3.45Å; F303-F309 HydrophobicContact CB-CE2 3.96Å; F303-F309 AromaticContact CD2-CE2 3.68Å; F303-F309 HydrophobicContact CD2-CE2 3.68Å; F303-F309 AromaticContact CD2-CZ 3.61Å; F303-F309 HydrophobicContact CD2-CZ 3.61Å; F303-F309 HydrophobicContact CE2-CZ 4.18Å; F303-F309 HydrophobicContact CG-CE2 4.17Å; I307-F309 HydrophobicContact CB-CE2 4.22Å; I307-F309 HydrophobicContact CG2-CD2 4.43Å; I307-F309 HydrophobicContact CG2-CE2 4.17Å
310	I	98.5	Very high	95.5	Very high	3 Å²	3	45 Å²	45	2%	0.015	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	130.9	-174.2	-57.7	-179.4	0	0	0	109.3	I259 I269 H277 M278 L279 L280 Y296 L308 V312	I259-I310 CarbonylContact O-C 3.56Å; I259-I310 WeakPolarHBondContact O-CA 3.42Å; I269-I310 HydrophobicContact CD1-CD1 4.33Å; I269-I310 HydrophobicContact CG2-CD1 3.84Å; H277-I310 HydrophobicContact CB-CD1 3.93Å; H277-I310 VanDerWaalsContact ND1-CD1 3.34Å; H277-I310 WeakPolarHBondContact ND1-CD1 3.4Å; M278-I310 PolarHBondContact O-N 3.05Å; L279-I310 CarbonylContact C-O 3.44Å; L279-I310 WeakPolarHBondContact CA-O 3.46Å; L279-I310 HydrophobicContact CG-CB 4.33Å; L280-I310 PolarHBondContact N-O 3.36Å; Y296-I310 PolarHBondContact OH-N 2.94Å; Y296-I310 PolarHBondContact OH-O 2.8Å; L308-I310 HydrophobicContact CD2-CD1 4.24Å; L308-I310 HydrophobicContact CD2-CG1 4.33Å; L308-I310 HydrophobicContact CG-CG1 4.17Å; I310-V312 HydrophobicContact CG2-CG2 4.44Å
311	L	98.6	Very high	94.8	Very high	3 Å²	3	55.1 Å²	55.1	2%	0.016	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	130.5	168.6	-179.6	148.1	0	0	0	109.6	V258 I259 E260 Y261 L280 V282 K284 F289 I293 N313	V258-L311 HydrophobicContact CG1-CB 4Å; I259-L311 PolarHBondContact O-N 3.23Å; E260-L311 HydrophobicContact CB-CD2 4.37Å; E260-L311 HydrophobicContact CG-CD2 3.74Å; Y261-L311 WeakPolarHBondContact CB-O 3.48Å; Y261-L311 PolarHBondContact N-O 3.11Å; L280-L311 HydrophobicContact CD2-CD1 4.28Å; V282-L311 HydrophobicContact CG1-CD1 3.74Å; V282-L311 HydrophobicContact CG1-CD2 4.46Å; V282-L311 HydrophobicContact CG1-CG 3.95Å; K284-L311 HydrophobicContact CD-CD2 4.15Å; F289-L311 HydrophobicContact CE2-CD1 3.65Å; F289-L311 HydrophobicContact CZ-CD1 4.25Å; I293-L311 HydrophobicContact CD1-CD1 3.88Å; L311-N313 HydrophobicContact CD2-CB 4.21Å
312	V	98.1	Very high	94.4	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	109.6	169.5	-177.9	0	0	0	0	107.5	L279 L280 F281 V282 I310 A314 N319 V322 I323	L279-V312 HydrophobicContact CD2-CG2 4.05Å; L280-V312 PolarHBondContact O-N 3.27Å; F281-V312 HydrophobicContact CD1-CB 3.73Å; F281-V312 HydrophobicContact CD1-CG1 3.86Å; F281-V312 HydrophobicContact CD1-CG2 4.2Å; F281-V312 HydrophobicContact CE1-CB 3.92Å; F281-V312 HydrophobicContact CE1-CG1 3.99Å; F281-V312 HydrophobicContact CE1-CG2 3.88Å; F281-V312 HydrophobicContact CZ-CG2 4.44Å; V282-V312 PolarHBondContact N-O 3.04Å; V282-V312 VanDerWaalsContact N-O 3.16Å; I310-V312 HydrophobicContact CG2-CG2 4.44Å; V312-A314 PolarHBondContact O-N 3.3Å; V312-N319 HydrophobicContact CG1-CB 3.99Å; V312-V322 HydrophobicContact CG1-CG1 3.85Å; V312-I323 HydrophobicContact CG1-CD1 4.47Å; V312-I323 HydrophobicContact CG1-CG1 4.09Å
313	N	97.3	Very high	94.1	Very high	10 Å²	10	49.4 Å²	49.4	5%	0.053	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	123.3	175	-175.7	19.4	0	0	0	109.6	V282 K284 L311 D315 E316 N319	V282-N313 WeakPolarHBondContact O-CA 3.13Å; V282-N313 PolarHBondContact O-OD1 2.76Å; K284-N313 HydrophobicContact CD-CB 3.86Å; K284-N313 HydrophobicContact CG-CB 4.28Å; K284-N313 PolarHBondContact N-OD1 2.95Å; L311-N313 HydrophobicContact CD2-CB 4.21Å; N313-D315 VanDerWaalsContact C-N 3.32Å; N313-D315 WeakPolarHBondContact OD1-CB 3.25Å; N313-D315 PolarHBondContact OD1-N 3.37Å; N313-D315 PolarHBondContact OD1-OD2 3.07Å; N313-E316 HydrophobicContact CB-CB 4.28Å; N313-N319 PolarHBondContact O-ND2 3.07Å
314	A	95.9	Very high	93.5	Very high	28 Å²	28	54.6 Å²	54.6	23%	0.231	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-27.7	174.6	0	0	0	0	0	112.6	V282 V312 E316 I333	V282-A314 PolarHBondContact O-N 3.05Å; V312-A314 PolarHBondContact O-N 3.3Å; A314-E316 PolarHBondContact O-N 3.14Å; A314-I333 HydrophobicContact CB-CD1 3.6Å; A314-I333 HydrophobicContact CB-CG1 4.4Å; A314-I333 HydrophobicContact CB-CG2 4.37Å
315	D	94.8	Very high	93	Very high	63 Å²	63	57.6 Å²	57.6	34%	0.337	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-4.2	-176.1	-46	-28	0	0	0	113.2	S283 K284 S285 N313 P317	S283-D315 VanDerWaalsContact CA-OD1 3.29Å; S283-D315 WeakPolarHBondContact CA-OD1 3.39Å; S283-D315 WeakPolarHBondContact CB-OD1 3.16Å; S283-D315 VanDerWaalsContact OG-CG 3.31Å; S283-D315 PolarHBondContact OG-OD1 2.89Å; S283-D315 PolarHBondContact OG-OD2 3.45Å; K284-D315 PolarHBondContact N-OD2 2.67Å; S285-D315 VanDerWaalsContact CB-OD2 3.3Å; S285-D315 WeakPolarHBondContact CB-OD2 3.3Å; S285-D315 PolarHBondContact N-OD2 2.69Å; S285-D315 PolarHBondContact OG-OD2 3.45Å; N313-D315 VanDerWaalsContact C-N 3.32Å; N313-D315 WeakPolarHBondContact OD1-CB 3.25Å; N313-D315 PolarHBondContact OD1-N 3.37Å; N313-D315 PolarHBondContact OD1-OD2 3.07Å; D315-P317 WeakPolarHBondContact O-CD 3.29Å
316	E	94.3	Very high	92.7	Very high	20 Å²	20	52.9 Å²	52.9	9%	0.093	24%	0.238	C	C	.	.			trans	-104.6	106	-174.9	172	53.5	-106.4	0	0	110.3	K91 N313 A314 R318 N319	K91-E316 WeakPolarHBondContact CE-OE2 3.39Å; K91-E316 IonicContact NZ-OE2 2.66Å; K91-E316 PolarHBondContact NZ-OE2 2.64Å; N313-E316 HydrophobicContact CB-CB 4.28Å; A314-E316 PolarHBondContact O-N 3.14Å; E316-R318 VanDerWaalsContact CD-NE 3.34Å; E316-R318 HydrophobicContact CG-CB 4.29Å; E316-R318 PolarHBondContact O-N 3.5Å; E316-R318 WeakPolarHBondContact OE1-CB 3.49Å; E316-R318 WeakPolarHBondContact OE1-CG 3.39Å; E316-R318 IonicContact OE1-CZ 3.19Å; E316-R318 PolarHBondContact OE1-N 3.24Å; E316-R318 IonicContact OE1-NE 2.98Å; E316-R318 PolarHBondContact OE1-NE 2.92Å; E316-R318 IonicContact OE1-NH2 3.6Å; E316-R318 IonicContact OE2-CZ 2.68Å; E316-R318 IonicContact OE2-NE 3.39Å; E316-R318 IonicContact OE2-NH2 2.6Å; E316-R318 PolarHBondContact OE2-NH2 2.85Å; E316-N319 WeakPolarHBondContact O-CB 3.41Å; E316-N319 PolarHBondContact O-N 3.36Å
317	P	91.7	Very high	92.2	Very high	89 Å²	89	53.4 Å²	53.4	58%	0.578	24%	0.236	S	C	*	.	G	3₁₀ helix	trans	-59.4	-25.2	-172.8	-26.6	36	0	0	0	114.7	D315 N319 R320	D315-P317 WeakPolarHBondContact O-CD 3.29Å; P317-N319 PolarHBondContact O-N 3.34Å; P317-R320 WeakPolarHBondContact O-CB 3.49Å; P317-R320 PolarHBondContact O-N 3.19Å; P317-R320 VanDerWaalsContact O-N 3.16Å
318	R	92.2	Very high	91.7	Very high	122 Å²	122	53.9 Å²	53.9	46%	0.46	24%	0.239	S	C	.	.	G	3₁₀ helix	trans	-62.6	-23.2	174.3	-67	176.8	-71.9	167.7	-0.7	112.7	E316 R320	E316-R318 VanDerWaalsContact CD-NE 3.34Å; E316-R318 HydrophobicContact CG-CB 4.29Å; E316-R318 PolarHBondContact O-N 3.5Å; E316-R318 WeakPolarHBondContact OE1-CB 3.49Å; E316-R318 WeakPolarHBondContact OE1-CG 3.39Å; E316-R318 IonicContact OE1-CZ 3.19Å; E316-R318 PolarHBondContact OE1-N 3.24Å; E316-R318 IonicContact OE1-NE 2.98Å; E316-R318 PolarHBondContact OE1-NE 2.92Å; E316-R318 IonicContact OE1-NH2 3.6Å; E316-R318 IonicContact OE2-CZ 2.68Å; E316-R318 IonicContact OE2-NE 3.39Å; E316-R318 IonicContact OE2-NH2 2.6Å; E316-R318 PolarHBondContact OE2-NH2 2.85Å; R318-R320 VanDerWaalsContact C-N 3.31Å; R318-R320 PolarHBondContact O-N 3.05Å
319	N	93.3	Very high	91.2	Very high	5 Å²	5	55.4 Å²	55.4	3%	0.027	25%	0.248	C	C	.	.	G	3₁₀ helix	trans	-80.7	-5.7	177.8	-67.6	-15.4	0	0	0	114	Y261 V312 N313 E316 P317 R321 V322 I323	Y261-N319 WeakPolarHBondContact CD1-OD1 3.46Å; V312-N319 HydrophobicContact CG1-CB 3.99Å; N313-N319 PolarHBondContact O-ND2 3.07Å; E316-N319 WeakPolarHBondContact O-CB 3.41Å; E316-N319 PolarHBondContact O-N 3.36Å; P317-N319 PolarHBondContact O-N 3.34Å; N319-R321 VanDerWaalsContact C-N 3.27Å; N319-R321 PolarHBondContact O-N 3.06Å; N319-R321 VanDerWaalsContact O-N 3.15Å; N319-V322 HydrophobicContact CB-CG1 4.07Å; N319-V322 WeakPolarHBondContact O-CG1 3.35Å; N319-V322 PolarHBondContact O-N 3.31Å; N319-I323 HydrophobicContact CB-CD1 4.15Å; N319-I323 WeakPolarHBondContact O-CG1 3.32Å; N319-I323 PolarHBondContact O-N 3.26Å; N319-I323 VanDerWaalsContact O-N 3.07Å
320	R	88.9	Confident	90.5	Very high	155 Å²	155	63.8 Å²	63.8	59%	0.585	29%	0.288	S	S	*	.	H	α-helix	trans	-49.1	-45.9	-179	-177.6	-179.9	-65	135.6	2.1	112.8	P317 R318 V322 I323 E324	P317-R320 WeakPolarHBondContact O-CB 3.49Å; P317-R320 PolarHBondContact O-N 3.19Å; P317-R320 VanDerWaalsContact O-N 3.16Å; R318-R320 VanDerWaalsContact C-N 3.31Å; R318-R320 PolarHBondContact O-N 3.05Å; R320-V322 VanDerWaalsContact C-N 3.33Å; R320-V322 PolarHBondContact O-N 3.15Å; R320-I323 WeakPolarHBondContact O-CB 3.07Å; R320-I323 PolarHBondContact O-N 2.89Å; R320-E324 WeakPolarHBondContact CD-OE1 3.38Å; R320-E324 HydrophobicContact CG-CG 4.12Å; R320-E324 VanDerWaalsContact CG-OE1 3.24Å; R320-E324 WeakPolarHBondContact CG-OE1 3.46Å; R320-E324 WeakPolarHBondContact O-CB 3.46Å; R320-E324 VanDerWaalsContact O-CG 3.27Å; R320-E324 WeakPolarHBondContact O-CG 3.34Å; R320-E324 PolarHBondContact O-N 3.48Å
321	R	83.1	Confident	89.9	Confident	214 Å²	214	65.8 Å²	65.8	81%	0.808	30%	0.3	S	S	*	.	H	α-helix	trans	-62.3	-32.6	-179.5	-70.9	-177.5	178.8	166.5	-0.1	114.5	N319 E324 Y325	N319-R321 VanDerWaalsContact C-N 3.27Å; N319-R321 PolarHBondContact O-N 3.06Å; N319-R321 VanDerWaalsContact O-N 3.15Å; R321-E324 WeakPolarHBondContact CA-OE2 3.38Å; R321-Y325 WeakPolarHBondContact O-CB 3.13Å; R321-Y325 PolarHBondContact O-N 3.02Å
322	V	88.4	Confident	89.3	Confident	22 Å²	22	67.5 Å²	67.5	13%	0.133	31%	0.309	C	S	.	.	H	α-helix	trans	-80.4	-35.8	176.1	58.9	0	0	0	0	111	Y261 V312 N319 R320 Y325 F326	Y261-V322 HydrophobicContact CD1-CG1 3.99Å; Y261-V322 HydrophobicContact CE1-CB 4.39Å; Y261-V322 HydrophobicContact CE1-CG1 3.71Å; V312-V322 HydrophobicContact CG1-CG1 3.85Å; N319-V322 HydrophobicContact CB-CG1 4.07Å; N319-V322 WeakPolarHBondContact O-CG1 3.35Å; N319-V322 PolarHBondContact O-N 3.31Å; R320-V322 VanDerWaalsContact C-N 3.33Å; R320-V322 PolarHBondContact O-N 3.15Å; V322-Y325 PolarHBondContact O-N 3.43Å; V322-F326 HydrophobicContact CG2-CD2 3.81Å; V322-F326 HydrophobicContact CG2-CE2 3.93Å; V322-F326 WeakPolarHBondContact O-CD2 3.28Å; V322-F326 PolarHBondContact O-N 3.16Å
323	I	89.5	Confident	89	Confident	27 Å²	27	69 Å²	69	14%	0.138	32%	0.317	C	S	.	.	H	α-helix	trans	-60.7	-47.5	172.8	-67	166.7	0	0	0	110.5	F281 V312 N319 R320 F326 R327 V328	F281-I323 HydrophobicContact CD1-CG1 4.14Å; F281-I323 HydrophobicContact CE1-CG1 4.41Å; V312-I323 HydrophobicContact CG1-CD1 4.47Å; V312-I323 HydrophobicContact CG1-CG1 4.09Å; N319-I323 HydrophobicContact CB-CD1 4.15Å; N319-I323 WeakPolarHBondContact O-CG1 3.32Å; N319-I323 PolarHBondContact O-N 3.26Å; N319-I323 VanDerWaalsContact O-N 3.07Å; R320-I323 WeakPolarHBondContact O-CB 3.07Å; R320-I323 PolarHBondContact O-N 2.89Å; I323-F326 PolarHBondContact O-N 3.38Å; I323-R327 PolarHBondContact O-N 2.79Å; I323-V328 HydrophobicContact CG2-CB 4.08Å; I323-V328 HydrophobicContact CG2-CG1 4.26Å; I323-V328 WeakPolarHBondContact CG2-O 2.97Å; I323-V328 PolarHBondContact O-N 2.83Å; I323-V328 VanDerWaalsContact O-N 3.08Å
324	E	82.9	Confident	89	Confident	115 Å²	115	70.7 Å²	70.7	54%	0.537	33%	0.328	S	S	.	.	H	α-helix	trans	-59.1	-47.8	173	-73.2	165.8	167.2	0	0	112.2	R320 R321 F326 R327	R320-E324 WeakPolarHBondContact CD-OE1 3.38Å; R320-E324 HydrophobicContact CG-CG 4.12Å; R320-E324 VanDerWaalsContact CG-OE1 3.24Å; R320-E324 WeakPolarHBondContact CG-OE1 3.46Å; R320-E324 WeakPolarHBondContact O-CB 3.46Å; R320-E324 VanDerWaalsContact O-CG 3.27Å; R320-E324 WeakPolarHBondContact O-CG 3.34Å; R320-E324 PolarHBondContact O-N 3.48Å; R321-E324 WeakPolarHBondContact CA-OE2 3.38Å; E324-F326 VanDerWaalsContact C-N 3.27Å; E324-F326 PolarHBondContact O-N 2.82Å; E324-R327 PolarHBondContact O-N 3.15Å
325	Y	82.3	Confident	89	Confident	103 Å²	103	70.6 Å²	70.6	40%	0.404	33%	0.326	S	S	.	.	H	α-helix	trans	-56.8	-41	178.4	177.3	-96.5	0	0	0	112	R321 V322 R327 D344 R346	R321-Y325 WeakPolarHBondContact O-CB 3.13Å; R321-Y325 PolarHBondContact O-N 3.02Å; V322-Y325 PolarHBondContact O-N 3.43Å; Y325-R327 VanDerWaalsContact C-N 3.29Å; Y325-R327 PolarHBondContact O-N 2.6Å; Y325-D344 PolarHBondContact OH-OD1 3.13Å; Y325-D344 VanDerWaalsContact OH-OD1 3.05Å; Y325-D344 PolarHBondContact OH-OD2 3.3Å; Y325-R346 PolarHBondContact O-NH1 3.45Å; Y325-R346 PolarHBondContact OH-NH2 2.86Å
326	F	87.5	Confident	89.1	Confident	5 Å²	5	67.8 Å²	67.8	2%	0.022	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.8	1.3	177.9	-83.6	-85.3	0	0	0	115	L279 F281 V322 I323 E324 V328 Q337 L339	L279-F326 HydrophobicContact CD1-CE1 3.87Å; L279-F326 HydrophobicContact CD1-CE2 4.25Å; L279-F326 HydrophobicContact CD1-CZ 3.47Å; L279-F326 VanDerWaalsContact CD1-CZ 3.47Å; L279-F326 HydrophobicContact CD2-CD2 4.24Å; L279-F326 HydrophobicContact CD2-CE1 4.46Å; L279-F326 HydrophobicContact CD2-CE2 3.51Å; L279-F326 HydrophobicContact CD2-CZ 3.63Å; L279-F326 HydrophobicContact CG-CZ 4.17Å; F281-F326 HydrophobicContact CE1-CB 4.26Å; F281-F326 HydrophobicContact CE1-CD2 4.33Å; F281-F326 HydrophobicContact CE1-CG 4.41Å; F281-F326 HydrophobicContact CE2-CB 4.26Å; F281-F326 HydrophobicContact CE2-CD1 4.4Å; F281-F326 HydrophobicContact CE2-CG 4.21Å; F281-F326 HydrophobicContact CZ-CB 3.65Å; F281-F326 HydrophobicContact CZ-CD1 4.11Å; F281-F326 AromaticContact CZ-CD2 3.67Å; F281-F326 HydrophobicContact CZ-CD2 3.67Å; F281-F326 HydrophobicContact CZ-CE2 4.34Å; F281-F326 AromaticContact CZ-CG 3.53Å; F281-F326 HydrophobicContact CZ-CG 3.53Å; V322-F326 HydrophobicContact CG2-CD2 3.81Å; V322-F326 HydrophobicContact CG2-CE2 3.93Å; V322-F326 WeakPolarHBondContact O-CD2 3.28Å; V322-F326 PolarHBondContact O-N 3.16Å; I323-F326 PolarHBondContact O-N 3.38Å; E324-F326 VanDerWaalsContact C-N 3.27Å; E324-F326 PolarHBondContact O-N 2.82Å; F326-V328 HydrophobicContact CB-CG2 3.97Å; F326-V328 PolarHBondContact O-N 2.92Å; F326-Q337 HydrophobicContact CD1-CB 4.32Å; F326-Q337 PolarHBondContact O-NE2 2.74Å; F326-L339 HydrophobicContact CE1-CB 3.89Å; F326-L339 HydrophobicContact CZ-CB 3.78Å; F326-L339 HydrophobicContact CZ-CD2 3.85Å; F326-L339 HydrophobicContact CZ-CG 4.26Å
327	R	85.1	Confident	89.2	Confident	136 Å²	136	67 Å²	67	51%	0.513	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.1	43.9	-175.7	-60.4	-175.1	172.7	-152.1	-13.1	112.1	I323 E324 Y325 D451	I323-R327 PolarHBondContact O-N 2.79Å; E324-R327 PolarHBondContact O-N 3.15Å; Y325-R327 VanDerWaalsContact C-N 3.29Å; Y325-R327 PolarHBondContact O-N 2.6Å; R327-D451 IonicContact CZ-OD2 3.14Å; R327-D451 IonicContact NE-OD2 2.73Å; R327-D451 IonicContact NH1-OD2 3.3Å; R327-D451 PolarHBondContact NH1-OD2 2.97Å
328	V	87.8	Confident	89.5	Confident	9 Å²	9	62.8 Å²	62.8	6%	0.055	28%	0.28	C	S	.	.			trans	-97.1	129.9	175.1	172.7	0	0	0	0	108.5	F281 I323 F326 D332 I333	F281-V328 HydrophobicContact CB-CG1 4.09Å; F281-V328 HydrophobicContact CD1-CG1 4.36Å; F281-V328 HydrophobicContact CD1-CG2 4.28Å; F281-V328 HydrophobicContact CD2-CG2 3.9Å; F281-V328 HydrophobicContact CE1-CG2 4.38Å; F281-V328 HydrophobicContact CE2-CG2 4.01Å; F281-V328 HydrophobicContact CG-CG1 4.12Å; F281-V328 HydrophobicContact CG-CG2 4.05Å; F281-V328 HydrophobicContact CZ-CG2 4.26Å; I323-V328 HydrophobicContact CG2-CB 4.08Å; I323-V328 HydrophobicContact CG2-CG1 4.26Å; I323-V328 WeakPolarHBondContact CG2-O 2.97Å; I323-V328 PolarHBondContact O-N 2.83Å; I323-V328 VanDerWaalsContact O-N 3.08Å; F326-V328 HydrophobicContact CB-CG2 3.97Å; F326-V328 PolarHBondContact O-N 2.92Å; V328-D332 HydrophobicContact CG1-CB 3.99Å; V328-I333 HydrophobicContact CG1-CD1 4.46Å; V328-I333 HydrophobicContact CG1-CG1 4.06Å
329	T	85.9	Confident	89.5	Confident	33 Å²	33	57.9 Å²	57.9	20%	0.202	26%	0.262	C	S	.	.			trans	-110.9	175.3	177.2	68.3	0	0	0	0	111.5	V331 D332 L454 L457	T329-V331 PolarHBondContact O-N 2.99Å; T329-V331 VanDerWaalsContact OG1-CG2 3.23Å; T329-V331 WeakPolarHBondContact OG1-CG2 3.48Å; T329-D332 WeakPolarHBondContact CB-OD2 3.4Å; T329-D332 PolarHBondContact N-OD2 2.97Å; T329-D332 WeakPolarHBondContact O-CB 3.31Å; T329-D332 PolarHBondContact O-N 2.79Å; T329-D332 VanDerWaalsContact O-N 3.13Å; T329-D332 PolarHBondContact OG1-OD2 3.05Å; T329-L454 HydrophobicContact CG2-CD2 3.9Å; T329-L457 HydrophobicContact CG2-CD1 3.81Å
330	E	85.5	Confident	89.4	Confident	178 Å²	178	59.2 Å²	59.2	83%	0.832	27%	0.27	S	S	*	.	G	3₁₀ helix	trans	-59.4	-34.3	176.4	-63.9	-177.2	-177.9	0	0	112.6	D332 I333	E330-D332 VanDerWaalsContact C-N 3.34Å; E330-I333 PolarHBondContact O-N 2.72Å
331	V	84.5	Confident	89	Confident	44 Å²	44	54.8 Å²	54.8	27%	0.267	26%	0.257	S	S	.	.	G	3₁₀ helix	trans	-76.5	-21.3	178.1	-61.6	0	0	0	0	113.3	T329 I333 L457 R459	T329-V331 PolarHBondContact O-N 2.99Å; T329-V331 VanDerWaalsContact OG1-CG2 3.23Å; T329-V331 WeakPolarHBondContact OG1-CG2 3.48Å; V331-I333 VanDerWaalsContact C-N 3.28Å; V331-L457 HydrophobicContact CG2-CB 4.38Å; V331-R459 HydrophobicContact CB-CB 4.4Å; V331-R459 VanDerWaalsContact O-CZ 3.28Å; V331-R459 PolarHBondContact O-NH2 3.45Å
332	D	86.4	Confident	89	Confident	40 Å²	40	49 Å²	49	21%	0.214	25%	0.249	C	C	.	.	G	3₁₀ helix	trans	-76.4	-10.1	170.8	-65.1	-77.1	0	0	0	112.9	V328 T329 E330 P334 S335	V328-D332 HydrophobicContact CG1-CB 3.99Å; T329-D332 WeakPolarHBondContact CB-OD2 3.4Å; T329-D332 PolarHBondContact N-OD2 2.97Å; T329-D332 WeakPolarHBondContact O-CB 3.31Å; T329-D332 PolarHBondContact O-N 2.79Å; T329-D332 VanDerWaalsContact O-N 3.13Å; T329-D332 PolarHBondContact OG1-OD2 3.05Å; E330-D332 VanDerWaalsContact C-N 3.34Å; D332-P334 CarbonylContact O-C 3.53Å; D332-S335 WeakPolarHBondContact O-CB 3.48Å; D332-S335 PolarHBondContact O-N 3.08Å; D332-S335 PolarHBondContact O-OG 3.15Å
333	I	92.8	Very high	88.7	Confident	32 Å²	32	51.2 Å²	51.2	16%	0.164	27%	0.266	C	S	.	.			trans	-88.5	133.3	-175.6	-71.1	159.6	0	0	0	110.6	A314 V328 E330 V331 R459	A314-I333 HydrophobicContact CB-CD1 3.6Å; A314-I333 HydrophobicContact CB-CG1 4.4Å; A314-I333 HydrophobicContact CB-CG2 4.37Å; V328-I333 HydrophobicContact CG1-CD1 4.46Å; V328-I333 HydrophobicContact CG1-CG1 4.06Å; E330-I333 PolarHBondContact O-N 2.72Å; V331-I333 VanDerWaalsContact C-N 3.28Å; I333-R459 PolarHBondContact O-NH2 2.94Å
334	P	96.5	Very high	88.3	Confident	45 Å²	45	53 Å²	53	29%	0.292	28%	0.276	S	S	.	.	S	Bend	cis	-81.2	146.2	-8.4	35.3	-34.6	0	0	0	112.5	F281 V282 I292 D332 I354	F281-P334 CarbonylContact O-C 3.52Å; F281-P334 WeakPolarHBondContact O-CA 3.41Å; F281-P334 WeakPolarHBondContact O-CB 3.24Å; V282-P334 HydrophobicContact CB-CB 4.22Å; V282-P334 HydrophobicContact CG2-CB 4.06Å; I292-P334 HydrophobicContact CD1-CB 4.13Å; I292-P334 HydrophobicContact CD1-CG 3.75Å; D332-P334 CarbonylContact O-C 3.53Å; P334-I354 HydrophobicContact CB-CD1 3.77Å; P334-I354 HydrophobicContact CG-CD1 3.99Å
335	S	95.3	Very high	88.3	Confident	26 Å²	26	47.6 Å²	47.6	18%	0.182	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	167.2	176	50	0	0	0	0	112.6	F281 D332	F281-S335 PolarHBondContact N-O 2.99Å; F281-S335 PolarHBondContact O-N 2.69Å; D332-S335 WeakPolarHBondContact O-CB 3.48Å; D332-S335 PolarHBondContact O-N 3.08Å; D332-S335 PolarHBondContact O-OG 3.15Å
336	V	98.1	Very high	88.6	Confident	4 Å²	4	44.8 Å²	44.8	2%	0.024	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	131.8	-179.3	-176.7	0	0	0	0	110.1	M278 L279 L280 M349 I354 L359 F362	M278-V336 HydrophobicContact CG-CG1 3.52Å; M278-V336 HydrophobicContact SD-CG1 3.76Å; L279-V336 VanDerWaalsContact O-CA 3.3Å; L279-V336 WeakPolarHBondContact O-CA 3.49Å; L280-V336 HydrophobicContact CD1-CG2 3.85Å; V336-M349 HydrophobicContact CB-CB 4.02Å; V336-M349 HydrophobicContact CB-CE 4.24Å; V336-M349 HydrophobicContact CB-SD 4.19Å; V336-M349 HydrophobicContact CG2-CE 4.18Å; V336-M349 HydrophobicContact CG2-SD 4.46Å; V336-M349 WeakPolarHBondContact O-CB 3.04Å; V336-M349 PolarHBondContact O-N 3.07Å; V336-I354 HydrophobicContact CG2-CD1 4.08Å; V336-I354 HydrophobicContact CG2-CG1 4.26Å; V336-I354 HydrophobicContact CG2-CG2 3.88Å; V336-L359 HydrophobicContact CB-CD2 4.48Å; V336-L359 HydrophobicContact CG1-CD2 4.02Å; V336-L359 HydrophobicContact CG2-CD2 4Å; V336-F362 HydrophobicContact CG1-CD1 4.41Å; V336-F362 HydrophobicContact CG1-CE1 4.24Å
337	Q	96.3	Very high	88.8	Confident	4 Å²	4	46.5 Å²	46.5	2%	0.019	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	163	170	-58.6	-160.7	36.6	0	0	111.3	M278 L279 F281 F326 Y347 K348	M278-Q337 CarbonylContact C-O 3.49Å; M278-Q337 WeakPolarHBondContact CA-O 3.25Å; L279-Q337 PolarHBondContact N-O 2.95Å; L279-Q337 PolarHBondContact O-N 3.48Å; F281-Q337 HydrophobicContact CE2-CB 4.37Å; F281-Q337 HydrophobicContact CE2-CG 4.28Å; F326-Q337 HydrophobicContact CD1-CB 4.32Å; F326-Q337 PolarHBondContact O-NE2 2.74Å; Q337-Y347 CarbonylContact C-O 3.57Å; Q337-Y347 WeakPolarHBondContact CA-O 3.29Å; Q337-Y347 WeakPolarHBondContact CB-O 3.3Å; Q337-K348 HydrophobicContact CG-CG 4.19Å
338	I	97.4	Very high	89.1	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	136.7	161.2	-67.7	166.5	0	0	0	108.7	H277 M278 I307 R346 Y347 F362 F366	H277-I338 CarbonylContact O-C 3.44Å; H277-I338 VanDerWaalsContact O-CA 3.26Å; H277-I338 WeakPolarHBondContact O-CA 3.43Å; M278-I338 HydrophobicContact CB-CG1 4.01Å; M278-I338 HydrophobicContact CE-CD1 3.85Å; M278-I338 HydrophobicContact CE-CG1 4.07Å; M278-I338 HydrophobicContact CG-CG1 3.99Å; I307-I338 HydrophobicContact CD1-CD1 4.42Å; I338-R346 CarbonylContact O-C 3.58Å; I338-R346 WeakPolarHBondContact O-CA 3.49Å; I338-Y347 PolarHBondContact N-O 3.28Å; I338-Y347 PolarHBondContact O-N 3.38Å; I338-F362 HydrophobicContact CB-CE1 4.39Å; I338-F362 HydrophobicContact CB-CZ 4.15Å; I338-F362 HydrophobicContact CD1-CD1 3.98Å; I338-F362 HydrophobicContact CD1-CD2 4.46Å; I338-F362 HydrophobicContact CD1-CE1 3.64Å; I338-F362 HydrophobicContact CD1-CE2 4.15Å; I338-F362 HydrophobicContact CD1-CG 4.37Å; I338-F362 HydrophobicContact CD1-CZ 3.71Å; I338-F362 HydrophobicContact CG1-CD1 4.32Å; I338-F362 HydrophobicContact CG1-CE1 3.6Å; I338-F362 HydrophobicContact CG1-CZ 3.79Å; I338-F366 HydrophobicContact CB-CD2 4.38Å; I338-F366 HydrophobicContact CD1-CB 3.62Å; I338-F366 HydrophobicContact CD1-CD1 4.08Å; I338-F366 HydrophobicContact CD1-CD2 4.33Å; I338-F366 HydrophobicContact CD1-CG 3.75Å; I338-F366 HydrophobicContact CG2-CD1 4.01Å; I338-F366 HydrophobicContact CG2-CD2 3.73Å; I338-F366 HydrophobicContact CG2-CE1 3.88Å; I338-F366 HydrophobicContact CG2-CE2 3.58Å; I338-F366 HydrophobicContact CG2-CG 3.95Å; I338-F366 HydrophobicContact CG2-CZ 3.65Å
339	L	93.1	Very high	89.4	Confident	18 Å²	18	41.9 Å²	41.9	9%	0.094	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	130.5	167.6	177.9	66.9	0	0	0	109.8	S276 H277 L279 F326 L341 D344 R346	S276-L339 CarbonylContact C-O 3.56Å; S276-L339 VanDerWaalsContact CA-O 3.32Å; S276-L339 WeakPolarHBondContact CA-O 3.32Å; H277-L339 PolarHBondContact N-O 2.9Å; H277-L339 PolarHBondContact O-N 3.04Å; L279-L339 HydrophobicContact CD1-CB 4.13Å; F326-L339 HydrophobicContact CE1-CB 3.89Å; F326-L339 HydrophobicContact CZ-CB 3.78Å; F326-L339 HydrophobicContact CZ-CD2 3.85Å; F326-L339 HydrophobicContact CZ-CG 4.26Å; L339-L341 HydrophobicContact CD2-CD1 4Å; L339-L341 HydrophobicContact CD2-CG 4.38Å; L339-L341 HydrophobicContact CG-CD1 4.12Å; L339-D344 VanDerWaalsContact CD1-OD1 3.32Å; L339-D344 WeakPolarHBondContact CD1-OD1 2.98Å; L339-R346 HydrophobicContact CD1-CG 3.83Å
340	N	89.6	Confident	89.6	Confident	33 Å²	33	43.5 Å²	43.5	18%	0.176	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	114.5	160.8	179.6	-90.5	0	0	0	109.6	S276 S342 S343 D344 A345 F366	S276-N340 PolarHBondContact OG-ND2 3.35Å; N340-S342 VanDerWaalsContact C-N 3.29Å; N340-S342 PolarHBondContact O-N 2.69Å; N340-S342 PolarHBondContact OD1-N 3.23Å; N340-S343 PolarHBondContact O-N 2.83Å; N340-S343 PolarHBondContact OD1-N 2.95Å; N340-S343 PolarHBondContact OD1-OG 3.21Å; N340-D344 WeakPolarHBondContact O-CA 3.45Å; N340-D344 PolarHBondContact O-N 2.93Å; N340-A345 HydrophobicContact CB-CB 4.31Å; N340-A345 PolarHBondContact N-O 3.13Å; N340-A345 PolarHBondContact O-N 3.33Å; N340-F366 HydrophobicContact CB-CE2 4.45Å; N340-F366 HydrophobicContact CB-CZ 4.28Å
341	L	82.3	Confident	89.8	Confident	63 Å²	63	36.2 Å²	36.2	33%	0.33	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-30.6	-172.8	-82.9	68.1	0	0	0	112.6	M275 H277 L339 S343	M275-L341 PolarHBondContact O-N 3.04Å; H277-L341 HydrophobicContact CB-CD1 4.31Å; L339-L341 HydrophobicContact CD2-CD1 4Å; L339-L341 HydrophobicContact CD2-CG 4.38Å; L339-L341 HydrophobicContact CG-CD1 4.12Å; L341-S343 VanDerWaalsContact C-N 3.28Å; L341-S343 PolarHBondContact O-N 3.06Å
342	S	81.4	Confident	89.9	Confident	91 Å²	91	37.1 Å²	37.1	64%	0.636	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.7	-13.6	-176.9	-45.2	0	0	0	0	114.3	N340	N340-S342 VanDerWaalsContact C-N 3.29Å; N340-S342 PolarHBondContact O-N 2.69Å; N340-S342 PolarHBondContact OD1-N 3.23Å
343	S	82.8	Confident	90.2	Very high	69 Å²	69	40.2 Å²	40.2	48%	0.483	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-138.4	2.8	-173.6	60.7	0	0	0	0	114.9	N340 L341 A345	N340-S343 PolarHBondContact O-N 2.83Å; N340-S343 PolarHBondContact OD1-N 2.95Å; N340-S343 PolarHBondContact OD1-OG 3.21Å; L341-S343 VanDerWaalsContact C-N 3.28Å; L341-S343 PolarHBondContact O-N 3.06Å; S343-A345 PolarHBondContact O-N 3.27Å; S343-A345 VanDerWaalsContact OG-CB 3.29Å; S343-A345 WeakPolarHBondContact OG-CB 3.44Å
344	D	80.3	Confident	90.4	Very high	64 Å²	64	39.5 Å²	39.5	34%	0.342	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	43.2	35.1	-166.8	-162	-2.1	0	0	0	112.9	Y325 L339 N340 R346	Y325-D344 PolarHBondContact OH-OD1 3.13Å; Y325-D344 VanDerWaalsContact OH-OD1 3.05Å; Y325-D344 PolarHBondContact OH-OD2 3.3Å; L339-D344 VanDerWaalsContact CD1-OD1 3.32Å; L339-D344 WeakPolarHBondContact CD1-OD1 2.98Å; N340-D344 WeakPolarHBondContact O-CA 3.45Å; N340-D344 PolarHBondContact O-N 2.93Å; D344-R346 VanDerWaalsContact CG-NH2 3.25Å; D344-R346 IonicContact OD1-CZ 3.62Å; D344-R346 VanDerWaalsContact OD1-CZ 3.28Å; D344-R346 IonicContact OD1-NE 3.91Å; D344-R346 PolarHBondContact OD1-NE 3.08Å; D344-R346 IonicContact OD1-NH2 2.67Å; D344-R346 PolarHBondContact OD1-NH2 3.01Å; D344-R346 IonicContact OD2-CZ 3.86Å; D344-R346 IonicContact OD2-NE 2.67Å; D344-R346 IonicContact OD2-NH2 2.64Å; D344-R346 PolarHBondContact OD2-NH2 3.47Å
345	A	84.2	Confident	90.4	Very high	3 Å²	3	39.3 Å²	39.3	3%	0.025	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	121.9	178.7	0	0	0	0	0	109.3	N340 S343 Y347 K373	N340-A345 HydrophobicContact CB-CB 4.31Å; N340-A345 PolarHBondContact N-O 3.13Å; N340-A345 PolarHBondContact O-N 3.33Å; S343-A345 PolarHBondContact O-N 3.27Å; S343-A345 VanDerWaalsContact OG-CB 3.29Å; S343-A345 WeakPolarHBondContact OG-CB 3.44Å; A345-Y347 HydrophobicContact CB-CE2 3.65Å; A345-Y347 WeakPolarHBondContact O-CE2 3.18Å; A345-K373 HydrophobicContact CB-CD 4.08Å
346	R	88.8	Confident	90.5	Very high	43 Å²	43	39.4 Å²	39.4	16%	0.162	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	144.8	-175.5	-59.3	166.1	-156.5	-173.3	-0.3	109.7	Y325 I338 L339 D344 H374	Y325-R346 PolarHBondContact O-NH1 3.45Å; Y325-R346 PolarHBondContact OH-NH2 2.86Å; I338-R346 CarbonylContact O-C 3.58Å; I338-R346 WeakPolarHBondContact O-CA 3.49Å; L339-R346 HydrophobicContact CD1-CG 3.83Å; D344-R346 VanDerWaalsContact CG-NH2 3.25Å; D344-R346 IonicContact OD1-CZ 3.62Å; D344-R346 VanDerWaalsContact OD1-CZ 3.28Å; D344-R346 IonicContact OD1-NE 3.91Å; D344-R346 PolarHBondContact OD1-NE 3.08Å; D344-R346 IonicContact OD1-NH2 2.67Å; D344-R346 PolarHBondContact OD1-NH2 3.01Å; D344-R346 IonicContact OD2-CZ 3.86Å; D344-R346 IonicContact OD2-NE 2.67Å; D344-R346 IonicContact OD2-NH2 2.64Å; D344-R346 PolarHBondContact OD2-NH2 3.47Å; R346-H374 PolarHBondContact O-N 3.01Å
347	Y	91.1	Very high	90.4	Very high	42 Å²	42	42.8 Å²	42.8	17%	0.165	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	122.7	-175.2	-57.2	-99.5	0	0	0	107.4	Q337 I338 A345 F362 F366 A371 K372 K373	Q337-Y347 CarbonylContact C-O 3.57Å; Q337-Y347 WeakPolarHBondContact CA-O 3.29Å; Q337-Y347 WeakPolarHBondContact CB-O 3.3Å; I338-Y347 PolarHBondContact N-O 3.28Å; I338-Y347 PolarHBondContact O-N 3.38Å; A345-Y347 HydrophobicContact CB-CE2 3.65Å; A345-Y347 WeakPolarHBondContact O-CE2 3.18Å; Y347-F362 WeakPolarHBondContact O-CZ 3.49Å; Y347-F366 HydrophobicContact CD1-CD2 4.4Å; Y347-F366 AromaticContact CD2-CD2 3.83Å; Y347-F366 HydrophobicContact CD2-CD2 3.83Å; Y347-F366 AromaticContact CD2-CE2 3.78Å; Y347-F366 HydrophobicContact CD2-CE2 3.78Å; Y347-F366 HydrophobicContact CE1-CD2 4.46Å; Y347-F366 AromaticContact CE2-CD2 3.92Å; Y347-F366 HydrophobicContact CE2-CD2 3.92Å; Y347-F366 AromaticContact CE2-CE2 3.56Å; Y347-F366 HydrophobicContact CE2-CE2 3.56Å; Y347-F366 HydrophobicContact CG-CD2 4.12Å; Y347-A371 HydrophobicContact CD1-CB 3.63Å; Y347-A371 HydrophobicContact CE1-CB 4.21Å; Y347-A371 WeakPolarHBondContact CE1-O 3.41Å; Y347-A371 HydrophobicContact CG-CB 4.41Å; Y347-K372 VanDerWaalsContact CD1-O 3.25Å; Y347-K372 WeakPolarHBondContact CD1-O 3.49Å; Y347-K373 HydrophobicContact CD1-CB 4.44Å; Y347-K373 HydrophobicContact CE1-CB 3.91Å
348	K	91.3	Very high	90.5	Very high	36 Å²	36	44.5 Å²	44.5	16%	0.157	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	142.2	172.6	-63.6	-170.8	179.5	-175.4	0	109.4	Q337 H374	Q337-K348 HydrophobicContact CG-CG 4.19Å; K348-H374 WeakPolarHBondContact CE-NE2 3.27Å; K348-H374 HydrophobicContact CG-CB 4.36Å
349	M	94.4	Very high	90.5	Very high	12 Å²	12	44.5 Å²	44.5	6%	0.059	25%	0.245	C	C	.	.			trans	-66.6	126.9	178.4	-176.6	172.9	71.6	0	0	110.6	V336 S351 I354 N358 L359 F362 W416	V336-M349 HydrophobicContact CB-CB 4.02Å; V336-M349 HydrophobicContact CB-CE 4.24Å; V336-M349 HydrophobicContact CB-SD 4.19Å; V336-M349 HydrophobicContact CG2-CE 4.18Å; V336-M349 HydrophobicContact CG2-SD 4.46Å; V336-M349 WeakPolarHBondContact O-CB 3.04Å; V336-M349 PolarHBondContact O-N 3.07Å; M349-S351 PolarHBondContact O-N 3.33Å; M349-I354 HydrophobicContact CE-CB 4.43Å; M349-I354 HydrophobicContact CE-CG1 3.97Å; M349-N358 HydrophobicContact SD-CB 4.43Å; M349-L359 HydrophobicContact SD-CD2 4.05Å; M349-L359 HydrophobicContact SD-CG 4.46Å; M349-F362 HydrophobicContact CB-CD1 3.6Å; M349-F362 HydrophobicContact CB-CE1 3.69Å; M349-F362 HydrophobicContact CB-CG 4.09Å; M349-F362 HydrophobicContact CB-CZ 4.26Å; M349-F362 HydrophobicContact CG-CB 3.94Å; M349-F362 HydrophobicContact CG-CD1 3.64Å; M349-F362 HydrophobicContact CG-CE1 4.27Å; M349-F362 HydrophobicContact CG-CG 3.81Å; M349-F362 HydrophobicContact SD-CB 4.41Å; M349-F362 HydrophobicContact SD-CD1 4.21Å; M349-W416 WeakPolarHBondContact O-CZ2 3.4Å
350	P	90	Very high	90.8	Very high	67 Å²	67	44.9 Å²	44.9	44%	0.435	25%	0.246	S	C	.	.	S	Bend	trans	-83.2	54.5	-176.8	34.8	-36.8	0	0	0	112.5	W416	P350-W416 VanDerWaalsContact C-CD2 3.43Å; P350-W416 VanDerWaalsContact C-CG 3.46Å; P350-W416 VanDerWaalsContact CA-CD2 3.47Å; P350-W416 HydrophobicContact CB-CD2 4.01Å; P350-W416 HydrophobicContact CB-CE3 3.58Å; P350-W416 HydrophobicContact CB-CH2 4.34Å; P350-W416 HydrophobicContact CB-CZ3 3.78Å
351	S	90.1	Very high	91.2	Very high	24 Å²	24	50.7 Å²	50.7	17%	0.168	27%	0.27	C	S	.	.			trans	-161.5	142.4	176.7	-172	0	0	0	0	111.5	M349 D353 N358 W416	M349-S351 PolarHBondContact O-N 3.33Å; S351-D353 PolarHBondContact OG-N 3.45Å; S351-N358 PolarHBondContact OG-ND2 3.48Å; S351-W416 VanDerWaalsContact CA-CD1 3.49Å
352	D	86.1	Confident	91.9	Very high	63 Å²	63	47.9 Å²	47.9	34%	0.337	26%	0.255	S	S	.	.	S	Bend	trans	-74.5	-28	174.6	-52.6	-1.1	0	0	0	111.3	W416 S417 Y460	D352-W416 PolarHBondContact OD1-NE1 2.88Å; D352-S417 WeakPolarHBondContact OD1-CB 3.23Å; D352-S417 WeakPolarHBondContact OD2-CA 3.32Å; D352-S417 WeakPolarHBondContact OD2-CB 3.36Å; D352-S417 PolarHBondContact OD2-OG 3.47Å; D352-Y460 PolarHBondContact OD1-OH 2.8Å
353	D	91.9	Very high	92.7	Very high	106 Å²	106	43.5 Å²	43.5	57%	0.567	22%	0.224	S	C	*	.	S	Bend	trans	-100.1	115.4	-171.5	-55.7	-63.7	0	0	0	112	S351 T355 N358	S351-D353 PolarHBondContact OG-N 3.45Å; D353-T355 VanDerWaalsContact C-N 3.3Å; D353-T355 HydrophobicContact CB-CG2 4.09Å; D353-T355 PolarHBondContact O-N 3.34Å; D353-N358 WeakPolarHBondContact O-CB 3.13Å; D353-N358 PolarHBondContact O-ND2 2.89Å
354	I	96.7	Very high	93.4	Very high	16 Å²	16	46.7 Å²	46.7	8%	0.082	23%	0.226	C	C	.	.			trans	-80.9	75.5	179.4	-47.5	175.1	0	0	0	110.9	L280 I292 H295 P334 V336 M349 L359	L280-I354 HydrophobicContact CD1-CD1 3.87Å; L280-I354 HydrophobicContact CD1-CG2 4.49Å; I292-I354 HydrophobicContact CD1-CD1 4.45Å; I292-I354 HydrophobicContact CG1-CB 4.49Å; I292-I354 HydrophobicContact CG2-CB 4.22Å; I292-I354 HydrophobicContact CG2-CD1 4.22Å; I292-I354 HydrophobicContact CG2-CG2 3.91Å; H295-I354 PolarHBondContact CD2-O 2.62Å; P334-I354 HydrophobicContact CB-CD1 3.77Å; P334-I354 HydrophobicContact CG-CD1 3.99Å; V336-I354 HydrophobicContact CG2-CD1 4.08Å; V336-I354 HydrophobicContact CG2-CG1 4.26Å; V336-I354 HydrophobicContact CG2-CG2 3.88Å; M349-I354 HydrophobicContact CE-CB 4.43Å; M349-I354 HydrophobicContact CE-CG1 3.97Å; I354-L359 HydrophobicContact CG2-CD1 4.13Å; I354-L359 HydrophobicContact CG2-CD2 4.12Å; I354-L359 HydrophobicContact CG2-CG 4.25Å
355	T	96.9	Very high	94.2	Very high	42 Å²	42	45.2 Å²	45.2	26%	0.258	22%	0.22	S	C	.	.			trans	-106.8	158.7	177.7	71.3	0	0	0	0	112.3	D353 E357 N358 L359	D353-T355 VanDerWaalsContact C-N 3.3Å; D353-T355 HydrophobicContact CB-CG2 4.09Å; D353-T355 PolarHBondContact O-N 3.34Å; T355-E357 VanDerWaalsContact C-N 3.31Å; T355-E357 PolarHBondContact O-N 3.23Å; T355-N358 PolarHBondContact O-N 3.43Å; T355-N358 WeakPolarHBondContact OG1-CB 3.47Å; T355-N358 VanDerWaalsContact OG1-CG 3.29Å; T355-N358 PolarHBondContact OG1-N 3.38Å; T355-N358 PolarHBondContact OG1-ND2 3.46Å; T355-L359 WeakPolarHBondContact O-CB 3.39Å; T355-L359 WeakPolarHBondContact O-CD1 3.4Å; T355-L359 VanDerWaalsContact O-CG 3.24Å; T355-L359 WeakPolarHBondContact O-CG 3.46Å; T355-L359 PolarHBondContact O-N 3.02Å
356	Y	97.4	Very high	94.8	Very high	27 Å²	27	46 Å²	46	11%	0.106	22%	0.223	C	C	.	.	H	α-helix	trans	-53.9	-45	176.2	159.2	-95.5	0	0	0	112.1	I31 H295 L298 A299 E302 L359 K360	I31-Y356 HydrophobicContact CD1-CD1 3.16Å; I31-Y356 HydrophobicContact CD1-CE1 3.36Å; I31-Y356 HydrophobicContact CD1-CG 3.88Å; H295-Y356 PolarHBondContact ND1-N 2.74Å; H295-Y356 VanDerWaalsContact ND1-N 3.14Å; L298-Y356 HydrophobicContact CB-CD2 3.8Å; L298-Y356 HydrophobicContact CB-CE2 4.46Å; L298-Y356 HydrophobicContact CB-CG 4.44Å; A299-Y356 HydrophobicContact CB-CD2 4.19Å; E302-Y356 HydrophobicContact CG-CE2 3.88Å; E302-Y356 PolarHBondContact OE1-OH 3.45Å; Y356-L359 PolarHBondContact O-N 2.66Å; Y356-K360 HydrophobicContact CD1-CD 4.33Å; Y356-K360 HydrophobicContact CE1-CD 3.64Å; Y356-K360 VanDerWaalsContact CE1-NZ 3.28Å; Y356-K360 HydrophobicContact CE2-CD 3.97Å; Y356-K360 VanDerWaalsContact CZ-CD 3.4Å; Y356-K360 WeakPolarHBondContact O-CB 3.41Å; Y356-K360 PolarHBondContact O-N 3.27Å; Y356-K360 WeakPolarHBondContact OH-CD 3.4Å; Y356-K360 WeakPolarHBondContact OH-CE 3.29Å; Y356-K360 PolarHBondContact OH-NZ 3.01Å
357	E	97.1	Very high	95.1	Very high	75 Å²	75	47.7 Å²	47.7	35%	0.35	24%	0.235	S	C	.	.	H	α-helix	trans	-69.9	-34.4	179.8	-69.3	-60.4	166.2	0	0	112.7	T355 K360 K361	T355-E357 VanDerWaalsContact C-N 3.31Å; T355-E357 PolarHBondContact O-N 3.23Å; E357-K360 VanDerWaalsContact CD-NZ 3.26Å; E357-K360 IonicContact OE1-NZ 3.66Å; E357-K360 PolarHBondContact OE1-NZ 3.4Å; E357-K360 VanDerWaalsContact OE2-CD 3.32Å; E357-K360 WeakPolarHBondContact OE2-CD 3.1Å; E357-K360 VanDerWaalsContact OE2-CE 3.24Å; E357-K360 WeakPolarHBondContact OE2-CE 3.49Å; E357-K360 IonicContact OE2-NZ 2.69Å; E357-K360 PolarHBondContact OE2-NZ 3.16Å; E357-K361 WeakPolarHBondContact O-CB 3.41Å; E357-K361 PolarHBondContact O-N 3.41Å
358	N	97.3	Very high	95.4	Very high	41 Å²	41	48.8 Å²	48.8	22%	0.219	25%	0.249	C	C	.	.	H	α-helix	trans	-68.8	-43.6	175.2	-70	-27.8	0	0	0	111.6	M349 S351 D353 T355 K361 F362	M349-N358 HydrophobicContact SD-CB 4.43Å; S351-N358 PolarHBondContact OG-ND2 3.48Å; D353-N358 WeakPolarHBondContact O-CB 3.13Å; D353-N358 PolarHBondContact O-ND2 2.89Å; T355-N358 PolarHBondContact O-N 3.43Å; T355-N358 WeakPolarHBondContact OG1-CB 3.47Å; T355-N358 VanDerWaalsContact OG1-CG 3.29Å; T355-N358 PolarHBondContact OG1-N 3.38Å; T355-N358 PolarHBondContact OG1-ND2 3.46Å; N358-K361 PolarHBondContact O-N 3.17Å; N358-F362 VanDerWaalsContact O-CB 3.27Å; N358-F362 WeakPolarHBondContact O-CB 3.44Å; N358-F362 PolarHBondContact O-N 3.23Å
359	L	98.5	Very high	95.4	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-60	-45.7	173.6	-69.6	164.6	0	0	0	111.9	M278 H295 Y296 A299 V336 M349 I354 T355 Y356 F362 G363	M278-L359 HydrophobicContact SD-CD2 3.78Å; H295-L359 HydrophobicContact CB-CD1 4.37Å; Y296-L359 HydrophobicContact CD2-CD1 3.86Å; Y296-L359 HydrophobicContact CD2-CD2 3.81Å; Y296-L359 HydrophobicContact CE2-CD2 4.02Å; A299-L359 HydrophobicContact CB-CB 3.65Å; A299-L359 HydrophobicContact CB-CD1 3.77Å; A299-L359 HydrophobicContact CB-CG 4.34Å; V336-L359 HydrophobicContact CB-CD2 4.48Å; V336-L359 HydrophobicContact CG1-CD2 4.02Å; V336-L359 HydrophobicContact CG2-CD2 4Å; M349-L359 HydrophobicContact SD-CD2 4.05Å; M349-L359 HydrophobicContact SD-CG 4.46Å; I354-L359 HydrophobicContact CG2-CD1 4.13Å; I354-L359 HydrophobicContact CG2-CD2 4.12Å; I354-L359 HydrophobicContact CG2-CG 4.25Å; T355-L359 WeakPolarHBondContact O-CB 3.39Å; T355-L359 WeakPolarHBondContact O-CD1 3.4Å; T355-L359 VanDerWaalsContact O-CG 3.24Å; T355-L359 WeakPolarHBondContact O-CG 3.46Å; T355-L359 PolarHBondContact O-N 3.02Å; Y356-L359 PolarHBondContact O-N 2.66Å; L359-F362 PolarHBondContact O-N 3.29Å; L359-G363 PolarHBondContact O-N 2.82Å
360	K	98	Very high	95.3	Very high	26 Å²	26	61.6 Å²	61.6	11%	0.113	31%	0.31	C	S	.	.	H	α-helix	trans	-65	-43.9	177.7	173.8	172.8	156.3	-160.6	0	112.1	E302 Y356 E357 F362 R364	E302-K360 HydrophobicContact CG-CD 4.28Å; E302-K360 HydrophobicContact CG-CG 4.46Å; Y356-K360 HydrophobicContact CD1-CD 4.33Å; Y356-K360 HydrophobicContact CE1-CD 3.64Å; Y356-K360 VanDerWaalsContact CE1-NZ 3.28Å; Y356-K360 HydrophobicContact CE2-CD 3.97Å; Y356-K360 VanDerWaalsContact CZ-CD 3.4Å; Y356-K360 WeakPolarHBondContact O-CB 3.41Å; Y356-K360 PolarHBondContact O-N 3.27Å; Y356-K360 WeakPolarHBondContact OH-CD 3.4Å; Y356-K360 WeakPolarHBondContact OH-CE 3.29Å; Y356-K360 PolarHBondContact OH-NZ 3.01Å; E357-K360 VanDerWaalsContact CD-NZ 3.26Å; E357-K360 IonicContact OE1-NZ 3.66Å; E357-K360 PolarHBondContact OE1-NZ 3.4Å; E357-K360 VanDerWaalsContact OE2-CD 3.32Å; E357-K360 WeakPolarHBondContact OE2-CD 3.1Å; E357-K360 VanDerWaalsContact OE2-CE 3.24Å; E357-K360 WeakPolarHBondContact OE2-CE 3.49Å; E357-K360 IonicContact OE2-NZ 2.69Å; E357-K360 PolarHBondContact OE2-NZ 3.16Å; K360-F362 VanDerWaalsContact C-N 3.35Å; K360-R364 VanDerWaalsContact O-CB 3.28Å; K360-R364 WeakPolarHBondContact O-CB 3.49Å; K360-R364 WeakPolarHBondContact O-CD 3.48Å; K360-R364 WeakPolarHBondContact O-CG 3.26Å; K360-R364 PolarHBondContact O-N 2.88Å
361	K	97.8	Very high	95.2	Very high	154 Å²	154	59.1 Å²	59.1	67%	0.67	30%	0.296	S	S	*	.	H	α-helix	trans	-61.5	-42.6	172.4	-178	177.9	179.4	-179.7	0	111.4	E357 N358 S365	E357-K361 WeakPolarHBondContact O-CB 3.41Å; E357-K361 PolarHBondContact O-N 3.41Å; N358-K361 PolarHBondContact O-N 3.17Å; K361-S365 VanDerWaalsContact O-CB 3.28Å; K361-S365 WeakPolarHBondContact O-CB 3.39Å; K361-S365 PolarHBondContact O-N 3.45Å
362	F	97.8	Very high	94.9	Very high	4 Å²	4	64.4 Å²	64.4	2%	0.018	32%	0.315	C	S	.	.	H	α-helix	trans	-67.1	-50	179.4	178.9	-139.4	0	0	0	112.4	M278 V336 I338 Y347 M349 N358 L359 K360 R364 S365 F366 A371	M278-F362 HydrophobicContact CE-CD1 4.03Å; V336-F362 HydrophobicContact CG1-CD1 4.41Å; V336-F362 HydrophobicContact CG1-CE1 4.24Å; I338-F362 HydrophobicContact CB-CE1 4.39Å; I338-F362 HydrophobicContact CB-CZ 4.15Å; I338-F362 HydrophobicContact CD1-CD1 3.98Å; I338-F362 HydrophobicContact CD1-CD2 4.46Å; I338-F362 HydrophobicContact CD1-CE1 3.64Å; I338-F362 HydrophobicContact CD1-CE2 4.15Å; I338-F362 HydrophobicContact CD1-CG 4.37Å; I338-F362 HydrophobicContact CD1-CZ 3.71Å; I338-F362 HydrophobicContact CG1-CD1 4.32Å; I338-F362 HydrophobicContact CG1-CE1 3.6Å; I338-F362 HydrophobicContact CG1-CZ 3.79Å; Y347-F362 WeakPolarHBondContact O-CZ 3.49Å; M349-F362 HydrophobicContact CB-CD1 3.6Å; M349-F362 HydrophobicContact CB-CE1 3.69Å; M349-F362 HydrophobicContact CB-CG 4.09Å; M349-F362 HydrophobicContact CB-CZ 4.26Å; M349-F362 HydrophobicContact CG-CB 3.94Å; M349-F362 HydrophobicContact CG-CD1 3.64Å; M349-F362 HydrophobicContact CG-CE1 4.27Å; M349-F362 HydrophobicContact CG-CG 3.81Å; M349-F362 HydrophobicContact SD-CB 4.41Å; M349-F362 HydrophobicContact SD-CD1 4.21Å; N358-F362 VanDerWaalsContact O-CB 3.27Å; N358-F362 WeakPolarHBondContact O-CB 3.44Å; N358-F362 PolarHBondContact O-N 3.23Å; L359-F362 PolarHBondContact O-N 3.29Å; K360-F362 VanDerWaalsContact C-N 3.35Å; F362-R364 VanDerWaalsContact C-N 3.34Å; F362-R364 PolarHBondContact O-N 2.94Å; F362-S365 WeakPolarHBondContact O-CB 3.37Å; F362-S365 PolarHBondContact O-N 2.64Å; F362-S365 VanDerWaalsContact O-N 3.14Å; F362-F366 PolarHBondContact O-N 2.81Å; F362-A371 HydrophobicContact CE2-CB 4.43Å
363	G	97.9	Very high	94.7	Very high	0 Å²	0	66 Å²	66	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-60.8	-39.4	176	0	0	0	0	0	113	L359 F366 L367	L359-G363 PolarHBondContact O-N 2.82Å; G363-F366 PolarHBondContact O-N 3.17Å; G363-L367 WeakPolarHBondContact O-CG 3.48Å; G363-L367 PolarHBondContact O-N 3.4Å
364	R	98.1	Very high	94	Very high	135 Å²	135	61.9 Å²	61.9	51%	0.509	30%	0.297	S	S	.	.	H	α-helix	trans	-67.3	-38	173.7	-70.6	172	-176.5	-154.7	1.3	112.2	E302 F303 K360 F362 S368	E302-R364 IonicContact OE2-CZ 2.73Å; E302-R364 IonicContact OE2-NE 2.71Å; E302-R364 IonicContact OE2-NH2 2.67Å; E302-R364 PolarHBondContact OE2-NH2 3.13Å; F303-R364 HydrophobicContact CE1-CG 4.06Å; F303-R364 HydrophobicContact CZ-CG 4.12Å; K360-R364 VanDerWaalsContact O-CB 3.28Å; K360-R364 WeakPolarHBondContact O-CB 3.49Å; K360-R364 WeakPolarHBondContact O-CD 3.48Å; K360-R364 WeakPolarHBondContact O-CG 3.26Å; K360-R364 PolarHBondContact O-N 2.88Å; F362-R364 VanDerWaalsContact C-N 3.34Å; F362-R364 PolarHBondContact O-N 2.94Å; R364-S368 WeakPolarHBondContact O-CB 3.44Å; R364-S368 PolarHBondContact O-N 2.93Å; R364-S368 PolarHBondContact O-OG 3.2Å
365	S	97.2	Very high	92.8	Very high	33 Å²	33	65.9 Å²	65.9	23%	0.231	32%	0.315	C	S	.	.	H	α-helix	trans	-64.4	-43.5	174.7	-173.8	0	0	0	0	111.9	K361 F362 S368 K369 N370 A371	K361-S365 VanDerWaalsContact O-CB 3.28Å; K361-S365 WeakPolarHBondContact O-CB 3.39Å; K361-S365 PolarHBondContact O-N 3.45Å; F362-S365 WeakPolarHBondContact O-CB 3.37Å; F362-S365 PolarHBondContact O-N 2.64Å; F362-S365 VanDerWaalsContact O-N 3.14Å; S365-S368 WeakPolarHBondContact CA-OG 3.37Å; S365-S368 PolarHBondContact O-N 2.67Å; S365-S368 PolarHBondContact O-OG 2.73Å; S365-K369 PolarHBondContact O-N 2.67Å; S365-N370 PolarHBondContact O-N 2.97Å; S365-A371 PolarHBondContact O-N 2.95Å; S365-A371 PolarHBondContact OG-N 2.67Å
366	F	96.3	Very high	91.6	Very high	20 Å²	20	67.9 Å²	67.9	9%	0.088	33%	0.331	C	S	.	.	H	α-helix	trans	-61.4	-51.4	175.1	169.8	-99.4	0	0	0	112.1	S276 I307 I338 N340 Y347 F362 G363 S368 K369 A371	S276-F366 WeakPolarHBondContact OG-CZ 3.35Å; I307-F366 HydrophobicContact CD1-CD1 4.06Å; I338-F366 HydrophobicContact CB-CD2 4.38Å; I338-F366 HydrophobicContact CD1-CB 3.62Å; I338-F366 HydrophobicContact CD1-CD1 4.08Å; I338-F366 HydrophobicContact CD1-CD2 4.33Å; I338-F366 HydrophobicContact CD1-CG 3.75Å; I338-F366 HydrophobicContact CG2-CD1 4.01Å; I338-F366 HydrophobicContact CG2-CD2 3.73Å; I338-F366 HydrophobicContact CG2-CE1 3.88Å; I338-F366 HydrophobicContact CG2-CE2 3.58Å; I338-F366 HydrophobicContact CG2-CG 3.95Å; I338-F366 HydrophobicContact CG2-CZ 3.65Å; N340-F366 HydrophobicContact CB-CE2 4.45Å; N340-F366 HydrophobicContact CB-CZ 4.28Å; Y347-F366 HydrophobicContact CD1-CD2 4.4Å; Y347-F366 AromaticContact CD2-CD2 3.83Å; Y347-F366 HydrophobicContact CD2-CD2 3.83Å; Y347-F366 AromaticContact CD2-CE2 3.78Å; Y347-F366 HydrophobicContact CD2-CE2 3.78Å; Y347-F366 HydrophobicContact CE1-CD2 4.46Å; Y347-F366 AromaticContact CE2-CD2 3.92Å; Y347-F366 HydrophobicContact CE2-CD2 3.92Å; Y347-F366 AromaticContact CE2-CE2 3.56Å; Y347-F366 HydrophobicContact CE2-CE2 3.56Å; Y347-F366 HydrophobicContact CG-CD2 4.12Å; F362-F366 PolarHBondContact O-N 2.81Å; G363-F366 PolarHBondContact O-N 3.17Å; F366-S368 PolarHBondContact O-N 2.84Å; F366-K369 WeakPolarHBondContact O-CA 3.3Å; F366-K369 PolarHBondContact O-N 3.41Å; F366-A371 HydrophobicContact CB-CB 4.23Å
367	L	96.3	Very high	90.8	Very high	79 Å²	79	67 Å²	67	41%	0.414	33%	0.329	S	S	.	.	H	α-helix	trans	-64.9	-26.8	-179.7	-69.7	173.6	0	0	0	113.4	F303 K306 I307 G363 K369	F303-L367 HydrophobicContact CD1-CD1 3.77Å; F303-L367 HydrophobicContact CE1-CD1 4.02Å; K306-L367 HydrophobicContact CB-CD1 4.17Å; K306-L367 HydrophobicContact CB-CD2 4.46Å; K306-L367 HydrophobicContact CD-CD1 4.2Å; I307-L367 HydrophobicContact CD1-CD1 4.11Å; I307-L367 HydrophobicContact CD1-CD2 4.45Å; I307-L367 HydrophobicContact CD1-CG 4.06Å; I307-L367 HydrophobicContact CG1-CD1 4.29Å; I307-L367 HydrophobicContact CG1-CD2 4.22Å; I307-L367 HydrophobicContact CG1-CG 4.33Å; G363-L367 WeakPolarHBondContact O-CG 3.48Å; G363-L367 PolarHBondContact O-N 3.4Å; L367-K369 VanDerWaalsContact C-N 3.31Å
368	S	96.1	Very high	90.2	Very high	64 Å²	64	65.8 Å²	65.8	45%	0.448	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.1	8.2	172.9	57.6	0	0	0	0	114	R364 S365 F366 N370	R364-S368 WeakPolarHBondContact O-CB 3.44Å; R364-S368 PolarHBondContact O-N 2.93Å; R364-S368 PolarHBondContact O-OG 3.2Å; S365-S368 WeakPolarHBondContact CA-OG 3.37Å; S365-S368 PolarHBondContact O-N 2.67Å; S365-S368 PolarHBondContact O-OG 2.73Å; F366-S368 PolarHBondContact O-N 2.84Å; S368-N370 WeakPolarHBondContact CB-ND2 3.4Å; S368-N370 PolarHBondContact O-N 2.88Å; S368-N370 PolarHBondContact O-ND2 3.14Å; S368-N370 PolarHBondContact OG-ND2 3.32Å
369	K	91.6	Very high	89.8	Confident	195 Å²	195	70.3 Å²	70.3	85%	0.848	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.5	19.8	-179.3	-53.1	-177.8	-178.5	179.9	0	115	S365 F366 L367	S365-K369 PolarHBondContact O-N 2.67Å; F366-K369 WeakPolarHBondContact O-CA 3.3Å; F366-K369 PolarHBondContact O-N 3.41Å; L367-K369 VanDerWaalsContact C-N 3.31Å
370	N	91.7	Very high	89.4	Confident	122 Å²	122	73.9 Å²	73.9	65%	0.652	36%	0.361	S	S	*	.			trans	-93.4	-7.9	-179.9	-69.7	-62.5	0	0	0	114	S365 S368	S365-N370 PolarHBondContact O-N 2.97Å; S368-N370 WeakPolarHBondContact CB-ND2 3.4Å; S368-N370 PolarHBondContact O-N 2.88Å; S368-N370 PolarHBondContact O-ND2 3.14Å; S368-N370 PolarHBondContact OG-ND2 3.32Å
371	A	89	Confident	89.1	Confident	16 Å²	16	75.1 Å²	75.1	13%	0.132	37%	0.372	C	S	.	.	S	Bend	trans	-74.2	132.5	177.5	0	0	0	0	0	111.5	Y347 F362 S365 F366 K373	Y347-A371 HydrophobicContact CD1-CB 3.63Å; Y347-A371 HydrophobicContact CE1-CB 4.21Å; Y347-A371 WeakPolarHBondContact CE1-O 3.41Å; Y347-A371 HydrophobicContact CG-CB 4.41Å; F362-A371 HydrophobicContact CE2-CB 4.43Å; S365-A371 PolarHBondContact O-N 2.95Å; S365-A371 PolarHBondContact OG-N 2.67Å; F366-A371 HydrophobicContact CB-CB 4.23Å; A371-K373 PolarHBondContact O-N 3.34Å
372	K	83.5	Confident	88.7	Confident	134 Å²	134	76.7 Å²	76.7	58%	0.583	38%	0.379	S	S	*	.	P	Polyproline II helix	trans	-60.8	122.7	170.4	-87.6	-166	173.1	-165.2	0	110	Y347 E378	Y347-K372 VanDerWaalsContact CD1-O 3.25Å; Y347-K372 WeakPolarHBondContact CD1-O 3.49Å; K372-E378 IonicContact NZ-OE1 3.94Å; K372-E378 PolarHBondContact NZ-OE1 2.83Å
373	K	81.5	Confident	88.3	Confident	98 Å²	98	82.3 Å²	82.3	43%	0.426	41%	0.405	S	S	.	.	P	Polyproline II helix	trans	-67.2	129.2	165.9	179	177.3	175.4	175.4	0	108.8	A345 Y347 A371 Q375	A345-K373 HydrophobicContact CB-CD 4.08Å; Y347-K373 HydrophobicContact CD1-CB 4.44Å; Y347-K373 HydrophobicContact CE1-CB 3.91Å; A371-K373 PolarHBondContact O-N 3.34Å; K373-Q375 HydrophobicContact CG-CG 4.27Å
374	H	77.1	Confident	88	Confident	19 Å²	19	85.3 Å²	85.3	9%	0.088	42%	0.416	C	S	.	.	P	Polyproline II helix	trans	-73.5	136.9	170.7	170.3	57.3	0	0	0	109.6	R346 K348 T448 D451	R346-H374 PolarHBondContact O-N 3.01Å; K348-H374 WeakPolarHBondContact CE-NE2 3.27Å; K348-H374 HydrophobicContact CG-CB 4.36Å; H374-T448 PolarHBondContact ND1-O 3.3Å; H374-D451 IonicContact CE1-OD1 2.74Å; H374-D451 PolarHBondContact CE1-OD1 2.81Å; H374-D451 VanDerWaalsContact CE1-OD1 3.24Å; H374-D451 IonicContact NE2-OD1 2.66Å; H374-D451 PolarHBondContact NE2-OD1 3.18Å
375	Q	71.3	Confident	87.7	Confident	99 Å²	99	82.4 Å²	82.4	46%	0.463	41%	0.411	S	S	.	.			trans	-141.9	164.3	-171.4	-63.4	-175.3	74.2	0	0	109.7	K373 S377 A449	K373-Q375 HydrophobicContact CG-CG 4.27Å; Q375-S377 PolarHBondContact O-N 3Å; Q375-A449 VanDerWaalsContact O-O 3.14Å
376	S	71.4	Confident	87.2	Confident	84 Å²	84	87.3 Å²	87.3	59%	0.587	43%	0.43	S	S	*	.	S	Bend	trans	-63.1	-28.5	174	49.9	0	0	0	0	112.7	D451	S376-D451 WeakPolarHBondContact CA-OD2 3.34Å; S376-D451 PolarHBondContact O-N 2.97Å
377	S	81.2	Confident	86.8	Confident	10 Å²	10	88.3 Å²	88.3	7%	0.07	45%	0.446	C	S	.	.			trans	-157.4	150.5	170	-176.9	0	0	0	0	110.1	Q375 G394 K395 N450	Q375-S377 PolarHBondContact O-N 3Å; S377-G394 WeakPolarHBondContact OG-CA 3.39Å; S377-G394 PolarHBondContact OG-N 2.86Å; S377-K395 WeakPolarHBondContact OG-CG 3.16Å; S377-K395 PolarHBondContact OG-N 3.16Å; S377-N450 WeakPolarHBondContact CA-OD1 3.29Å; S377-N450 PolarHBondContact OG-OD1 3.08Å
378	E	84.2	Confident	86.7	Confident	48 Å²	48	86.7 Å²	86.7	22%	0.224	44%	0.438	C	S	.	.	P	Polyproline II helix	trans	-71.2	169.1	156.5	-66.8	179.8	118.4	0	0	110.6	K372 V393 A449 N450	K372-E378 IonicContact NZ-OE1 3.94Å; K372-E378 PolarHBondContact NZ-OE1 2.83Å; E378-V393 HydrophobicContact CB-CB 4.45Å; E378-V393 HydrophobicContact CB-CG1 3.93Å; E378-A449 HydrophobicContact CG-CB 3.73Å; E378-N450 PolarHBondContact N-OD1 3.22Å; E378-N450 PolarHBondContact OE2-ND2 3.16Å; E378-N450 VanDerWaalsContact OE2-ND2 3.14Å
379	E	88.5	Confident	86.7	Confident	137 Å²	137	84 Å²	84	64%	0.64	42%	0.418	S	S	*	.	P	Polyproline II helix	trans	-73.1	145.7	171.3	-69.7	-56.1	148.4	0	0	111.4	P381 K395	E379-P381 VanDerWaalsContact O-CD 3.3Å; E379-P381 WeakPolarHBondContact O-CD 3.49Å; E379-K395 IonicContact OE1-NZ 2.71Å; E379-K395 PolarHBondContact OE1-NZ 3.23Å; E379-K395 IonicContact OE2-NZ 2.68Å; E379-K395 PolarHBondContact OE2-NZ 2.71Å
380	I	90.5	Very high	86.9	Confident	75 Å²	75	77.5 Å²	77.5	39%	0.385	39%	0.39	S	S	.	.	P	Polyproline II helix	trans	-64.3	121.7	178.8	-59.2	172	0	0	0	108.7	W384 V393 K395 N396	I380-W384 HydrophobicContact CG2-CB 4.32Å; I380-W384 HydrophobicContact CG2-CG 3.92Å; I380-V393 HydrophobicContact CB-CG2 4.36Å; I380-V393 HydrophobicContact CG1-CG2 3.74Å; I380-K395 HydrophobicContact CD1-CB 3.98Å; I380-K395 HydrophobicContact CG1-CB 3.9Å; I380-K395 HydrophobicContact CG1-CD 4.47Å; I380-N396 HydrophobicContact CD1-CB 4.11Å; I380-N396 HydrophobicContact CG1-CB 4.36Å
381	P	91.1	Very high	87.1	Confident	51 Å²	51	73.7 Å²	73.7	33%	0.331	37%	0.368	S	S	.	.	P	Polyproline II helix	trans	-61.5	140.9	177.1	-22.7	33.1	0	0	0	111.8	E379 H383 W384 Q391	E379-P381 VanDerWaalsContact O-CD 3.3Å; E379-P381 WeakPolarHBondContact O-CD 3.49Å; P381-H383 PolarHBondContact O-N 3.05Å; P381-W384 HydrophobicContact CB-CB 4.06Å; P381-W384 HydrophobicContact CG-CB 4.25Å; P381-W384 WeakPolarHBondContact O-CB 3.27Å; P381-W384 PolarHBondContact O-N 3.3Å; P381-Q391 HydrophobicContact CG-CG 4.09Å
382	K	89.7	Confident	87.4	Confident	188 Å²	188	72.9 Å²	72.9	82%	0.817	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-17.6	180	-70.4	-171.1	177.3	-173.9	0	115.2
383	H	90.8	Very high	87.8	Confident	122 Å²	122	66.6 Å²	66.6	57%	0.565	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-131.5	31.2	-174.7	-53.1	-79.5	0	0	0	110.7	P381 D385 Q386	P381-H383 PolarHBondContact O-N 3.05Å; H383-D385 PolarHBondContact O-N 3.34Å; H383-Q386 HydrophobicContact CB-CB 4.3Å; H383-Q386 HydrophobicContact CB-CG 4.18Å; H383-Q386 PolarHBondContact ND1-OE1 3.05Å; H383-Q386 PolarHBondContact O-N 3.28Å
384	W	91.6	Very high	88.1	Confident	62 Å²	62	63 Å²	63	24%	0.235	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-26.1	-170.8	72.6	-86.4	0	0	0	114.1	I380 P381 K390 Q391 L392 V400	I380-W384 HydrophobicContact CG2-CB 4.32Å; I380-W384 HydrophobicContact CG2-CG 3.92Å; P381-W384 HydrophobicContact CB-CB 4.06Å; P381-W384 HydrophobicContact CG-CB 4.25Å; P381-W384 WeakPolarHBondContact O-CB 3.27Å; P381-W384 PolarHBondContact O-N 3.3Å; W384-K390 HydrophobicContact CE3-CB 4.36Å; W384-K390 HydrophobicContact CZ3-CB 4.29Å; W384-K390 HydrophobicContact CZ3-CD 4.01Å; W384-K390 CarbonylContact O-C 3.57Å; W384-K390 WeakPolarHBondContact O-CA 3.46Å; W384-Q391 PolarHBondContact O-N 2.99Å; W384-L392 HydrophobicContact CE3-CD2 4.16Å; W384-L392 HydrophobicContact CZ3-CD2 3.93Å; W384-V400 HydrophobicContact CH2-CG2 3.53Å; W384-V400 HydrophobicContact CZ3-CG2 3.64Å
385	D	91.3	Very high	88.7	Confident	74 Å²	74	66.9 Å²	66.9	40%	0.396	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.9	-7	-175.7	56.4	-18.1	0	0	0	114.1	H383 K390	H383-D385 PolarHBondContact O-N 3.34Å; D385-K390 HydrophobicContact CB-CD 4.44Å
386	Q	86	Confident	89.7	Confident	137 Å²	137	62.5 Å²	62.5	64%	0.64	32%	0.322	S	S	*	.	S	Bend	trans	-89.5	-6.5	-169.1	-55	-172.1	-7.7	0	0	114.4	H383	H383-Q386 HydrophobicContact CB-CB 4.3Å; H383-Q386 HydrophobicContact CB-CG 4.18Å; H383-Q386 PolarHBondContact ND1-OE1 3.05Å; H383-Q386 PolarHBondContact O-N 3.28Å
387	G	87.9	Confident	90.7	Very high	41 Å²	41	58.6 Å²	58.6	42%	0.423	29%	0.294	S	S	.	.	S	Bend	trans	-95.1	165	174.6	0	0	0	0	0	112.5	V389	G387-V389 PolarHBondContact O-N 3.34Å
388	L	94.1	Very high	91.1	Very high	45 Å²	45	61.5 Å²	61.5	24%	0.236	31%	0.309	C	S	.	.	S	Bend	trans	-65.2	-18.7	176.3	-57.5	170.4	0	0	0	112.6	E428 G431 R432 Q435	L388-E428 HydrophobicContact CD1-CG 4.47Å; L388-G431 VanDerWaalsContact O-CA 3.23Å; L388-G431 WeakPolarHBondContact O-CA 3.24Å; L388-R432 HydrophobicContact CD1-CB 4.04Å; L388-R432 HydrophobicContact CD1-CG 4.41Å; L388-R432 VanDerWaalsContact CD1-CZ 3.48Å; L388-R432 VanDerWaalsContact CD1-NH2 3.34Å; L388-Q435 HydrophobicContact CD2-CB 3.97Å
389	V	96.5	Very high	91.3	Very high	6 Å²	6	65.5 Å²	65.5	4%	0.036	33%	0.331	C	S	.	.	S	Bend	trans	-123.5	112	171.6	-176.5	0	0	0	0	108.6	G387 Q391 L427 I442 K444	G387-V389 PolarHBondContact O-N 3.34Å; V389-Q391 PolarHBondContact O-N 2.64Å; V389-L427 HydrophobicContact CG1-CD2 3.68Å; V389-L427 HydrophobicContact CG1-CG 3.99Å; V389-L427 HydrophobicContact CG2-CD2 4.42Å; V389-L427 HydrophobicContact CG2-CG 3.91Å; V389-L427 VanDerWaalsContact CG2-O 3.24Å; V389-L427 WeakPolarHBondContact CG2-O 3.36Å; V389-I442 WeakPolarHBondContact CA-O 3.33Å; V389-I442 HydrophobicContact CG1-CG2 4.3Å; V389-I442 HydrophobicContact CG2-CG2 4.11Å; V389-K444 HydrophobicContact CB-CD 4.49Å; V389-K444 HydrophobicContact CG1-CB 4.03Å; V389-K444 HydrophobicContact CG1-CD 3.72Å; V389-K444 HydrophobicContact CG1-CG 3.81Å
390	K	96.7	Very high	91.5	Very high	60 Å²	60	59.5 Å²	59.5	26%	0.261	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66	132.9	-179	-59.3	-167.2	-175.9	177.2	0	111	W384 D385 I441 I442 A443 K444	W384-K390 HydrophobicContact CE3-CB 4.36Å; W384-K390 HydrophobicContact CZ3-CB 4.29Å; W384-K390 HydrophobicContact CZ3-CD 4.01Å; W384-K390 CarbonylContact O-C 3.57Å; W384-K390 WeakPolarHBondContact O-CA 3.46Å; D385-K390 HydrophobicContact CB-CD 4.44Å; K390-I441 HydrophobicContact CD-CG2 3.78Å; K390-I441 HydrophobicContact CG-CG2 4.19Å; K390-I442 PolarHBondContact N-O 3.17Å; K390-A443 HydrophobicContact CB-CB 4.26Å; K390-A443 CarbonylContact O-C 3.51Å; K390-A443 VanDerWaalsContact O-CA 3.23Å; K390-A443 WeakPolarHBondContact O-CA 3.39Å; K390-K444 PolarHBondContact O-N 3.25Å
391	Q	96.1	Very high	91.6	Very high	41 Å²	41	56.1 Å²	56.1	19%	0.192	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	118.2	176.9	-175.6	65.5	58.1	0	0	109.8	P381 W384 V389 Y413 K444	P381-Q391 HydrophobicContact CG-CG 4.09Å; W384-Q391 PolarHBondContact O-N 2.99Å; V389-Q391 PolarHBondContact O-N 2.64Å; Q391-Y413 PolarHBondContact NE2-OH 2.85Å; Q391-Y413 PolarHBondContact OE1-OH 3.13Å; Q391-K444 PolarHBondContact NE2-O 3.31Å; Q391-K444 VanDerWaalsContact OE1-CE 3.31Å
392	L	95.3	Very high	91.5	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	153.8	175.5	-53.7	-179	0	0	0	111	W384 N396 F397 V400 V401 V410 A443 K444 I445	W384-L392 HydrophobicContact CE3-CD2 4.16Å; W384-L392 HydrophobicContact CZ3-CD2 3.93Å; L392-N396 WeakPolarHBondContact CA-OD1 3.47Å; L392-F397 HydrophobicContact CB-CD2 4.36Å; L392-F397 HydrophobicContact CD1-CD2 3.94Å; L392-F397 HydrophobicContact CD1-CE2 4.47Å; L392-V400 HydrophobicContact CD2-CB 3.87Å; L392-V400 HydrophobicContact CD2-CG1 4Å; L392-V400 HydrophobicContact CD2-CG2 3.8Å; L392-V401 HydrophobicContact CD1-CG1 3.83Å; L392-V410 HydrophobicContact CD1-CG1 4.41Å; L392-V410 HydrophobicContact CD1-CG2 4.29Å; L392-A443 HydrophobicContact CD1-CB 3.91Å; L392-A443 HydrophobicContact CG-CB 4.14Å; L392-K444 PolarHBondContact N-O 3.22Å; L392-I445 HydrophobicContact CB-CB 4.15Å; L392-I445 HydrophobicContact CB-CD1 4.27Å
393	V	91.9	Very high	91.5	Very high	2 Å²	2	50.6 Å²	50.6	1%	0.012	26%	0.26	C	S	.	.			trans	-139.5	163.1	173.9	-63.9	0	0	0	0	107.8	E378 I380 K395 N396 F397 N450	E378-V393 HydrophobicContact CB-CB 4.45Å; E378-V393 HydrophobicContact CB-CG1 3.93Å; I380-V393 HydrophobicContact CB-CG2 4.36Å; I380-V393 HydrophobicContact CG1-CG2 3.74Å; V393-K395 HydrophobicContact CG2-CB 4.31Å; V393-K395 PolarHBondContact O-N 3.22Å; V393-N396 WeakPolarHBondContact CG2-OD1 3.23Å; V393-N396 PolarHBondContact N-OD1 3.27Å; V393-N396 PolarHBondContact O-N 3.46Å; V393-N396 PolarHBondContact O-OD1 2.6Å; V393-F397 WeakPolarHBondContact O-CB 3.45Å; V393-F397 PolarHBondContact O-N 2.95Å; V393-N450 VanDerWaalsContact CA-OD1 3.29Å; V393-N450 WeakPolarHBondContact CA-OD1 3.09Å; V393-N450 VanDerWaalsContact CB-OD1 3.27Å; V393-N450 WeakPolarHBondContact CB-OD1 3.43Å
394	G	87.8	Confident	91.3	Very high	23 Å²	23	51.4 Å²	51.4	24%	0.237	26%	0.262	C	S	.	.	H	α-helix	trans	-52.8	-32.5	-176.8	0	0	0	0	0	114.7	S377 N450	S377-G394 WeakPolarHBondContact OG-CA 3.39Å; S377-G394 PolarHBondContact OG-N 2.86Å; G394-N450 PolarHBondContact N-OD1 3.41Å
395	K	88.9	Confident	91.3	Very high	99 Å²	99	54.8 Å²	54.8	43%	0.43	28%	0.28	S	S	.	.	H	α-helix	trans	-67.5	-32.9	177.5	-73.2	179.7	-166.7	-166.5	0	115	S377 E379 I380 V393	S377-K395 WeakPolarHBondContact OG-CG 3.16Å; S377-K395 PolarHBondContact OG-N 3.16Å; E379-K395 IonicContact OE1-NZ 2.71Å; E379-K395 PolarHBondContact OE1-NZ 3.23Å; E379-K395 IonicContact OE2-NZ 2.68Å; E379-K395 PolarHBondContact OE2-NZ 2.71Å; I380-K395 HydrophobicContact CD1-CB 3.98Å; I380-K395 HydrophobicContact CG1-CB 3.9Å; I380-K395 HydrophobicContact CG1-CD 4.47Å; V393-K395 HydrophobicContact CG2-CB 4.31Å; V393-K395 PolarHBondContact O-N 3.22Å
396	N	92.4	Very high	91.3	Very high	8 Å²	8	53.4 Å²	53.4	4%	0.043	27%	0.27	C	S	.	.	H	α-helix	trans	-110.2	-11.5	179.6	73.2	-19.1	0	0	0	113.7	I380 L392 V393 N398 I399 V400	I380-N396 HydrophobicContact CD1-CB 4.11Å; I380-N396 HydrophobicContact CG1-CB 4.36Å; L392-N396 WeakPolarHBondContact CA-OD1 3.47Å; V393-N396 WeakPolarHBondContact CG2-OD1 3.23Å; V393-N396 PolarHBondContact N-OD1 3.27Å; V393-N396 PolarHBondContact O-N 3.46Å; V393-N396 PolarHBondContact O-OD1 2.6Å; N396-N398 PolarHBondContact O-N 3.18Å; N396-I399 PolarHBondContact O-N 3.44Å; N396-I399 VanDerWaalsContact O-N 3.12Å; N396-V400 WeakPolarHBondContact O-CG2 3.36Å; N396-V400 PolarHBondContact O-N 3.25Å
397	F	92.1	Very high	91.7	Very high	2 Å²	2	47.3 Å²	47.3	1%	0.009	24%	0.242	C	C	.	.	H	α-helix	trans	-50.4	-62.1	-177	-178.2	-98.7	0	0	0	112.6	L392 V393 I399 V400 V401 V410 F412 I445 I452 F466	L392-F397 HydrophobicContact CB-CD2 4.36Å; L392-F397 HydrophobicContact CD1-CD2 3.94Å; L392-F397 HydrophobicContact CD1-CE2 4.47Å; V393-F397 WeakPolarHBondContact O-CB 3.45Å; V393-F397 PolarHBondContact O-N 2.95Å; F397-I399 PolarHBondContact O-N 3.49Å; F397-V400 PolarHBondContact O-N 3Å; F397-V400 VanDerWaalsContact O-N 3.12Å; F397-V401 HydrophobicContact CD1-CG2 4.07Å; F397-V401 HydrophobicContact CD2-CG1 3.9Å; F397-V401 HydrophobicContact CE1-CG1 4.46Å; F397-V401 HydrophobicContact CE1-CG2 3.75Å; F397-V401 HydrophobicContact CE2-CG1 3.7Å; F397-V401 HydrophobicContact CE2-CG2 4.47Å; F397-V401 HydrophobicContact CG-CG1 4.38Å; F397-V401 HydrophobicContact CZ-CG1 3.99Å; F397-V401 HydrophobicContact CZ-CG2 3.97Å; F397-V401 WeakPolarHBondContact O-CG1 3.38Å; F397-V401 WeakPolarHBondContact O-CG2 3.1Å; F397-V401 PolarHBondContact O-N 3.28Å; F397-V410 HydrophobicContact CE2-CG1 4.32Å; F397-F412 AromaticContact CE2-CE1 3.58Å; F397-F412 HydrophobicContact CE2-CE1 3.58Å; F397-F412 AromaticContact CE2-CZ 3.87Å; F397-F412 HydrophobicContact CE2-CZ 3.87Å; F397-F412 AromaticContact CZ-CE1 3.65Å; F397-F412 HydrophobicContact CZ-CE1 3.65Å; F397-F412 AromaticContact CZ-CZ 3.82Å; F397-F412 HydrophobicContact CZ-CZ 3.82Å; F397-I445 HydrophobicContact CB-CD1 4.11Å; F397-I445 HydrophobicContact CD2-CD1 3.61Å; F397-I445 HydrophobicContact CD2-CG2 4.43Å; F397-I445 HydrophobicContact CE2-CD1 4.36Å; F397-I445 HydrophobicContact CE2-CG2 4.24Å; F397-I445 HydrophobicContact CG-CD1 4.07Å; F397-I452 HydrophobicContact CD1-CG2 4.18Å; F397-I452 HydrophobicContact CE1-CG2 4.33Å; F397-I452 HydrophobicContact CG-CG2 4.29Å; F397-F466 HydrophobicContact CE1-CZ 4.47Å; F397-F466 HydrophobicContact CZ-CE1 4.44Å; F397-F466 HydrophobicContact CZ-CE2 4.36Å; F397-F466 AromaticContact CZ-CZ 3.8Å; F397-F466 HydrophobicContact CZ-CZ 3.8Å
398	N	88.8	Confident	92	Very high	71 Å²	71	45.3 Å²	45.3	38%	0.38	22%	0.222	S	C	.	.	H	α-helix	trans	-59.7	-30.8	-179.8	-76.9	24.6	0	0	0	113.7	N396 V400 F402	N396-N398 PolarHBondContact O-N 3.18Å; N398-V400 VanDerWaalsContact C-N 3.34Å; N398-F402 HydrophobicContact CB-CD2 4.12Å; N398-F402 HydrophobicContact CB-CE2 4.29Å; N398-F402 WeakPolarHBondContact O-CD2 3.5Å; N398-F402 PolarHBondContact O-N 3.1Å
399	I	90.3	Very high	92.2	Very high	132 Å²	132	43.2 Å²	43.2	68%	0.677	21%	0.211	S	C	*	.	H	α-helix	trans	-71.4	-34.5	-179.1	-60.7	172.6	0	0	0	110.4	N396 F397	N396-I399 PolarHBondContact O-N 3.44Å; N396-I399 VanDerWaalsContact O-N 3.12Å; F397-I399 PolarHBondContact O-N 3.49Å
400	V	92.1	Very high	92.2	Very high	11 Å²	11	42.9 Å²	42.9	7%	0.067	21%	0.209	C	C	.	.	H	α-helix	trans	-88.5	-44.7	-179.1	-178.5	0	0	0	0	111.7	W384 L392 N396 F397 N398 F402 D403 V408	W384-V400 HydrophobicContact CH2-CG2 3.53Å; W384-V400 HydrophobicContact CZ3-CG2 3.64Å; L392-V400 HydrophobicContact CD2-CB 3.87Å; L392-V400 HydrophobicContact CD2-CG1 4Å; L392-V400 HydrophobicContact CD2-CG2 3.8Å; N396-V400 WeakPolarHBondContact O-CG2 3.36Å; N396-V400 PolarHBondContact O-N 3.25Å; F397-V400 PolarHBondContact O-N 3Å; F397-V400 VanDerWaalsContact O-N 3.12Å; N398-V400 VanDerWaalsContact C-N 3.34Å; V400-F402 VanDerWaalsContact C-N 3.32Å; V400-F402 PolarHBondContact O-N 2.77Å; V400-D403 WeakPolarHBondContact O-CB 3.43Å; V400-D403 PolarHBondContact O-N 3.28Å; V400-V408 HydrophobicContact CG1-CG1 4.32Å; V400-V408 WeakPolarHBondContact O-CG2 3.44Å
401	V	91.5	Very high	92.2	Very high	3 Å²	3	40 Å²	40	2%	0.018	20%	0.197	C	C	.	.	H	α-helix	trans	-79.2	-11.3	-172.7	-50.4	0	0	0	0	114.4	L392 F397 V408 V410 F466	L392-V401 HydrophobicContact CD1-CG1 3.83Å; F397-V401 HydrophobicContact CD1-CG2 4.07Å; F397-V401 HydrophobicContact CD2-CG1 3.9Å; F397-V401 HydrophobicContact CE1-CG1 4.46Å; F397-V401 HydrophobicContact CE1-CG2 3.75Å; F397-V401 HydrophobicContact CE2-CG1 3.7Å; F397-V401 HydrophobicContact CE2-CG2 4.47Å; F397-V401 HydrophobicContact CG-CG1 4.38Å; F397-V401 HydrophobicContact CZ-CG1 3.99Å; F397-V401 HydrophobicContact CZ-CG2 3.97Å; F397-V401 WeakPolarHBondContact O-CG1 3.38Å; F397-V401 WeakPolarHBondContact O-CG2 3.1Å; F397-V401 PolarHBondContact O-N 3.28Å; V401-V408 HydrophobicContact CG1-CG1 4.21Å; V401-V410 HydrophobicContact CG1-CG2 3.73Å; V401-F466 HydrophobicContact CB-CB 4.24Å; V401-F466 HydrophobicContact CB-CD1 3.81Å; V401-F466 HydrophobicContact CB-CD2 3.96Å; V401-F466 HydrophobicContact CB-CE1 4.12Å; V401-F466 HydrophobicContact CB-CE2 4.28Å; V401-F466 HydrophobicContact CB-CG 3.75Å; V401-F466 HydrophobicContact CB-CZ 4.37Å; V401-F466 HydrophobicContact CG1-CD2 4.31Å; V401-F466 HydrophobicContact CG1-CE2 4.37Å; V401-F466 HydrophobicContact CG2-CD1 3.75Å; V401-F466 HydrophobicContact CG2-CE1 3.73Å; V401-F466 HydrophobicContact CG2-CG 4.23Å; V401-F466 HydrophobicContact CG2-CZ 4.21Å; V401-F466 WeakPolarHBondContact O-CB 3.19Å
402	F	89.4	Confident	92.1	Very high	64 Å²	64	38.1 Å²	38.1	28%	0.281	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-115.9	27.5	171.8	-53.8	-62.7	0	0	0	111.4	N398 V400 K404 Y456 F466	N398-F402 HydrophobicContact CB-CD2 4.12Å; N398-F402 HydrophobicContact CB-CE2 4.29Å; N398-F402 WeakPolarHBondContact O-CD2 3.5Å; N398-F402 PolarHBondContact O-N 3.1Å; V400-F402 VanDerWaalsContact C-N 3.32Å; V400-F402 PolarHBondContact O-N 2.77Å; F402-K404 PolarHBondContact O-N 2.94Å; F402-Y456 AromaticContact CZ-CE2 3.96Å; F402-Y456 HydrophobicContact CZ-CE2 3.96Å; F402-Y456 AromaticContact CZ-CZ 3.93Å; F402-Y456 WeakPolarHBondContact CZ-OH 3.34Å; F402-F466 HydrophobicContact CD1-CD1 4.29Å; F402-F466 AromaticContact CE1-CD1 3.76Å; F402-F466 HydrophobicContact CE1-CD1 3.76Å; F402-F466 HydrophobicContact CE1-CE1 4.05Å; F402-F466 HydrophobicContact CZ-CD1 4.29Å; F402-F466 HydrophobicContact CZ-CE1 4.14Å
403	D	89	Confident	91.9	Very high	59 Å²	59	39.1 Å²	39.1	32%	0.316	19%	0.192	S	C	.	.			trans	-64.5	118.7	166.6	-176	-21.6	0	0	0	108.6	V400 E405 K406	V400-D403 WeakPolarHBondContact O-CB 3.43Å; V400-D403 PolarHBondContact O-N 3.28Å; D403-E405 PolarHBondContact O-N 3.41Å; D403-E405 PolarHBondContact OD1-N 3.4Å; D403-K406 HydrophobicContact CB-CB 4.15Å; D403-K406 HydrophobicContact CB-CG 4.15Å; D403-K406 VanDerWaalsContact CG-CG 3.47Å; D403-K406 PolarHBondContact O-N 3.02Å; D403-K406 VanDerWaalsContact OD2-CG 3.28Å; D403-K406 WeakPolarHBondContact OD2-CG 3.2Å
404	K	88.1	Confident	91.6	Very high	140 Å²	140	39 Å²	39	61%	0.609	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-18.1	-175.1	-79.3	177.2	154	-87.9	0	113.5	F402 T468 D469	F402-K404 PolarHBondContact O-N 2.94Å; K404-T468 WeakPolarHBondContact O-CG2 3.21Å; K404-D469 WeakPolarHBondContact CG-OD1 3.25Å; K404-D469 IonicContact NZ-OD1 2.78Å; K404-D469 PolarHBondContact NZ-OD1 3.44Å; K404-D469 PolarHBondContact O-N 3.39Å
405	E	90.3	Very high	91.5	Very high	133 Å²	133	40.3 Å²	40.3	62%	0.621	20%	0.195	S	C	*	.	T	Hydrogen-bonded Turn	trans	-102.7	7.1	-176.8	-56.1	-178.4	-175.2	0	0	113.8	D403	D403-E405 PolarHBondContact O-N 3.41Å; D403-E405 PolarHBondContact OD1-N 3.4Å
406	K	92.5	Very high	91.1	Very high	44 Å²	44	38.2 Å²	38.2	19%	0.191	18%	0.184	C	C	.	.			trans	-137.5	139.2	-165.6	-54.9	-68	160.1	-98.9	0	113.7	D403 V408 S438 T439 I441 T468	D403-K406 HydrophobicContact CB-CB 4.15Å; D403-K406 HydrophobicContact CB-CG 4.15Å; D403-K406 VanDerWaalsContact CG-CG 3.47Å; D403-K406 PolarHBondContact O-N 3.02Å; D403-K406 VanDerWaalsContact OD2-CG 3.28Å; D403-K406 WeakPolarHBondContact OD2-CG 3.2Å; K406-V408 HydrophobicContact CB-CG2 3.92Å; K406-V408 PolarHBondContact O-N 3.48Å; K406-S438 PolarHBondContact NZ-O 3.42Å; K406-T439 CarbonylContact C-O 3.59Å; K406-T439 VanDerWaalsContact CA-O 3.25Å; K406-T439 WeakPolarHBondContact CA-O 3.12Å; K406-T439 WeakPolarHBondContact CB-O 3.39Å; K406-T439 WeakPolarHBondContact CD-O 3.48Å; K406-I441 HydrophobicContact CB-CD1 3.84Å; K406-I441 HydrophobicContact CB-CG1 4.28Å; K406-I441 HydrophobicContact CD-CD1 4Å; K406-I441 HydrophobicContact CD-CG1 4.3Å; K406-I441 HydrophobicContact CG-CD1 3.73Å; K406-I441 HydrophobicContact CG-CG1 4.41Å; K406-T468 PolarHBondContact O-N 3.21Å
407	D	93.3	Very high	90.9	Very high	9 Å²	9	37.9 Å²	37.9	5%	0.048	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	93.9	175.1	-62.4	-50.4	0	0	0	109	T439 I440 I441 L465 T468 R496	D407-T439 PolarHBondContact N-O 3.1Å; D407-T439 WeakPolarHBondContact OD2-CB 3.08Å; D407-T439 PolarHBondContact OD2-OG1 3.4Å; D407-I440 HydrophobicContact CB-CG1 4.2Å; D407-I440 WeakPolarHBondContact O-CA 3.23Å; D407-I441 PolarHBondContact O-N 3.41Å; D407-L465 HydrophobicContact CB-CD1 4.18Å; D407-T468 WeakPolarHBondContact OD1-CB 3.25Å; D407-T468 PolarHBondContact OD1-N 2.72Å; D407-T468 PolarHBondContact OD1-OG1 2.82Å; D407-T468 PolarHBondContact OD2-OG1 3.43Å; D407-R496 IonicContact OD2-NH1 2.76Å
408	V	95.9	Very high	90.6	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	107.4	-166.9	-168.2	0	0	0	0	111.4	V400 V401 K406 V410 I441 A443 F466	V400-V408 HydrophobicContact CG1-CG1 4.32Å; V400-V408 WeakPolarHBondContact O-CG2 3.44Å; V401-V408 HydrophobicContact CG1-CG1 4.21Å; K406-V408 HydrophobicContact CB-CG2 3.92Å; K406-V408 PolarHBondContact O-N 3.48Å; V408-V410 HydrophobicContact CG1-CG2 3.83Å; V408-I441 HydrophobicContact CG1-CB 4.21Å; V408-I441 HydrophobicContact CG1-CG2 4.13Å; V408-I441 HydrophobicContact CG2-CB 4.21Å; V408-I441 HydrophobicContact CG2-CD1 4.38Å; V408-A443 HydrophobicContact CG1-CB 4.38Å; V408-F466 HydrophobicContact CB-CB 4.43Å; V408-F466 PolarHBondContact N-O 2.99Å; V408-F466 PolarHBondContact O-N 3.02Å
409	F	97.1	Very high	90.5	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	110.8	176.4	-169.9	-110.3	0	0	0	110.8	L430 I441 I442 A443 F463 L465 Y476 F485 F488 L489	F409-L430 HydrophobicContact CD1-CD2 3.81Å; F409-L430 HydrophobicContact CE1-CD2 3.81Å; F409-I441 PolarHBondContact N-O 3.1Å; F409-I442 HydrophobicContact CB-CD1 4.03Å; F409-I442 HydrophobicContact CD1-CD1 4.31Å; F409-A443 PolarHBondContact O-N 2.95Å; F409-F463 HydrophobicContact CE1-CB 4.2Å; F409-F463 AromaticContact CE1-CD1 3.72Å; F409-F463 HydrophobicContact CE1-CD1 3.72Å; F409-F463 HydrophobicContact CE1-CE1 4.48Å; F409-F463 HydrophobicContact CE1-CG 4.24Å; F409-F463 HydrophobicContact CE2-CB 3.88Å; F409-F463 HydrophobicContact CZ-CB 3.52Å; F409-F463 AromaticContact CZ-CD1 3.88Å; F409-F463 HydrophobicContact CZ-CD1 3.88Å; F409-F463 AromaticContact CZ-CG 3.91Å; F409-F463 HydrophobicContact CZ-CG 3.91Å; F409-L465 HydrophobicContact CB-CD1 4.42Å; F409-L465 HydrophobicContact CD2-CB 4.25Å; F409-Y476 HydrophobicContact CE2-CD2 4.34Å; F409-Y476 HydrophobicContact CE2-CG 4.4Å; F409-Y476 HydrophobicContact CZ-CD2 4.48Å; F409-Y476 HydrophobicContact CZ-CG 4.39Å; F409-F485 AromaticContact CE1-CD1 3.99Å; F409-F485 HydrophobicContact CE1-CD1 3.99Å; F409-F485 HydrophobicContact CE1-CE1 4.36Å; F409-F485 HydrophobicContact CE1-CG 4.28Å; F409-F485 AromaticContact CZ-CD1 3.68Å; F409-F485 HydrophobicContact CZ-CD1 3.68Å; F409-F485 HydrophobicContact CZ-CE1 4.05Å; F409-F485 HydrophobicContact CZ-CG 4.37Å; F409-F488 HydrophobicContact CD2-CE1 4.28Å; F409-F488 HydrophobicContact CE2-CD1 4.23Å; F409-F488 AromaticContact CE2-CE1 3.93Å; F409-F488 HydrophobicContact CE2-CE1 3.93Å; F409-L489 HydrophobicContact CB-CD2 3.95Å; F409-L489 HydrophobicContact CD2-CD2 3.97Å; F409-L489 HydrophobicContact CG-CD2 4.04Å
410	V	96.8	Very high	90.5	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	126.6	-172.2	-170.9	0	0	0	0	111.5	L392 F397 V401 V408 F412 A443 I445 F463 R464 F466	L392-V410 HydrophobicContact CD1-CG1 4.41Å; L392-V410 HydrophobicContact CD1-CG2 4.29Å; F397-V410 HydrophobicContact CE2-CG1 4.32Å; V401-V410 HydrophobicContact CG1-CG2 3.73Å; V408-V410 HydrophobicContact CG1-CG2 3.83Å; V410-F412 HydrophobicContact CB-CD2 4.35Å; V410-F412 HydrophobicContact CB-CE2 3.65Å; V410-F412 HydrophobicContact CB-CZ 3.87Å; V410-F412 HydrophobicContact CG1-CD2 4.19Å; V410-F412 HydrophobicContact CG1-CE1 4.17Å; V410-F412 HydrophobicContact CG1-CE2 3.79Å; V410-F412 HydrophobicContact CG1-CZ 3.79Å; V410-F412 WeakPolarHBondContact O-CD2 3.41Å; V410-F412 WeakPolarHBondContact O-CE2 3.36Å; V410-A443 WeakPolarHBondContact CA-O 3.47Å; V410-A443 HydrophobicContact CG2-CB 4.29Å; V410-I445 HydrophobicContact CG1-CG2 3.96Å; V410-F463 VanDerWaalsContact O-CA 3.28Å; V410-F463 WeakPolarHBondContact O-CA 3.45Å; V410-R464 PolarHBondContact N-O 3.14Å; V410-R464 PolarHBondContact O-N 2.86Å; V410-R464 VanDerWaalsContact O-N 3.1Å; V410-F466 HydrophobicContact CB-CE2 4.38Å; V410-F466 HydrophobicContact CG2-CD2 4.03Å; V410-F466 HydrophobicContact CG2-CE2 3.97Å
411	M	96.4	Very high	90.5	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	124.5	163	-175.4	-171.1	-172.4	0	0	111.1	C420 L423 F424 L427 A443 K444 I445 P461 F463	M411-C420 HydrophobicContact CE-CB 4.13Å; M411-L423 HydrophobicContact CE-CB 3.88Å; M411-L423 HydrophobicContact CE-CD1 4.34Å; M411-F424 HydrophobicContact CE-CD1 4.09Å; M411-F424 HydrophobicContact CE-CE1 3.91Å; M411-F424 HydrophobicContact SD-CD1 3.88Å; M411-F424 HydrophobicContact SD-CE1 3.92Å; M411-L427 HydrophobicContact CB-CD1 4.46Å; M411-L427 HydrophobicContact CB-CD2 3.54Å; M411-L427 HydrophobicContact CG-CD2 4.2Å; M411-L427 HydrophobicContact SD-CD2 3.7Å; M411-A443 PolarHBondContact N-O 3.43Å; M411-K444 HydrophobicContact CB-CB 4.16Å; M411-K444 CarbonylContact O-C 3.47Å; M411-K444 VanDerWaalsContact O-CA 3.23Å; M411-K444 WeakPolarHBondContact O-CA 3.22Å; M411-I445 PolarHBondContact O-N 3.34Å; M411-P461 HydrophobicContact CE-CB 3.63Å; M411-F463 HydrophobicContact CB-CD1 3.7Å; M411-F463 HydrophobicContact CB-CE1 3.54Å; M411-F463 HydrophobicContact CB-CZ 4.48Å; M411-F463 HydrophobicContact CE-CZ 4.28Å; M411-F463 HydrophobicContact CG-CD1 3.96Å; M411-F463 HydrophobicContact CG-CE1 3.45Å; M411-F463 VanDerWaalsContact CG-CE1 3.45Å; M411-F463 HydrophobicContact CG-CZ 3.92Å; M411-F463 HydrophobicContact SD-CE1 4.12Å; M411-F463 HydrophobicContact SD-CZ 4.33Å
412	F	93.5	Very high	90.5	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	118.2	174.3	-60	-97.6	0	0	0	108.8	F397 V410 I445 I447 I452 P461 F462 R464 F466	F397-F412 AromaticContact CE2-CE1 3.58Å; F397-F412 HydrophobicContact CE2-CE1 3.58Å; F397-F412 AromaticContact CE2-CZ 3.87Å; F397-F412 HydrophobicContact CE2-CZ 3.87Å; F397-F412 AromaticContact CZ-CE1 3.65Å; F397-F412 HydrophobicContact CZ-CE1 3.65Å; F397-F412 AromaticContact CZ-CZ 3.82Å; F397-F412 HydrophobicContact CZ-CZ 3.82Å; V410-F412 HydrophobicContact CB-CD2 4.35Å; V410-F412 HydrophobicContact CB-CE2 3.65Å; V410-F412 HydrophobicContact CB-CZ 3.87Å; V410-F412 HydrophobicContact CG1-CD2 4.19Å; V410-F412 HydrophobicContact CG1-CE1 4.17Å; V410-F412 HydrophobicContact CG1-CE2 3.79Å; V410-F412 HydrophobicContact CG1-CZ 3.79Å; V410-F412 WeakPolarHBondContact O-CD2 3.41Å; V410-F412 WeakPolarHBondContact O-CE2 3.36Å; F412-I445 HydrophobicContact CD1-CG2 3.32Å; F412-I445 HydrophobicContact CE1-CG2 3.69Å; F412-I445 HydrophobicContact CG-CG2 4.05Å; F412-I447 HydrophobicContact CB-CD1 4.45Å; F412-I447 HydrophobicContact CB-CG2 3.98Å; F412-I447 HydrophobicContact CD1-CG2 3.68Å; F412-I447 HydrophobicContact CG-CG2 4.33Å; F412-I452 HydrophobicContact CD1-CD1 3.6Å; F412-I452 HydrophobicContact CE1-CD1 3.56Å; F412-P461 WeakPolarHBondContact O-CA 3.12Å; F412-F462 HydrophobicContact CB-CD1 3.8Å; F412-F462 HydrophobicContact CB-CD2 3.99Å; F412-F462 HydrophobicContact CB-CE1 3.39Å; F412-F462 HydrophobicContact CB-CE2 3.58Å; F412-F462 HydrophobicContact CB-CG 4.09Å; F412-F462 HydrophobicContact CB-CZ 3.27Å; F412-F462 AromaticContact CD1-CE2 3.98Å; F412-F462 HydrophobicContact CD1-CE2 3.98Å; F412-F462 AromaticContact CD1-CZ 3.77Å; F412-F462 HydrophobicContact CD1-CZ 3.77Å; F412-F462 AromaticContact CD2-CD2 3.6Å; F412-F462 HydrophobicContact CD2-CD2 3.6Å; F412-F462 AromaticContact CD2-CE2 3.18Å; F412-F462 HydrophobicContact CD2-CE2 3.18Å; F412-F462 HydrophobicContact CD2-CG 4.46Å; F412-F462 AromaticContact CD2-CZ 3.77Å; F412-F462 HydrophobicContact CD2-CZ 3.77Å; F412-F462 HydrophobicContact CE1-CE2 4.48Å; F412-F462 HydrophobicContact CE2-CD2 4.36Å; F412-F462 AromaticContact CE2-CE2 3.79Å; F412-F462 HydrophobicContact CE2-CE2 3.79Å; F412-F462 AromaticContact CG-CD2 3.99Å; F412-F462 HydrophobicContact CG-CD2 3.99Å; F412-F462 HydrophobicContact CG-CE1 4.02Å; F412-F462 AromaticContact CG-CE2 3.29Å; F412-F462 HydrophobicContact CG-CE2 3.29Å; F412-F462 AromaticContact CG-CZ 3.32Å; F412-F462 HydrophobicContact CG-CZ 3.32Å; F412-F462 HydrophobicContact CZ-CE2 4.39Å; F412-F462 PolarHBondContact N-O 3.02Å; F412-F462 PolarHBondContact O-N 3.14Å; F412-R464 HydrophobicContact CE2-CB 3.88Å; F412-R464 HydrophobicContact CE2-CG 3.94Å; F412-F466 HydrophobicContact CE2-CE2 4.3Å; F412-F466 AromaticContact CZ-CE2 3.86Å; F412-F466 HydrophobicContact CZ-CE2 3.86Å; F412-F466 HydrophobicContact CZ-CZ 4.02Å
413	Y	91.6	Very high	90.8	Very high	22 Å²	22	51.8 Å²	51.8	9%	0.086	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	167.9	-165.8	74.5	-90.1	0	0	0	114.2	Q391 P415 F424 K444 I445 D446 I447	Q391-Y413 PolarHBondContact NE2-OH 2.85Å; Q391-Y413 PolarHBondContact OE1-OH 3.13Å; Y413-P415 HydrophobicContact CE2-CB 4.5Å; Y413-P415 HydrophobicContact CE2-CG 4.02Å; Y413-F424 HydrophobicContact CD1-CE1 4.4Å; Y413-F424 AromaticContact CD2-CE1 3.86Å; Y413-F424 HydrophobicContact CD2-CE1 3.86Å; Y413-F424 AromaticContact CD2-CZ 3.62Å; Y413-F424 HydrophobicContact CD2-CZ 3.62Å; Y413-F424 HydrophobicContact CE2-CE1 4.43Å; Y413-F424 HydrophobicContact CE2-CZ 4.07Å; Y413-F424 AromaticContact CG-CE1 3.87Å; Y413-F424 HydrophobicContact CG-CE1 3.87Å; Y413-F424 HydrophobicContact CG-CZ 4.12Å; Y413-K444 HydrophobicContact CD1-CB 3.93Å; Y413-K444 HydrophobicContact CD1-CG 4.5Å; Y413-K444 HydrophobicContact CE1-CB 3.68Å; Y413-K444 HydrophobicContact CE1-CD 4.2Å; Y413-K444 HydrophobicContact CE1-CG 3.79Å; Y413-I445 VanDerWaalsContact CD1-C 3.47Å; Y413-I445 WeakPolarHBondContact CD1-O 3.37Å; Y413-I445 WeakPolarHBondContact CE1-O 3.36Å; Y413-I445 PolarHBondContact N-O 3.12Å; Y413-D446 HydrophobicContact CE2-CB 4.09Å; Y413-D446 WeakPolarHBondContact O-CA 3.28Å; Y413-I447 PolarHBondContact O-N 3.11Å
414	A	84.9	Confident	91.1	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	24%	0.235	C	C	.	.			trans	-119.8	128.4	166.3	0	0	0	0	0	109.9	W416 S417 C420 T448 Y460	A414-W416 HydrophobicContact CB-CD2 4.34Å; A414-W416 HydrophobicContact CB-CZ2 4.21Å; A414-W416 PolarHBondContact O-N 3.03Å; A414-W416 VanDerWaalsContact O-N 3.08Å; A414-S417 PolarHBondContact O-N 3.06Å; A414-S417 VanDerWaalsContact O-N 3.15Å; A414-C420 PolarHBondContact N-SG 3.33Å; A414-T448 HydrophobicContact CB-CG2 3.54Å; A414-Y460 HydrophobicContact CB-CD1 4.14Å; A414-Y460 HydrophobicContact CB-CD2 3.56Å; A414-Y460 HydrophobicContact CB-CE1 3.97Å; A414-Y460 HydrophobicContact CB-CE2 3.38Å; A414-Y460 HydrophobicContact CB-CG 3.95Å
415	P	85.8	Confident	91.5	Very high	49 Å²	49	48.7 Å²	48.7	32%	0.318	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62	-22.6	-170.6	-23.2	29.5	0	0	0	115.4	Y413 K421 D446	Y413-P415 HydrophobicContact CE2-CB 4.5Å; Y413-P415 HydrophobicContact CE2-CG 4.02Å; P415-K421 WeakPolarHBondContact O-CE 3.23Å; P415-D446 VanDerWaalsContact CD-CG 3.47Å; P415-D446 WeakPolarHBondContact CD-OD1 3.42Å; P415-D446 VanDerWaalsContact CD-OD2 3.28Å; P415-D446 WeakPolarHBondContact CD-OD2 3.47Å; P415-D446 HydrophobicContact CG-CB 4.4Å; P415-D446 WeakPolarHBondContact CG-OD2 3.4Å
416	W	82.3	Confident	91.8	Very high	55 Å²	55	44 Å²	44	21%	0.208	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.7	-28.4	179.7	50.2	81.7	0	0	0	113.4	M349 P350 S351 D352 A414 K418 K421 T448	M349-W416 WeakPolarHBondContact O-CZ2 3.4Å; P350-W416 VanDerWaalsContact C-CD2 3.43Å; P350-W416 VanDerWaalsContact C-CG 3.46Å; P350-W416 VanDerWaalsContact CA-CD2 3.47Å; P350-W416 HydrophobicContact CB-CD2 4.01Å; P350-W416 HydrophobicContact CB-CE3 3.58Å; P350-W416 HydrophobicContact CB-CH2 4.34Å; P350-W416 HydrophobicContact CB-CZ3 3.78Å; S351-W416 VanDerWaalsContact CA-CD1 3.49Å; D352-W416 PolarHBondContact OD1-NE1 2.88Å; A414-W416 HydrophobicContact CB-CD2 4.34Å; A414-W416 HydrophobicContact CB-CZ2 4.21Å; A414-W416 PolarHBondContact O-N 3.03Å; A414-W416 VanDerWaalsContact O-N 3.08Å; W416-K418 PolarHBondContact O-N 3.2Å; W416-K421 WeakPolarHBondContact O-CE 3.43Å; W416-K421 PolarHBondContact O-NZ 2.83Å; W416-T448 VanDerWaalsContact CH2-CB 3.42Å; W416-T448 HydrophobicContact CH2-CG2 3.62Å; W416-T448 WeakPolarHBondContact CH2-OG1 3.31Å; W416-T448 HydrophobicContact CZ2-CG2 3.67Å; W416-T448 HydrophobicContact CZ3-CG2 4.44Å; W416-T448 WeakPolarHBondContact CZ3-OG1 3.49Å
417	S	86.8	Confident	92	Very high	1 Å²	1	41.9 Å²	41.9	1%	0.007	20%	0.2	C	C	.	.			trans	-61.6	131.1	-167.9	179.2	0	0	0	0	112.6	D352 A414 K419 C420 K421	D352-S417 WeakPolarHBondContact OD1-CB 3.23Å; D352-S417 WeakPolarHBondContact OD2-CA 3.32Å; D352-S417 WeakPolarHBondContact OD2-CB 3.36Å; D352-S417 PolarHBondContact OD2-OG 3.47Å; A414-S417 PolarHBondContact O-N 3.06Å; A414-S417 VanDerWaalsContact O-N 3.15Å; S417-K419 VanDerWaalsContact C-N 3.32Å; S417-K419 PolarHBondContact O-N 2.93Å; S417-C420 PolarHBondContact O-N 2.83Å; S417-K421 WeakPolarHBondContact O-CG 3.43Å; S417-K421 PolarHBondContact O-N 2.93Å; S417-K421 VanDerWaalsContact O-N 3.07Å
418	K	85.9	Confident	92.2	Very high	162 Å²	162	44.5 Å²	44.5	70%	0.704	21%	0.212	S	C	*	.	H	α-helix	trans	-63	-39.7	179.2	-174.1	-179.8	177.2	-175.8	0	111.4	W416 K421 M422	W416-K418 PolarHBondContact O-N 3.2Å; K418-K421 PolarHBondContact O-N 2.9Å; K418-M422 HydrophobicContact CG-SD 4.34Å; K418-M422 WeakPolarHBondContact O-CG 3.24Å; K418-M422 PolarHBondContact O-N 2.81Å; K418-M422 VanDerWaalsContact O-N 3.17Å
419	K	87.4	Confident	92.2	Very high	147 Å²	147	49.1 Å²	49.1	64%	0.639	23%	0.233	S	C	*	.	H	α-helix	trans	-62.2	-45	177.3	-68.1	-175.4	178.6	-177.1	0	111.3	S417 M422 P461	S417-K419 VanDerWaalsContact C-N 3.32Å; S417-K419 PolarHBondContact O-N 2.93Å; K419-M422 PolarHBondContact O-N 3.18Å; K419-P461 HydrophobicContact CB-CG 3.84Å
420	C	90.3	Very high	92.2	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-61.1	-47.2	177.1	-62	0	0	0	0	111.5	M411 A414 S417 M422 L423 F424	M411-C420 HydrophobicContact CE-CB 4.13Å; A414-C420 PolarHBondContact N-SG 3.33Å; S417-C420 PolarHBondContact O-N 2.83Å; C420-M422 VanDerWaalsContact C-N 3.29Å; C420-M422 PolarHBondContact O-N 3.48Å; C420-L423 PolarHBondContact O-N 2.88Å; C420-F424 HydrophobicContact CB-CE1 4.11Å; C420-F424 HydrophobicContact CB-CZ 3.96Å; C420-F424 WeakPolarHBondContact O-CD1 3.34Å; C420-F424 PolarHBondContact O-N 2.89Å
421	K	91.3	Very high	92.2	Very high	109 Å²	109	49.2 Å²	49.2	47%	0.474	23%	0.234	S	C	.	.	H	α-helix	trans	-59.5	-34.7	-179.9	-73.7	167.9	179.5	165.7	0	114.2	P415 W416 S417 K418 L423 F424	P415-K421 WeakPolarHBondContact O-CE 3.23Å; W416-K421 WeakPolarHBondContact O-CE 3.43Å; W416-K421 PolarHBondContact O-NZ 2.83Å; S417-K421 WeakPolarHBondContact O-CG 3.43Å; S417-K421 PolarHBondContact O-N 2.93Å; S417-K421 VanDerWaalsContact O-N 3.07Å; K418-K421 PolarHBondContact O-N 2.9Å; K421-L423 PolarHBondContact O-N 2.89Å; K421-F424 HydrophobicContact CB-CD2 4.49Å; K421-F424 HydrophobicContact CB-CE2 4.49Å; K421-F424 HydrophobicContact CG-CD2 4.31Å; K421-F424 HydrophobicContact CG-CE2 3.93Å
422	M	92.4	Very high	92.2	Very high	136 Å²	136	56.1 Å²	56.1	67%	0.67	26%	0.26	S	S	*	.	H	α-helix	trans	-69	-21.2	176.5	-71.2	173.1	62	0	0	113.1	K418 K419 C420	K418-M422 HydrophobicContact CG-SD 4.34Å; K418-M422 WeakPolarHBondContact O-CG 3.24Å; K418-M422 PolarHBondContact O-N 2.81Å; K418-M422 VanDerWaalsContact O-N 3.17Å; K419-M422 PolarHBondContact O-N 3.18Å; C420-M422 VanDerWaalsContact C-N 3.29Å; C420-M422 PolarHBondContact O-N 3.48Å
423	L	95.6	Very high	92.3	Very high	21 Å²	21	60.7 Å²	60.7	11%	0.11	28%	0.28	C	S	.	.	H	α-helix	trans	-99.5	-12.5	-178	-60	174.1	0	0	0	113.5	M411 C420 K421 L426 L427 P461 F463 H480	M411-L423 HydrophobicContact CE-CB 3.88Å; M411-L423 HydrophobicContact CE-CD1 4.34Å; C420-L423 PolarHBondContact O-N 2.88Å; K421-L423 PolarHBondContact O-N 2.89Å; L423-L426 HydrophobicContact CD2-CD2 4.12Å; L423-L426 WeakPolarHBondContact O-CB 3.43Å; L423-L426 PolarHBondContact O-N 3.14Å; L423-L427 WeakPolarHBondContact O-CB 3.34Å; L423-L427 PolarHBondContact O-N 2.84Å; L423-P461 HydrophobicContact CD1-CB 3.96Å; L423-P461 HydrophobicContact CD1-CG 3.63Å; L423-F463 HydrophobicContact CB-CZ 4.5Å; L423-F463 HydrophobicContact CD1-CE2 4.06Å; L423-F463 HydrophobicContact CD1-CZ 3.93Å; L423-H480 HydrophobicContact CD1-CB 4.47Å; L423-H480 WeakPolarHBondContact CD1-ND1 3.41Å; L423-H480 HydrophobicContact CD2-CB 3.83Å
424	F	95.3	Very high	92.5	Very high	58 Å²	58	60.3 Å²	60.3	25%	0.254	28%	0.278	S	S	.	.	H	α-helix	trans	-60.1	-42.2	177.4	-61.9	-27.5	0	0	0	114.1	M411 Y413 C420 K421 L426 L427 E428	M411-F424 HydrophobicContact CE-CD1 4.09Å; M411-F424 HydrophobicContact CE-CE1 3.91Å; M411-F424 HydrophobicContact SD-CD1 3.88Å; M411-F424 HydrophobicContact SD-CE1 3.92Å; Y413-F424 HydrophobicContact CD1-CE1 4.4Å; Y413-F424 AromaticContact CD2-CE1 3.86Å; Y413-F424 HydrophobicContact CD2-CE1 3.86Å; Y413-F424 AromaticContact CD2-CZ 3.62Å; Y413-F424 HydrophobicContact CD2-CZ 3.62Å; Y413-F424 HydrophobicContact CE2-CE1 4.43Å; Y413-F424 HydrophobicContact CE2-CZ 4.07Å; Y413-F424 AromaticContact CG-CE1 3.87Å; Y413-F424 HydrophobicContact CG-CE1 3.87Å; Y413-F424 HydrophobicContact CG-CZ 4.12Å; C420-F424 HydrophobicContact CB-CE1 4.11Å; C420-F424 HydrophobicContact CB-CZ 3.96Å; C420-F424 WeakPolarHBondContact O-CD1 3.34Å; C420-F424 PolarHBondContact O-N 2.89Å; K421-F424 HydrophobicContact CB-CD2 4.49Å; K421-F424 HydrophobicContact CB-CE2 4.49Å; K421-F424 HydrophobicContact CG-CD2 4.31Å; K421-F424 HydrophobicContact CG-CE2 3.93Å; F424-L426 VanDerWaalsContact C-N 3.34Å; F424-L426 PolarHBondContact O-N 3.32Å; F424-L427 PolarHBondContact O-N 3.4Å; F424-E428 PolarHBondContact O-N 2.94Å; F424-E428 VanDerWaalsContact O-N 3.1Å
425	P	96.5	Very high	92.9	Very high	77 Å²	77	65.2 Å²	65.2	50%	0.5	30%	0.301	S	S	.	.	H	α-helix	trans	-63.2	-41.7	175.4	-20.7	33.5	0	0	0	111.9	L427 E428 E429	P425-L427 VanDerWaalsContact C-N 3.34Å; P425-L427 PolarHBondContact O-N 3.38Å; P425-E428 WeakPolarHBondContact O-CB 3.46Å; P425-E428 PolarHBondContact O-N 3.34Å; P425-E428 VanDerWaalsContact O-N 3.14Å; P425-E429 PolarHBondContact O-N 3.5Å
426	L	96.3	Very high	93.2	Very high	33 Å²	33	69.7 Å²	69.7	17%	0.173	32%	0.322	C	S	.	.	H	α-helix	trans	-64.4	-37.3	-179.8	-168.9	66.5	0	0	0	112.6	L423 F424 E429 L430 H480 L482 F485	L423-L426 HydrophobicContact CD2-CD2 4.12Å; L423-L426 WeakPolarHBondContact O-CB 3.43Å; L423-L426 PolarHBondContact O-N 3.14Å; F424-L426 VanDerWaalsContact C-N 3.34Å; F424-L426 PolarHBondContact O-N 3.32Å; L426-E429 PolarHBondContact O-N 2.91Å; L426-L430 WeakPolarHBondContact O-CB 3.5Å; L426-L430 PolarHBondContact O-N 3.28Å; L426-H480 VanDerWaalsContact CD2-O 3.27Å; L426-H480 WeakPolarHBondContact CD2-O 3.09Å; L426-L482 HydrophobicContact CD1-CB 3.79Å; L426-F485 HydrophobicContact CD2-CD2 4.31Å; L426-F485 HydrophobicContact CD2-CE2 3.68Å; L426-F485 HydrophobicContact CG-CD2 4.48Å; L426-F485 HydrophobicContact CG-CE2 4.14Å
427	L	96.8	Very high	93.7	Very high	1 Å²	1	70.6 Å²	70.6	1%	0.005	33%	0.329	C	S	.	.	H	α-helix	trans	-70.8	-33.6	174.5	-169.3	67	0	0	0	111.9	V389 M411 L423 F424 P425 L430 G431 I442 K444 F463	V389-L427 HydrophobicContact CG1-CD2 3.68Å; V389-L427 HydrophobicContact CG1-CG 3.99Å; V389-L427 HydrophobicContact CG2-CD2 4.42Å; V389-L427 HydrophobicContact CG2-CG 3.91Å; V389-L427 VanDerWaalsContact CG2-O 3.24Å; V389-L427 WeakPolarHBondContact CG2-O 3.36Å; M411-L427 HydrophobicContact CB-CD1 4.46Å; M411-L427 HydrophobicContact CB-CD2 3.54Å; M411-L427 HydrophobicContact CG-CD2 4.2Å; M411-L427 HydrophobicContact SD-CD2 3.7Å; L423-L427 WeakPolarHBondContact O-CB 3.34Å; L423-L427 PolarHBondContact O-N 2.84Å; F424-L427 PolarHBondContact O-N 3.4Å; P425-L427 VanDerWaalsContact C-N 3.34Å; P425-L427 PolarHBondContact O-N 3.38Å; L427-L430 HydrophobicContact CD1-CD2 4.2Å; L427-L430 PolarHBondContact O-N 3.44Å; L427-G431 PolarHBondContact O-N 2.94Å; L427-I442 HydrophobicContact CD1-CG2 3.47Å; L427-I442 VanDerWaalsContact CD1-CG2 3.47Å; L427-I442 HydrophobicContact CG-CG2 3.94Å; L427-K444 HydrophobicContact CD2-CB 4.07Å; L427-K444 HydrophobicContact CD2-CD 4.46Å; L427-F463 HydrophobicContact CD1-CE1 4.28Å
428	E	96.5	Very high	93.8	Very high	64 Å²	64	75 Å²	75	30%	0.299	36%	0.36	S	S	.	.	H	α-helix	trans	-71.1	-33.9	174.8	-158.1	73.6	-157.7	0	0	111.8	L388 F424 P425 R432 K444	L388-E428 HydrophobicContact CD1-CG 4.47Å; F424-E428 PolarHBondContact O-N 2.94Å; F424-E428 VanDerWaalsContact O-N 3.1Å; P425-E428 WeakPolarHBondContact O-CB 3.46Å; P425-E428 PolarHBondContact O-N 3.34Å; P425-E428 VanDerWaalsContact O-N 3.14Å; E428-R432 WeakPolarHBondContact O-CB 3.46Å; E428-R432 PolarHBondContact O-N 2.99Å; E428-K444 IonicContact OE2-NZ 2.74Å
429	E	96.5	Very high	94	Very high	97 Å²	97	68.5 Å²	68.5	45%	0.453	33%	0.334	S	S	.	.	H	α-helix	trans	-65.9	-42.1	168.2	-73.6	171.4	-157.8	0	0	112	P425 L426 R432 K433 L482	P425-E429 PolarHBondContact O-N 3.5Å; L426-E429 PolarHBondContact O-N 2.91Å; E429-R432 WeakPolarHBondContact O-CB 3.42Å; E429-R432 PolarHBondContact O-N 3.44Å; E429-K433 PolarHBondContact O-N 3.12Å; E429-L482 HydrophobicContact CB-CD1 3.99Å
430	L	97	Very high	94.3	Very high	0 Å²	0	62 Å²	62	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-62.8	-44.3	174.3	-167.2	71.7	0	0	0	111.2	F409 L426 L427 R432 K433 Y434 I442 L482 F485 L489	F409-L430 HydrophobicContact CD1-CD2 3.81Å; F409-L430 HydrophobicContact CE1-CD2 3.81Å; L426-L430 WeakPolarHBondContact O-CB 3.5Å; L426-L430 PolarHBondContact O-N 3.28Å; L427-L430 HydrophobicContact CD1-CD2 4.2Å; L427-L430 PolarHBondContact O-N 3.44Å; L430-R432 VanDerWaalsContact C-N 3.32Å; L430-R432 PolarHBondContact O-N 2.89Å; L430-K433 WeakPolarHBondContact O-CB 3.5Å; L430-K433 PolarHBondContact O-N 3.07Å; L430-K433 VanDerWaalsContact O-N 3.1Å; L430-Y434 HydrophobicContact CD1-CD2 4.04Å; L430-Y434 HydrophobicContact CD1-CE2 3.7Å; L430-Y434 HydrophobicContact CG-CD2 4.19Å; L430-Y434 HydrophobicContact CG-CE2 4.33Å; L430-Y434 WeakPolarHBondContact O-CD2 3.27Å; L430-Y434 PolarHBondContact O-N 3.19Å; L430-Y434 VanDerWaalsContact O-N 3.12Å; L430-I442 HydrophobicContact CD2-CD1 3.9Å; L430-I442 HydrophobicContact CD2-CG2 4.36Å; L430-I442 HydrophobicContact CG-CD1 4Å; L430-I442 HydrophobicContact CG-CG1 4.32Å; L430-L482 HydrophobicContact CB-CD1 4.07Å; L430-L482 HydrophobicContact CD1-CD1 4.01Å; L430-F485 HydrophobicContact CD1-CB 3.73Å; L430-F485 HydrophobicContact CD2-CB 3.79Å; L430-F485 HydrophobicContact CD2-CD2 4.1Å; L430-F485 HydrophobicContact CD2-CG 4.12Å; L430-F485 HydrophobicContact CG-CB 4.43Å; L430-L489 HydrophobicContact CD1-CD1 4.44Å; L430-L489 HydrophobicContact CD2-CD1 4.37Å
431	G	96.4	Very high	94.6	Very high	1 Å²	1	62.8 Å²	62.8	1%	0.01	31%	0.31	C	S	.	.	H	α-helix	trans	-56.7	-43.5	171.5	0	0	0	0	0	112.4	L388 L427 K433 Y434 Q435	L388-G431 VanDerWaalsContact O-CA 3.23Å; L388-G431 WeakPolarHBondContact O-CA 3.24Å; L427-G431 PolarHBondContact O-N 2.94Å; G431-K433 VanDerWaalsContact C-N 3.32Å; G431-K433 PolarHBondContact O-N 3.47Å; G431-Y434 PolarHBondContact O-N 3.12Å; G431-Q435 WeakPolarHBondContact O-CA 3.35Å; G431-Q435 WeakPolarHBondContact O-CB 3.47Å; G431-Q435 PolarHBondContact O-N 3.18Å
432	R	97.1	Very high	94.9	Very high	146 Å²	146	58 Å²	58	55%	0.551	29%	0.289	S	S	*	.	H	α-helix	trans	-64.5	-30.6	174.2	-165.5	179.3	-54.6	-68.1	-8.6	113.7	L388 E428 E429 L430 Q435	L388-R432 HydrophobicContact CD1-CB 4.04Å; L388-R432 HydrophobicContact CD1-CG 4.41Å; L388-R432 VanDerWaalsContact CD1-CZ 3.48Å; L388-R432 VanDerWaalsContact CD1-NH2 3.34Å; E428-R432 WeakPolarHBondContact O-CB 3.46Å; E428-R432 PolarHBondContact O-N 2.99Å; E429-R432 WeakPolarHBondContact O-CB 3.42Å; E429-R432 PolarHBondContact O-N 3.44Å; L430-R432 VanDerWaalsContact C-N 3.32Å; L430-R432 PolarHBondContact O-N 2.89Å; R432-Q435 WeakPolarHBondContact O-CG 3.47Å
433	K	96.5	Very high	95.2	Very high	95 Å²	95	51.5 Å²	51.5	41%	0.413	26%	0.257	S	S	.	.	H	α-helix	trans	-70.7	-42.1	175.6	-173	-175.6	172.1	-159.1	0	111.3	E429 L430 G431 S486 E490	E429-K433 PolarHBondContact O-N 3.12Å; L430-K433 WeakPolarHBondContact O-CB 3.5Å; L430-K433 PolarHBondContact O-N 3.07Å; L430-K433 VanDerWaalsContact O-N 3.1Å; G431-K433 VanDerWaalsContact C-N 3.32Å; G431-K433 PolarHBondContact O-N 3.47Å; K433-S486 PolarHBondContact NZ-OG 2.91Å; K433-E490 IonicContact NZ-OE1 3.76Å; K433-E490 PolarHBondContact NZ-OE1 3.01Å
434	Y	95.4	Very high	95.2	Very high	14 Å²	14	52.4 Å²	52.4	6%	0.055	26%	0.261	C	S	.	.	H	α-helix	trans	-102.3	4.1	-172.3	-65	-75.3	0	0	0	115.2	L430 G431 N436 H437 I440 I442 L489 E490	L430-Y434 HydrophobicContact CD1-CD2 4.04Å; L430-Y434 HydrophobicContact CD1-CE2 3.7Å; L430-Y434 HydrophobicContact CG-CD2 4.19Å; L430-Y434 HydrophobicContact CG-CE2 4.33Å; L430-Y434 WeakPolarHBondContact O-CD2 3.27Å; L430-Y434 PolarHBondContact O-N 3.19Å; L430-Y434 VanDerWaalsContact O-N 3.12Å; G431-Y434 PolarHBondContact O-N 3.12Å; Y434-N436 PolarHBondContact O-N 2.83Å; Y434-H437 HydrophobicContact CD1-CB 4.26Å; Y434-H437 AromaticContact CD1-CD2 3.89Å; Y434-H437 VanDerWaalsContact O-CB 3.25Å; Y434-H437 WeakPolarHBondContact O-CB 3.41Å; Y434-H437 PolarHBondContact O-N 3.12Å; Y434-I440 HydrophobicContact CD1-CB 4.36Å; Y434-I440 HydrophobicContact CD1-CD1 3.4Å; Y434-I440 VanDerWaalsContact CD1-CD1 3.4Å; Y434-I440 HydrophobicContact CD1-CG1 4.46Å; Y434-I440 HydrophobicContact CD1-CG2 4.28Å; Y434-I440 HydrophobicContact CD2-CG2 4.48Å; Y434-I440 HydrophobicContact CE1-CD1 3.47Å; Y434-I440 VanDerWaalsContact CE1-CD1 3.47Å; Y434-I440 HydrophobicContact CG-CB 4.46Å; Y434-I440 HydrophobicContact CG-CD1 4.08Å; Y434-I440 HydrophobicContact CG-CG2 3.93Å; Y434-I442 HydrophobicContact CD2-CD1 4.3Å; Y434-L489 HydrophobicContact CD2-CD1 4.19Å; Y434-L489 HydrophobicContact CE2-CD1 3.79Å; Y434-E490 PolarHBondContact OH-OE1 3.1Å
435	Q	92.9	Very high	95.1	Very high	104 Å²	104	49.7 Å²	49.7	49%	0.486	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.9	-22.6	-178.5	57.7	164.2	84.4	0	0	116.1	L388 G431 R432	L388-Q435 HydrophobicContact CD2-CB 3.97Å; G431-Q435 WeakPolarHBondContact O-CA 3.35Å; G431-Q435 WeakPolarHBondContact O-CB 3.47Å; G431-Q435 PolarHBondContact O-N 3.18Å; R432-Q435 WeakPolarHBondContact O-CG 3.47Å
436	N	92	Very high	94.8	Very high	142 Å²	142	46.1 Å²	46.1	76%	0.759	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-112	11.2	-179.5	-61.3	-4.7	0	0	0	112.2	Y434	Y434-N436 PolarHBondContact O-N 2.83Å
437	H	92.8	Very high	94.4	Very high	74 Å²	74	45.3 Å²	45.3	34%	0.343	22%	0.221	S	C	.	.			trans	-78	148.8	179.9	-161.3	-78.4	0	0	0	110.9	Y434 T439 I440	Y434-H437 HydrophobicContact CD1-CB 4.26Å; Y434-H437 AromaticContact CD1-CD2 3.89Å; Y434-H437 VanDerWaalsContact O-CB 3.25Å; Y434-H437 WeakPolarHBondContact O-CB 3.41Å; Y434-H437 PolarHBondContact O-N 3.12Å; H437-T439 PolarHBondContact CE1-OG1 2.83Å; H437-T439 PolarHBondContact ND1-N 2.89Å; H437-T439 PolarHBondContact ND1-OG1 3.12Å; H437-I440 HydrophobicContact CB-CB 4.19Å; H437-I440 PolarHBondContact ND1-N 2.89Å
438	S	88.3	Confident	93.5	Very high	94 Å²	94	45.9 Å²	45.9	66%	0.657	23%	0.225	S	C	*	.	S	Bend	trans	-71.8	-44.8	-176.3	48.9	0	0	0	0	113.7	K406	K406-S438 PolarHBondContact NZ-O 3.42Å
439	T	90.1	Very high	92.7	Very high	26 Å²	26	43.2 Å²	43.2	16%	0.16	21%	0.214	C	C	.	.	S	Bend	trans	-102.9	-46.5	-178	62.7	0	0	0	0	114.3	K406 D407 H437 I441	K406-T439 CarbonylContact C-O 3.59Å; K406-T439 VanDerWaalsContact CA-O 3.25Å; K406-T439 WeakPolarHBondContact CA-O 3.12Å; K406-T439 WeakPolarHBondContact CB-O 3.39Å; K406-T439 WeakPolarHBondContact CD-O 3.48Å; D407-T439 PolarHBondContact N-O 3.1Å; D407-T439 WeakPolarHBondContact OD2-CB 3.08Å; D407-T439 PolarHBondContact OD2-OG1 3.4Å; H437-T439 PolarHBondContact CE1-OG1 2.83Å; H437-T439 PolarHBondContact ND1-N 2.89Å; H437-T439 PolarHBondContact ND1-OG1 3.12Å; T439-I441 PolarHBondContact O-N 3.01Å
440	I	95.1	Very high	92.1	Very high	10 Å²	10	38.7 Å²	38.7	5%	0.051	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.4	129.4	-173.7	-66.6	170.5	0	0	0	113	D407 Y434 H437 I442 L489 I493	D407-I440 HydrophobicContact CB-CG1 4.2Å; D407-I440 WeakPolarHBondContact O-CA 3.23Å; Y434-I440 HydrophobicContact CD1-CB 4.36Å; Y434-I440 HydrophobicContact CD1-CD1 3.4Å; Y434-I440 VanDerWaalsContact CD1-CD1 3.4Å; Y434-I440 HydrophobicContact CD1-CG1 4.46Å; Y434-I440 HydrophobicContact CD1-CG2 4.28Å; Y434-I440 HydrophobicContact CD2-CG2 4.48Å; Y434-I440 HydrophobicContact CE1-CD1 3.47Å; Y434-I440 VanDerWaalsContact CE1-CD1 3.47Å; Y434-I440 HydrophobicContact CG-CB 4.46Å; Y434-I440 HydrophobicContact CG-CD1 4.08Å; Y434-I440 HydrophobicContact CG-CG2 3.93Å; H437-I440 HydrophobicContact CB-CB 4.19Å; H437-I440 PolarHBondContact ND1-N 2.89Å; I440-I442 HydrophobicContact CG2-CD1 3.58Å; I440-I442 HydrophobicContact CG2-CG1 4.23Å; I440-L489 HydrophobicContact CD1-CB 4.09Å; I440-L489 HydrophobicContact CD1-CD1 4.48Å; I440-I493 HydrophobicContact CD1-CD1 3.55Å; I440-I493 HydrophobicContact CG1-CD1 3.82Å
441	I	95.9	Very high	91.2	Very high	16 Å²	16	40.6 Å²	40.6	8%	0.082	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	125.7	164.8	-66.3	177.1	0	0	0	109.1	K390 K406 D407 V408 F409 T439 A443	K390-I441 HydrophobicContact CD-CG2 3.78Å; K390-I441 HydrophobicContact CG-CG2 4.19Å; K406-I441 HydrophobicContact CB-CD1 3.84Å; K406-I441 HydrophobicContact CB-CG1 4.28Å; K406-I441 HydrophobicContact CD-CD1 4Å; K406-I441 HydrophobicContact CD-CG1 4.3Å; K406-I441 HydrophobicContact CG-CD1 3.73Å; K406-I441 HydrophobicContact CG-CG1 4.41Å; D407-I441 PolarHBondContact O-N 3.41Å; V408-I441 HydrophobicContact CG1-CB 4.21Å; V408-I441 HydrophobicContact CG1-CG2 4.13Å; V408-I441 HydrophobicContact CG2-CB 4.21Å; V408-I441 HydrophobicContact CG2-CD1 4.38Å; F409-I441 PolarHBondContact N-O 3.1Å; T439-I441 PolarHBondContact O-N 3.01Å; I441-A443 HydrophobicContact CG2-CB 4.4Å
442	I	98.1	Very high	90.2	Very high	8 Å²	8	41.6 Å²	41.6	4%	0.041	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	127.2	169.7	-50.4	-54.4	0	0	0	109.2	V389 K390 F409 L427 L430 Y434 I440 L489	V389-I442 WeakPolarHBondContact CA-O 3.33Å; V389-I442 HydrophobicContact CG1-CG2 4.3Å; V389-I442 HydrophobicContact CG2-CG2 4.11Å; K390-I442 PolarHBondContact N-O 3.17Å; F409-I442 HydrophobicContact CB-CD1 4.03Å; F409-I442 HydrophobicContact CD1-CD1 4.31Å; L427-I442 HydrophobicContact CD1-CG2 3.47Å; L427-I442 VanDerWaalsContact CD1-CG2 3.47Å; L427-I442 HydrophobicContact CG-CG2 3.94Å; L430-I442 HydrophobicContact CD2-CD1 3.9Å; L430-I442 HydrophobicContact CD2-CG2 4.36Å; L430-I442 HydrophobicContact CG-CD1 4Å; L430-I442 HydrophobicContact CG-CG1 4.32Å; Y434-I442 HydrophobicContact CD2-CD1 4.3Å; I440-I442 HydrophobicContact CG2-CD1 3.58Å; I440-I442 HydrophobicContact CG2-CG1 4.23Å; I442-L489 HydrophobicContact CD1-CD1 4.04Å
443	A	97.6	Very high	88.9	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	167.3	-172.8	0	0	0	0	0	113.6	K390 L392 V408 F409 V410 M411 I441	K390-A443 HydrophobicContact CB-CB 4.26Å; K390-A443 CarbonylContact O-C 3.51Å; K390-A443 VanDerWaalsContact O-CA 3.23Å; K390-A443 WeakPolarHBondContact O-CA 3.39Å; L392-A443 HydrophobicContact CD1-CB 3.91Å; L392-A443 HydrophobicContact CG-CB 4.14Å; V408-A443 HydrophobicContact CG1-CB 4.38Å; F409-A443 PolarHBondContact O-N 2.95Å; V410-A443 WeakPolarHBondContact CA-O 3.47Å; V410-A443 HydrophobicContact CG2-CB 4.29Å; M411-A443 PolarHBondContact N-O 3.43Å; I441-A443 HydrophobicContact CG2-CB 4.4Å
444	K	96.5	Very high	87	Confident	41 Å²	41	40.2 Å²	40.2	18%	0.178	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	147.3	177.2	66.6	-169.2	166.3	-150.6	0	113.3	V389 K390 Q391 L392 M411 Y413 L427 E428	V389-K444 HydrophobicContact CB-CD 4.49Å; V389-K444 HydrophobicContact CG1-CB 4.03Å; V389-K444 HydrophobicContact CG1-CD 3.72Å; V389-K444 HydrophobicContact CG1-CG 3.81Å; K390-K444 PolarHBondContact O-N 3.25Å; Q391-K444 PolarHBondContact NE2-O 3.31Å; Q391-K444 VanDerWaalsContact OE1-CE 3.31Å; L392-K444 PolarHBondContact N-O 3.22Å; M411-K444 HydrophobicContact CB-CB 4.16Å; M411-K444 CarbonylContact O-C 3.47Å; M411-K444 VanDerWaalsContact O-CA 3.23Å; M411-K444 WeakPolarHBondContact O-CA 3.22Å; Y413-K444 HydrophobicContact CD1-CB 3.93Å; Y413-K444 HydrophobicContact CD1-CG 4.5Å; Y413-K444 HydrophobicContact CE1-CB 3.68Å; Y413-K444 HydrophobicContact CE1-CD 4.2Å; Y413-K444 HydrophobicContact CE1-CG 3.79Å; L427-K444 HydrophobicContact CD2-CB 4.07Å; L427-K444 HydrophobicContact CD2-CD 4.46Å; E428-K444 IonicContact OE2-NZ 2.74Å
445	I	93.7	Very high	85.4	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	136.8	176.1	-173	159.4	0	0	0	113.3	L392 F397 V410 M411 F412 Y413 I447 N450 I452	L392-I445 HydrophobicContact CB-CB 4.15Å; L392-I445 HydrophobicContact CB-CD1 4.27Å; F397-I445 HydrophobicContact CB-CD1 4.11Å; F397-I445 HydrophobicContact CD2-CD1 3.61Å; F397-I445 HydrophobicContact CD2-CG2 4.43Å; F397-I445 HydrophobicContact CE2-CD1 4.36Å; F397-I445 HydrophobicContact CE2-CG2 4.24Å; F397-I445 HydrophobicContact CG-CD1 4.07Å; V410-I445 HydrophobicContact CG1-CG2 3.96Å; M411-I445 PolarHBondContact O-N 3.34Å; F412-I445 HydrophobicContact CD1-CG2 3.32Å; F412-I445 HydrophobicContact CE1-CG2 3.69Å; F412-I445 HydrophobicContact CG-CG2 4.05Å; Y413-I445 VanDerWaalsContact CD1-C 3.47Å; Y413-I445 WeakPolarHBondContact CD1-O 3.37Å; Y413-I445 WeakPolarHBondContact CE1-O 3.36Å; Y413-I445 PolarHBondContact N-O 3.12Å; I445-I447 HydrophobicContact CG2-CG2 4.01Å; I445-I447 PolarHBondContact O-N 3.26Å; I445-N450 HydrophobicContact CD1-CB 4.25Å; I445-N450 HydrophobicContact CG1-CB 4.39Å; I445-I452 HydrophobicContact CD1-CG2 3.88Å
446	D	89.8	Confident	83.9	Confident	3 Å²	3	41.1 Å²	41.1	2%	0.016	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	98.7	170.6	179	-8.1	0	0	0	109.9	Y413 P415 T448 A449 N450	Y413-D446 HydrophobicContact CE2-CB 4.09Å; Y413-D446 WeakPolarHBondContact O-CA 3.28Å; P415-D446 VanDerWaalsContact CD-CG 3.47Å; P415-D446 WeakPolarHBondContact CD-OD1 3.42Å; P415-D446 VanDerWaalsContact CD-OD2 3.28Å; P415-D446 WeakPolarHBondContact CD-OD2 3.47Å; P415-D446 HydrophobicContact CG-CB 4.4Å; P415-D446 WeakPolarHBondContact CG-OD2 3.4Å; D446-T448 PolarHBondContact O-N 2.96Å; D446-T448 WeakPolarHBondContact OD1-CA 3.42Å; D446-T448 VanDerWaalsContact OD1-CB 3.31Å; D446-T448 WeakPolarHBondContact OD1-CB 3.48Å; D446-T448 PolarHBondContact OD1-N 2.96Å; D446-T448 PolarHBondContact OD1-OG1 2.94Å; D446-A449 HydrophobicContact CB-CB 4.44Å; D446-A449 PolarHBondContact O-N 2.76Å; D446-A449 PolarHBondContact OD1-N 2.97Å; D446-A449 VanDerWaalsContact OD1-N 3.15Å; D446-A449 WeakPolarHBondContact OD2-CB 3.22Å; D446-N450 WeakPolarHBondContact O-CB 3.28Å; D446-N450 PolarHBondContact O-N 3.34Å; D446-N450 VanDerWaalsContact O-N 3.16Å; D446-N450 PolarHBondContact O-ND2 3.33Å
447	I	86.6	Confident	82.7	Confident	15 Å²	15	36.2 Å²	36.2	8%	0.077	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.5	2.2	-179.9	64.3	169.6	0	0	0	114	F412 Y413 I445 I452 L457 Y460 F462	F412-I447 HydrophobicContact CB-CD1 4.45Å; F412-I447 HydrophobicContact CB-CG2 3.98Å; F412-I447 HydrophobicContact CD1-CG2 3.68Å; F412-I447 HydrophobicContact CG-CG2 4.33Å; Y413-I447 PolarHBondContact O-N 3.11Å; I445-I447 HydrophobicContact CG2-CG2 4.01Å; I445-I447 PolarHBondContact O-N 3.26Å; I447-I452 HydrophobicContact CG2-CD1 3.71Å; I447-I452 HydrophobicContact CG2-CG1 4.36Å; I447-L457 HydrophobicContact CD1-CD2 4.24Å; I447-Y460 HydrophobicContact CD1-CD1 4.06Å; I447-Y460 HydrophobicContact CG1-CD1 4.3Å; I447-F462 HydrophobicContact CD1-CE1 3.73Å; I447-F462 HydrophobicContact CD1-CZ 4.42Å
448	T	77.8	Confident	81.9	Confident	14 Å²	14	35.4 Å²	35.4	9%	0.086	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.6	-30	175.1	78.7	0	0	0	0	111.2	H374 A414 W416 D446 Y460	H374-T448 PolarHBondContact ND1-O 3.3Å; A414-T448 HydrophobicContact CB-CG2 3.54Å; W416-T448 VanDerWaalsContact CH2-CB 3.42Å; W416-T448 HydrophobicContact CH2-CG2 3.62Å; W416-T448 WeakPolarHBondContact CH2-OG1 3.31Å; W416-T448 HydrophobicContact CZ2-CG2 3.67Å; W416-T448 HydrophobicContact CZ3-CG2 4.44Å; W416-T448 WeakPolarHBondContact CZ3-OG1 3.49Å; D446-T448 PolarHBondContact O-N 2.96Å; D446-T448 WeakPolarHBondContact OD1-CA 3.42Å; D446-T448 VanDerWaalsContact OD1-CB 3.31Å; D446-T448 WeakPolarHBondContact OD1-CB 3.48Å; D446-T448 PolarHBondContact OD1-N 2.96Å; D446-T448 PolarHBondContact OD1-OG1 2.94Å; T448-Y460 HydrophobicContact CG2-CE1 4.36Å
449	A	81.5	Confident	81.5	Confident	8 Å²	8	37.1 Å²	37.1	7%	0.066	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.9	-13.1	178.4	0	0	0	0	0	114.3	Q375 E378 D446	Q375-A449 VanDerWaalsContact O-O 3.14Å; E378-A449 HydrophobicContact CG-CB 3.73Å; D446-A449 HydrophobicContact CB-CB 4.44Å; D446-A449 PolarHBondContact O-N 2.76Å; D446-A449 PolarHBondContact OD1-N 2.97Å; D446-A449 VanDerWaalsContact OD1-N 3.15Å; D446-A449 WeakPolarHBondContact OD2-CB 3.22Å
450	N	82.2	Confident	81.2	Confident	1 Å²	1	38.5 Å²	38.5	1%	0.005	18%	0.184	C	C	.	.	S	Bend	trans	-126.3	139.6	-177.9	-59.9	-91.6	0	0	0	110.8	S377 E378 V393 G394 I445 D446	S377-N450 WeakPolarHBondContact CA-OD1 3.29Å; S377-N450 PolarHBondContact OG-OD1 3.08Å; E378-N450 PolarHBondContact N-OD1 3.22Å; E378-N450 PolarHBondContact OE2-ND2 3.16Å; E378-N450 VanDerWaalsContact OE2-ND2 3.14Å; V393-N450 VanDerWaalsContact CA-OD1 3.29Å; V393-N450 WeakPolarHBondContact CA-OD1 3.09Å; V393-N450 VanDerWaalsContact CB-OD1 3.27Å; V393-N450 WeakPolarHBondContact CB-OD1 3.43Å; G394-N450 PolarHBondContact N-OD1 3.41Å; I445-N450 HydrophobicContact CD1-CB 4.25Å; I445-N450 HydrophobicContact CG1-CB 4.39Å; D446-N450 WeakPolarHBondContact O-CB 3.28Å; D446-N450 PolarHBondContact O-N 3.34Å; D446-N450 VanDerWaalsContact O-N 3.16Å; D446-N450 PolarHBondContact O-ND2 3.33Å
451	D	78.3	Confident	80.9	Confident	40 Å²	40	38.8 Å²	38.8	21%	0.214	19%	0.187	C	C	.	.			trans	-88.3	129.2	171.1	-74.1	-36	0	0	0	110.2	R327 H374 S376	R327-D451 IonicContact CZ-OD2 3.14Å; R327-D451 IonicContact NE-OD2 2.73Å; R327-D451 IonicContact NH1-OD2 3.3Å; R327-D451 PolarHBondContact NH1-OD2 2.97Å; H374-D451 IonicContact CE1-OD1 2.74Å; H374-D451 PolarHBondContact CE1-OD1 2.81Å; H374-D451 VanDerWaalsContact CE1-OD1 3.24Å; H374-D451 IonicContact NE2-OD1 2.66Å; H374-D451 PolarHBondContact NE2-OD1 3.18Å; S376-D451 WeakPolarHBondContact CA-OD2 3.34Å; S376-D451 PolarHBondContact O-N 2.97Å
452	I	75.5	Confident	80.8	Confident	22 Å²	22	38.4 Å²	38.4	11%	0.113	19%	0.185	C	C	.	.			trans	-122	164.5	172.4	60.6	170.2	0	0	0	110.6	F397 F412 I445 I447 L454 L457	F397-I452 HydrophobicContact CD1-CG2 4.18Å; F397-I452 HydrophobicContact CE1-CG2 4.33Å; F397-I452 HydrophobicContact CG-CG2 4.29Å; F412-I452 HydrophobicContact CD1-CD1 3.6Å; F412-I452 HydrophobicContact CE1-CD1 3.56Å; I445-I452 HydrophobicContact CD1-CG2 3.88Å; I447-I452 HydrophobicContact CG2-CD1 3.71Å; I447-I452 HydrophobicContact CG2-CG1 4.36Å; I452-L454 PolarHBondContact O-N 3.38Å; I452-L457 HydrophobicContact CD1-CD2 3.93Å; I452-L457 HydrophobicContact CG1-CD2 3.78Å; I452-L457 HydrophobicContact CG1-CG 4.34Å
453	Q	70.3	Confident	80.6	Confident	84 Å²	84	38.1 Å²	38.1	39%	0.393	18%	0.183	S	C	.	.			trans	-63.8	134.4	-178.2	-65.5	178.8	-8.2	0	0	111.4	M455 Y456	Q453-M455 HydrophobicContact CB-CE 4.49Å; Q453-M455 PolarHBondContact O-N 2.86Å; Q453-M455 VanDerWaalsContact O-N 3.1Å; Q453-Y456 HydrophobicContact CB-CD2 3.97Å; Q453-Y456 HydrophobicContact CB-CE2 4.11Å; Q453-Y456 PolarHBondContact O-N 2.89Å
454	L	56.8	Low	80.5	Confident	128 Å²	128	39.3 Å²	39.3	67%	0.67	19%	0.188	S	C	*	.	G	3₁₀ helix	trans	-56.3	-34.2	-167.7	-63	174.3	0	0	0	114	T329 I452 Y456 L457	T329-L454 HydrophobicContact CG2-CD2 3.9Å; I452-L454 PolarHBondContact O-N 3.38Å; L454-Y456 PolarHBondContact O-N 3.5Å; L454-Y456 VanDerWaalsContact O-N 3.12Å; L454-L457 HydrophobicContact CD2-CD1 3.8Å; L454-L457 PolarHBondContact O-N 2.88Å; L454-L457 VanDerWaalsContact O-N 3.12Å
455	M	60.9	Low	80.4	Confident	124 Å²	124	37.5 Å²	37.5	61%	0.611	18%	0.18	S	C	*	.	G	3₁₀ helix	trans	-63.1	-15.2	179	59.3	178.8	161.5	0	0	114.8	Q453	Q453-M455 HydrophobicContact CB-CE 4.49Å; Q453-M455 PolarHBondContact O-N 2.86Å; Q453-M455 VanDerWaalsContact O-N 3.1Å
456	Y	63	Low	80.3	Confident	14 Å²	14	37.6 Å²	37.6	6%	0.055	18%	0.18	C	C	.	.	G	3₁₀ helix	trans	-98.9	-7.8	177.2	-54.2	-51.3	0	0	0	113.8	F402 Q453 L454 F462 R464 F466 A473	F402-Y456 AromaticContact CZ-CE2 3.96Å; F402-Y456 HydrophobicContact CZ-CE2 3.96Å; F402-Y456 AromaticContact CZ-CZ 3.93Å; F402-Y456 WeakPolarHBondContact CZ-OH 3.34Å; Q453-Y456 HydrophobicContact CB-CD2 3.97Å; Q453-Y456 HydrophobicContact CB-CE2 4.11Å; Q453-Y456 PolarHBondContact O-N 2.89Å; L454-Y456 PolarHBondContact O-N 3.5Å; L454-Y456 VanDerWaalsContact O-N 3.12Å; Y456-F462 WeakPolarHBondContact O-CE2 3.09Å; Y456-F462 WeakPolarHBondContact O-CZ 3.41Å; Y456-R464 PolarHBondContact O-NE 2.96Å; Y456-R464 PolarHBondContact O-NH2 2.92Å; Y456-F466 HydrophobicContact CD1-CE1 4.24Å; Y456-F466 HydrophobicContact CD1-CZ 4.31Å; Y456-F466 HydrophobicContact CD2-CE1 4.49Å; Y456-F466 HydrophobicContact CE1-CE1 4.04Å; Y456-F466 HydrophobicContact CE2-CE1 4.3Å; Y456-F466 HydrophobicContact CG-CE1 4.47Å; Y456-F466 HydrophobicContact CG-CZ 4.35Å; Y456-A473 HydrophobicContact CD1-CB 3.76Å; Y456-A473 HydrophobicContact CE1-CB 3.52Å
457	L	66.9	Low	80.3	Confident	39 Å²	39	38.7 Å²	38.7	20%	0.204	19%	0.188	C	C	.	.			trans	-70.9	146	179.8	-69	171.3	0	0	0	112.3	T329 V331 I447 I452 L454 R464	T329-L457 HydrophobicContact CG2-CD1 3.81Å; V331-L457 HydrophobicContact CG2-CB 4.38Å; I447-L457 HydrophobicContact CD1-CD2 4.24Å; I452-L457 HydrophobicContact CD1-CD2 3.93Å; I452-L457 HydrophobicContact CG1-CD2 3.78Å; I452-L457 HydrophobicContact CG1-CG 4.34Å; L454-L457 HydrophobicContact CD2-CD1 3.8Å; L454-L457 PolarHBondContact O-N 2.88Å; L454-L457 VanDerWaalsContact O-N 3.12Å; L457-R464 PolarHBondContact O-NH2 3.03Å
458	D	75.4	Confident	80.3	Confident	57 Å²	57	38.9 Å²	38.9	31%	0.305	19%	0.189	S	C	.	.			trans	-156.1	177.5	168.1	-157.8	-20	0	0	0	107.5	Y460 F462	D458-Y460 PolarHBondContact O-N 2.95Å; D458-F462 HydrophobicContact CB-CB 4.15Å; D458-F462 HydrophobicContact CB-CD1 3.63Å; D458-F462 HydrophobicContact CB-CD2 4.02Å; D458-F462 HydrophobicContact CB-CE1 3.91Å; D458-F462 HydrophobicContact CB-CE2 4.29Å; D458-F462 HydrophobicContact CB-CG 3.68Å; D458-F462 HydrophobicContact CB-CZ 4.24Å; D458-F462 VanDerWaalsContact N-CE1 3.3Å; D458-F462 WeakPolarHBondContact O-CD1 3.36Å; D458-F462 WeakPolarHBondContact O-CE1 3.37Å
459	R	78.7	Confident	80.3	Confident	130 Å²	130	43.4 Å²	43.4	49%	0.491	21%	0.213	S	C	.	.	S	Bend	trans	-76.9	118.3	177.9	-171.3	176.8	-63.1	-99	-2.3	110.8	V331 I333	V331-R459 HydrophobicContact CB-CB 4.4Å; V331-R459 VanDerWaalsContact O-CZ 3.28Å; V331-R459 PolarHBondContact O-NH2 3.45Å; I333-R459 PolarHBondContact O-NH2 2.94Å
460	Y	84.3	Confident	80.1	Confident	55 Å²	55	45.2 Å²	45.2	22%	0.216	23%	0.225	C	C	.	.	S	Bend	trans	-62.7	150.5	-179.4	55.2	-100.3	0	0	0	113.8	D352 A414 I447 T448 D458	D352-Y460 PolarHBondContact OD1-OH 2.8Å; A414-Y460 HydrophobicContact CB-CD1 4.14Å; A414-Y460 HydrophobicContact CB-CD2 3.56Å; A414-Y460 HydrophobicContact CB-CE1 3.97Å; A414-Y460 HydrophobicContact CB-CE2 3.38Å; A414-Y460 HydrophobicContact CB-CG 3.95Å; I447-Y460 HydrophobicContact CD1-CD1 4.06Å; I447-Y460 HydrophobicContact CG1-CD1 4.3Å; T448-Y460 HydrophobicContact CG2-CE1 4.36Å; D458-Y460 PolarHBondContact O-N 2.95Å
461	P	89.9	Confident	79.6	Confident	15 Å²	15	53.1 Å²	53.1	10%	0.097	26%	0.262	C	S	.	.	S	Bend	cis	-75.1	132.7	-10.5	29.9	-32.3	0	0	0	111.8	M411 F412 K419 L423	M411-P461 HydrophobicContact CE-CB 3.63Å; F412-P461 WeakPolarHBondContact O-CA 3.12Å; K419-P461 HydrophobicContact CB-CG 3.84Å; L423-P461 HydrophobicContact CD1-CB 3.96Å; L423-P461 HydrophobicContact CD1-CG 3.63Å
462	F	92.6	Very high	79.7	Confident	9 Å²	9	58.7 Å²	58.7	4%	0.039	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	164.9	169	70.7	-91.9	0	0	0	110.1	F412 I447 Y456 D458 R464 L475	F412-F462 HydrophobicContact CB-CD1 3.8Å; F412-F462 HydrophobicContact CB-CD2 3.99Å; F412-F462 HydrophobicContact CB-CE1 3.39Å; F412-F462 HydrophobicContact CB-CE2 3.58Å; F412-F462 HydrophobicContact CB-CG 4.09Å; F412-F462 HydrophobicContact CB-CZ 3.27Å; F412-F462 AromaticContact CD1-CE2 3.98Å; F412-F462 HydrophobicContact CD1-CE2 3.98Å; F412-F462 AromaticContact CD1-CZ 3.77Å; F412-F462 HydrophobicContact CD1-CZ 3.77Å; F412-F462 AromaticContact CD2-CD2 3.6Å; F412-F462 HydrophobicContact CD2-CD2 3.6Å; F412-F462 AromaticContact CD2-CE2 3.18Å; F412-F462 HydrophobicContact CD2-CE2 3.18Å; F412-F462 HydrophobicContact CD2-CG 4.46Å; F412-F462 AromaticContact CD2-CZ 3.77Å; F412-F462 HydrophobicContact CD2-CZ 3.77Å; F412-F462 HydrophobicContact CE1-CE2 4.48Å; F412-F462 HydrophobicContact CE2-CD2 4.36Å; F412-F462 AromaticContact CE2-CE2 3.79Å; F412-F462 HydrophobicContact CE2-CE2 3.79Å; F412-F462 AromaticContact CG-CD2 3.99Å; F412-F462 HydrophobicContact CG-CD2 3.99Å; F412-F462 HydrophobicContact CG-CE1 4.02Å; F412-F462 AromaticContact CG-CE2 3.29Å; F412-F462 HydrophobicContact CG-CE2 3.29Å; F412-F462 AromaticContact CG-CZ 3.32Å; F412-F462 HydrophobicContact CG-CZ 3.32Å; F412-F462 HydrophobicContact CZ-CE2 4.39Å; F412-F462 PolarHBondContact N-O 3.02Å; F412-F462 PolarHBondContact O-N 3.14Å; I447-F462 HydrophobicContact CD1-CE1 3.73Å; I447-F462 HydrophobicContact CD1-CZ 4.42Å; Y456-F462 WeakPolarHBondContact O-CE2 3.09Å; Y456-F462 WeakPolarHBondContact O-CZ 3.41Å; D458-F462 HydrophobicContact CB-CB 4.15Å; D458-F462 HydrophobicContact CB-CD1 3.63Å; D458-F462 HydrophobicContact CB-CD2 4.02Å; D458-F462 HydrophobicContact CB-CE1 3.91Å; D458-F462 HydrophobicContact CB-CE2 4.29Å; D458-F462 HydrophobicContact CB-CG 3.68Å; D458-F462 HydrophobicContact CB-CZ 4.24Å; D458-F462 VanDerWaalsContact N-CE1 3.3Å; D458-F462 WeakPolarHBondContact O-CD1 3.36Å; D458-F462 WeakPolarHBondContact O-CE1 3.37Å; F462-R464 HydrophobicContact CD2-CG 4.19Å; F462-R464 HydrophobicContact CE2-CG 4.15Å; F462-L475 HydrophobicContact CD2-CD1 4.39Å
463	F	95.2	Very high	80.3	Confident	2 Å²	2	58.3 Å²	58.3	1%	0.009	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	142.9	-177.7	-52.9	-101.6	0	0	0	110.6	F409 V410 M411 L423 L427 Y476 H480 F485	F409-F463 HydrophobicContact CE1-CB 4.2Å; F409-F463 AromaticContact CE1-CD1 3.72Å; F409-F463 HydrophobicContact CE1-CD1 3.72Å; F409-F463 HydrophobicContact CE1-CE1 4.48Å; F409-F463 HydrophobicContact CE1-CG 4.24Å; F409-F463 HydrophobicContact CE2-CB 3.88Å; F409-F463 HydrophobicContact CZ-CB 3.52Å; F409-F463 AromaticContact CZ-CD1 3.88Å; F409-F463 HydrophobicContact CZ-CD1 3.88Å; F409-F463 AromaticContact CZ-CG 3.91Å; F409-F463 HydrophobicContact CZ-CG 3.91Å; V410-F463 VanDerWaalsContact O-CA 3.28Å; V410-F463 WeakPolarHBondContact O-CA 3.45Å; M411-F463 HydrophobicContact CB-CD1 3.7Å; M411-F463 HydrophobicContact CB-CE1 3.54Å; M411-F463 HydrophobicContact CB-CZ 4.48Å; M411-F463 HydrophobicContact CE-CZ 4.28Å; M411-F463 HydrophobicContact CG-CD1 3.96Å; M411-F463 HydrophobicContact CG-CE1 3.45Å; M411-F463 VanDerWaalsContact CG-CE1 3.45Å; M411-F463 HydrophobicContact CG-CZ 3.92Å; M411-F463 HydrophobicContact SD-CE1 4.12Å; M411-F463 HydrophobicContact SD-CZ 4.33Å; L423-F463 HydrophobicContact CB-CZ 4.5Å; L423-F463 HydrophobicContact CD1-CE2 4.06Å; L423-F463 HydrophobicContact CD1-CZ 3.93Å; L427-F463 HydrophobicContact CD1-CE1 4.28Å; F463-Y476 HydrophobicContact CB-CG 4.44Å; F463-Y476 HydrophobicContact CD2-CD1 4.47Å; F463-Y476 WeakPolarHBondContact O-CB 3.39Å; F463-Y476 PolarHBondContact O-N 2.71Å; F463-H480 AromaticContact CE2-CE1 3.75Å; F463-H480 AromaticContact CE2-ND1 3.94Å; F463-H480 AromaticContact CE2-NE2 3.87Å; F463-F485 HydrophobicContact CD1-CE1 4.34Å; F463-F485 HydrophobicContact CD1-CZ 4.37Å; F463-F485 AromaticContact CD2-CE1 3.99Å; F463-F485 HydrophobicContact CD2-CE1 3.99Å; F463-F485 HydrophobicContact CD2-CZ 4.17Å; F463-F485 HydrophobicContact CE1-CE1 4.31Å; F463-F485 AromaticContact CE1-CZ 3.88Å; F463-F485 HydrophobicContact CE1-CZ 3.88Å; F463-F485 AromaticContact CE2-CE1 3.99Å; F463-F485 HydrophobicContact CE2-CE1 3.99Å; F463-F485 AromaticContact CE2-CZ 3.7Å; F463-F485 HydrophobicContact CE2-CZ 3.7Å; F463-F485 HydrophobicContact CG-CE1 4.19Å; F463-F485 HydrophobicContact CZ-CE1 4.16Å; F463-F485 HydrophobicContact CZ-CE2 4.37Å; F463-F485 AromaticContact CZ-CZ 3.54Å; F463-F485 HydrophobicContact CZ-CZ 3.54Å
464	R	93.9	Very high	81.3	Confident	25 Å²	25	56.4 Å²	56.4	9%	0.094	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	142.9	170	-58.1	-176	179	-102.4	1.8	110.3	V410 F412 Y456 L457 F462 F466 A473 V474 L475	V410-R464 PolarHBondContact N-O 3.14Å; V410-R464 PolarHBondContact O-N 2.86Å; V410-R464 VanDerWaalsContact O-N 3.1Å; F412-R464 HydrophobicContact CE2-CB 3.88Å; F412-R464 HydrophobicContact CE2-CG 3.94Å; Y456-R464 PolarHBondContact O-NE 2.96Å; Y456-R464 PolarHBondContact O-NH2 2.92Å; L457-R464 PolarHBondContact O-NH2 3.03Å; F462-R464 HydrophobicContact CD2-CG 4.19Å; F462-R464 HydrophobicContact CE2-CG 4.15Å; R464-F466 HydrophobicContact CB-CD2 4.47Å; R464-F466 HydrophobicContact CB-CE2 3.9Å; R464-F466 HydrophobicContact CB-CZ 4.49Å; R464-A473 HydrophobicContact CB-CB 4.43Å; R464-V474 CarbonylContact C-O 3.6Å; R464-V474 VanDerWaalsContact CA-O 3.22Å; R464-V474 WeakPolarHBondContact CA-O 3.25Å; R464-V474 WeakPolarHBondContact CB-O 3.32Å; R464-L475 HydrophobicContact CG-CD1 4.13Å
465	L	94.5	Very high	82.9	Confident	3 Å²	3	52.6 Å²	52.6	2%	0.016	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	133.9	163.7	178.1	62.2	0	0	0	108.5	D407 F409 P467 A473 V474 F488 L489 H492	D407-L465 HydrophobicContact CB-CD1 4.18Å; F409-L465 HydrophobicContact CB-CD1 4.42Å; F409-L465 HydrophobicContact CD2-CB 4.25Å; L465-P467 HydrophobicContact CD2-CG 4.46Å; L465-P467 HydrophobicContact CG-CG 4.29Å; L465-A473 CarbonylContact O-C 3.58Å; L465-A473 VanDerWaalsContact O-CA 3.32Å; L465-A473 WeakPolarHBondContact O-CA 3.33Å; L465-V474 HydrophobicContact CB-CB 4.45Å; L465-V474 PolarHBondContact N-O 3.13Å; L465-V474 PolarHBondContact O-N 2.6Å; L465-F488 HydrophobicContact CB-CE1 3.95Å; L465-F488 HydrophobicContact CB-CZ 4.21Å; L465-F488 HydrophobicContact CD2-CE1 4.22Å; L465-F488 HydrophobicContact CD2-CZ 4.49Å; L465-L489 HydrophobicContact CD1-CD2 4.04Å; L465-H492 HydrophobicContact CD2-CB 3.79Å
466	F	92.7	Very high	84.5	Confident	2 Å²	2	47.5 Å²	47.5	1%	0.009	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	103.5	165.4	-61.8	-107.9	0	0	0	106	F397 V401 F402 V408 V410 F412 Y456 R464 A473	F397-F466 HydrophobicContact CE1-CZ 4.47Å; F397-F466 HydrophobicContact CZ-CE1 4.44Å; F397-F466 HydrophobicContact CZ-CE2 4.36Å; F397-F466 AromaticContact CZ-CZ 3.8Å; F397-F466 HydrophobicContact CZ-CZ 3.8Å; V401-F466 HydrophobicContact CB-CB 4.24Å; V401-F466 HydrophobicContact CB-CD1 3.81Å; V401-F466 HydrophobicContact CB-CD2 3.96Å; V401-F466 HydrophobicContact CB-CE1 4.12Å; V401-F466 HydrophobicContact CB-CE2 4.28Å; V401-F466 HydrophobicContact CB-CG 3.75Å; V401-F466 HydrophobicContact CB-CZ 4.37Å; V401-F466 HydrophobicContact CG1-CD2 4.31Å; V401-F466 HydrophobicContact CG1-CE2 4.37Å; V401-F466 HydrophobicContact CG2-CD1 3.75Å; V401-F466 HydrophobicContact CG2-CE1 3.73Å; V401-F466 HydrophobicContact CG2-CG 4.23Å; V401-F466 HydrophobicContact CG2-CZ 4.21Å; V401-F466 WeakPolarHBondContact O-CB 3.19Å; F402-F466 HydrophobicContact CD1-CD1 4.29Å; F402-F466 AromaticContact CE1-CD1 3.76Å; F402-F466 HydrophobicContact CE1-CD1 3.76Å; F402-F466 HydrophobicContact CE1-CE1 4.05Å; F402-F466 HydrophobicContact CZ-CD1 4.29Å; F402-F466 HydrophobicContact CZ-CE1 4.14Å; V408-F466 HydrophobicContact CB-CB 4.43Å; V408-F466 PolarHBondContact N-O 2.99Å; V408-F466 PolarHBondContact O-N 3.02Å; V410-F466 HydrophobicContact CB-CE2 4.38Å; V410-F466 HydrophobicContact CG2-CD2 4.03Å; V410-F466 HydrophobicContact CG2-CE2 3.97Å; F412-F466 HydrophobicContact CE2-CE2 4.3Å; F412-F466 AromaticContact CZ-CE2 3.86Å; F412-F466 HydrophobicContact CZ-CE2 3.86Å; F412-F466 HydrophobicContact CZ-CZ 4.02Å; Y456-F466 HydrophobicContact CD1-CE1 4.24Å; Y456-F466 HydrophobicContact CD1-CZ 4.31Å; Y456-F466 HydrophobicContact CD2-CE1 4.49Å; Y456-F466 HydrophobicContact CE1-CE1 4.04Å; Y456-F466 HydrophobicContact CE2-CE1 4.3Å; Y456-F466 HydrophobicContact CG-CE1 4.47Å; Y456-F466 HydrophobicContact CG-CZ 4.35Å; R464-F466 HydrophobicContact CB-CD2 4.47Å; R464-F466 HydrophobicContact CB-CE2 3.9Å; R464-F466 HydrophobicContact CB-CZ 4.49Å; F466-A473 HydrophobicContact CD1-CB 3.63Å; F466-A473 HydrophobicContact CD2-CB 4.38Å; F466-A473 HydrophobicContact CE1-CB 3.46Å; F466-A473 VanDerWaalsContact CE1-CB 3.46Å; F466-A473 HydrophobicContact CE2-CB 4.22Å; F466-A473 HydrophobicContact CG-CB 4.08Å; F466-A473 HydrophobicContact CZ-CB 3.76Å
467	P	90.3	Very high	85.9	Confident	26 Å²	26	55.4 Å²	55.4	17%	0.169	27%	0.269	C	S	.	.			trans	-72.1	152.6	-175.5	-16.2	30.3	0	0	0	112.5	L465 D469 S470 V474	L465-P467 HydrophobicContact CD2-CG 4.46Å; L465-P467 HydrophobicContact CG-CG 4.29Å; P467-D469 PolarHBondContact O-N 3.01Å; P467-S470 PolarHBondContact O-N 3.17Å; P467-S470 VanDerWaalsContact O-N 3.13Å; P467-V474 HydrophobicContact CG-CG2 4.18Å
468	T	86.2	Confident	87.1	Confident	18 Å²	18	55.3 Å²	55.3	11%	0.11	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-42.4	134.2	164.4	-56.5	0	0	0	0	110.5	K404 K406 D407 S470 R496	K404-T468 WeakPolarHBondContact O-CG2 3.21Å; K406-T468 PolarHBondContact O-N 3.21Å; D407-T468 WeakPolarHBondContact OD1-CB 3.25Å; D407-T468 PolarHBondContact OD1-N 2.72Å; D407-T468 PolarHBondContact OD1-OG1 2.82Å; D407-T468 PolarHBondContact OD2-OG1 3.43Å; T468-S470 PolarHBondContact O-N 3.4Å; T468-R496 VanDerWaalsContact CB-NH1 3.31Å; T468-R496 PolarHBondContact OG1-NH1 3.46Å
469	D	78.1	Confident	87.9	Confident	109 Å²	109	59.6 Å²	59.6	58%	0.583	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.2	7.9	-177.5	-93.3	-49.5	0	0	0	118.8	K404 P467	K404-D469 WeakPolarHBondContact CG-OD1 3.25Å; K404-D469 IonicContact NZ-OD1 2.78Å; K404-D469 PolarHBondContact NZ-OD1 3.44Å; K404-D469 PolarHBondContact O-N 3.39Å; P467-D469 PolarHBondContact O-N 3.01Å
470	S	77.4	Confident	88.7	Confident	46 Å²	46	57.1 Å²	57.1	32%	0.322	29%	0.29	S	S	.	.			trans	-108.1	132.2	177.4	-176.6	0	0	0	0	113.3	P467 T468 Q472	P467-S470 PolarHBondContact O-N 3.17Å; P467-S470 VanDerWaalsContact O-N 3.13Å; T468-S470 PolarHBondContact O-N 3.4Å; S470-Q472 VanDerWaalsContact C-N 3.28Å; S470-Q472 PolarHBondContact OG-N 3.34Å; S470-Q472 VanDerWaalsContact OG-N 3.13Å
471	Q	70.7	Confident	89.3	Confident	168 Å²	168	57 Å²	57	79%	0.785	30%	0.295	S	S	*	.	S	Bend	trans	-81.9	-6.5	170.2	-62.9	-171.2	2.1	0	0	113
472	Q	80.9	Confident	89.5	Confident	157 Å²	157	59.1 Å²	59.1	73%	0.734	31%	0.306	S	S	*	.	S	Bend	trans	-99.1	102.7	-174.7	-173.3	168.3	-9.1	0	0	112	S470 V474	S470-Q472 VanDerWaalsContact C-N 3.28Å; S470-Q472 PolarHBondContact OG-N 3.34Å; S470-Q472 VanDerWaalsContact OG-N 3.13Å; Q472-V474 PolarHBondContact O-N 2.9Å
473	A	88.1	Confident	89.6	Confident	13 Å²	13	65.4 Å²	65.4	11%	0.107	33%	0.333	C	S	.	.	P	Polyproline II helix	trans	-70.6	122.5	178.9	0	0	0	0	0	112.7	Y456 R464 L465 F466	Y456-A473 HydrophobicContact CD1-CB 3.76Å; Y456-A473 HydrophobicContact CE1-CB 3.52Å; R464-A473 HydrophobicContact CB-CB 4.43Å; L465-A473 CarbonylContact O-C 3.58Å; L465-A473 VanDerWaalsContact O-CA 3.32Å; L465-A473 WeakPolarHBondContact O-CA 3.33Å; F466-A473 HydrophobicContact CD1-CB 3.63Å; F466-A473 HydrophobicContact CD2-CB 4.38Å; F466-A473 HydrophobicContact CE1-CB 3.46Å; F466-A473 VanDerWaalsContact CE1-CB 3.46Å; F466-A473 HydrophobicContact CE2-CB 4.22Å; F466-A473 HydrophobicContact CG-CB 4.08Å; F466-A473 HydrophobicContact CZ-CB 3.76Å
474	V	90.9	Very high	89.6	Confident	45 Å²	45	66 Å²	66	27%	0.273	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	124.9	178.4	-173.4	0	0	0	0	109.9	R464 L465 P467 Q472 F488	R464-V474 CarbonylContact C-O 3.6Å; R464-V474 VanDerWaalsContact CA-O 3.22Å; R464-V474 WeakPolarHBondContact CA-O 3.25Å; R464-V474 WeakPolarHBondContact CB-O 3.32Å; L465-V474 HydrophobicContact CB-CB 4.45Å; L465-V474 PolarHBondContact N-O 3.13Å; L465-V474 PolarHBondContact O-N 2.6Å; P467-V474 HydrophobicContact CG-CG2 4.18Å; Q472-V474 PolarHBondContact O-N 2.9Å; V474-F488 HydrophobicContact CG1-CE2 4.33Å; V474-F488 HydrophobicContact CG1-CZ 4.12Å
475	L	90.8	Very high	89.8	Confident	48 Å²	48	64.8 Å²	64.8	25%	0.251	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	124.7	175.6	179.9	65.2	0	0	0	110.8	F462 R464 K477	F462-L475 HydrophobicContact CD2-CD1 4.39Å; R464-L475 HydrophobicContact CG-CD1 4.13Å; L475-K477 HydrophobicContact CG-CG 4.4Å
476	Y	94.1	Very high	89.8	Confident	16 Å²	16	65.1 Å²	65.1	6%	0.063	34%	0.338	C	S	.	.	P	Polyproline II helix	trans	-71.6	128.3	173	-173.6	-102.4	0	0	0	111.1	F409 F463 G478 E479 G484 F485 F488	F409-Y476 HydrophobicContact CE2-CD2 4.34Å; F409-Y476 HydrophobicContact CE2-CG 4.4Å; F409-Y476 HydrophobicContact CZ-CD2 4.48Å; F409-Y476 HydrophobicContact CZ-CG 4.39Å; F463-Y476 HydrophobicContact CB-CG 4.44Å; F463-Y476 HydrophobicContact CD2-CD1 4.47Å; F463-Y476 WeakPolarHBondContact O-CB 3.39Å; F463-Y476 PolarHBondContact O-N 2.71Å; Y476-G478 VanDerWaalsContact CE1-C 3.41Å; Y476-G478 VanDerWaalsContact CE1-O 3.22Å; Y476-G478 WeakPolarHBondContact CE1-O 3.26Å; Y476-G478 VanDerWaalsContact CZ-CA 3.46Å; Y476-G478 WeakPolarHBondContact OH-CA 3.35Å; Y476-E479 PolarHBondContact OH-N 3.29Å; Y476-E479 PolarHBondContact OH-O 3.26Å; Y476-G484 WeakPolarHBondContact CE2-O 3.48Å; Y476-G484 WeakPolarHBondContact OH-CA 3.46Å; Y476-G484 PolarHBondContact OH-O 3.27Å; Y476-F485 HydrophobicContact CD1-CD1 4.19Å; Y476-F485 AromaticContact CD1-CE1 3.86Å; Y476-F485 HydrophobicContact CD1-CE1 3.86Å; Y476-F485 AromaticContact CE1-CD1 3.69Å; Y476-F485 HydrophobicContact CE1-CD1 3.69Å; Y476-F485 AromaticContact CE1-CE1 3.51Å; Y476-F485 HydrophobicContact CE1-CE1 3.51Å; Y476-F485 HydrophobicContact CE2-CD1 4.1Å; Y476-F485 AromaticContact CZ-CD1 3.65Å; Y476-F485 AromaticContact CZ-CE1 3.98Å; Y476-F488 HydrophobicContact CD2-CB 4.18Å; Y476-F488 AromaticContact CD2-CD1 3.53Å; Y476-F488 HydrophobicContact CD2-CD1 3.53Å; Y476-F488 AromaticContact CD2-CD2 3.84Å; Y476-F488 HydrophobicContact CD2-CD2 3.84Å; Y476-F488 AromaticContact CD2-CE1 3.74Å; Y476-F488 HydrophobicContact CD2-CE1 3.74Å; Y476-F488 HydrophobicContact CD2-CE2 4.03Å; Y476-F488 AromaticContact CD2-CG 3.58Å; Y476-F488 HydrophobicContact CD2-CG 3.58Å; Y476-F488 AromaticContact CD2-CZ 3.99Å; Y476-F488 HydrophobicContact CD2-CZ 3.99Å; Y476-F488 HydrophobicContact CE2-CB 3.63Å; Y476-F488 AromaticContact CE2-CD1 3.85Å; Y476-F488 HydrophobicContact CE2-CD1 3.85Å; Y476-F488 HydrophobicContact CE2-CD2 4.02Å; Y476-F488 HydrophobicContact CE2-CE1 4.5Å; Y476-F488 AromaticContact CE2-CG 3.57Å; Y476-F488 HydrophobicContact CE2-CG 3.57Å
477	K	91.9	Very high	89.9	Confident	180 Å²	180	68.5 Å²	68.5	78%	0.783	36%	0.355	S	S	*	.			trans	-125	5.9	-179.7	-63.1	-179.4	-178	175.7	0	114	L475	L475-K477 HydrophobicContact CG-CG 4.4Å
478	G	92.3	Very high	90.2	Very high	38 Å²	38	68.8 Å²	68.8	39%	0.392	35%	0.354	S	S	.	.	S	Bend	trans	-83.5	-174.7	-178.7	0	0	0	0	0	113.7	Y476	Y476-G478 VanDerWaalsContact CE1-C 3.41Å; Y476-G478 VanDerWaalsContact CE1-O 3.22Å; Y476-G478 WeakPolarHBondContact CE1-O 3.26Å; Y476-G478 VanDerWaalsContact CZ-CA 3.46Å; Y476-G478 WeakPolarHBondContact OH-CA 3.35Å
479	E	93.1	Very high	90.6	Very high	147 Å²	147	68 Å²	68	69%	0.687	35%	0.35	S	S	*	.			trans	-71.3	135.7	176.4	-60.7	-170.7	158	0	0	111.9	Y476 T481	Y476-E479 PolarHBondContact OH-N 3.29Å; Y476-E479 PolarHBondContact OH-O 3.26Å; E479-T481 HydrophobicContact CB-CG2 4.22Å; E479-T481 PolarHBondContact O-N 3.39Å
480	H	95.3	Very high	91.3	Very high	77 Å²	77	66.3 Å²	66.3	36%	0.356	34%	0.338	S	S	.	.	S	Bend	trans	-74.1	67	177.8	-63.8	-174.3	0	0	0	111.8	L423 L426 F463 F485	L423-H480 HydrophobicContact CD1-CB 4.47Å; L423-H480 WeakPolarHBondContact CD1-ND1 3.41Å; L423-H480 HydrophobicContact CD2-CB 3.83Å; L426-H480 VanDerWaalsContact CD2-O 3.27Å; L426-H480 WeakPolarHBondContact CD2-O 3.09Å; F463-H480 AromaticContact CE2-CE1 3.75Å; F463-H480 AromaticContact CE2-ND1 3.94Å; F463-H480 AromaticContact CE2-NE2 3.87Å; H480-F485 HydrophobicContact CB-CZ 4.12Å
481	T	95.5	Very high	91.9	Very high	53 Å²	53	66.6 Å²	66.6	33%	0.325	34%	0.34	S	S	.	.	S	Bend	trans	-131.1	158.1	178.9	69.2	0	0	0	0	110.4	E479 K483 G484 F485	E479-T481 HydrophobicContact CB-CG2 4.22Å; E479-T481 PolarHBondContact O-N 3.39Å; T481-K483 PolarHBondContact O-N 2.64Å; T481-G484 PolarHBondContact O-N 2.88Å; T481-G484 VanDerWaalsContact O-N 3.11Å; T481-G484 PolarHBondContact OG1-N 3.13Å; T481-F485 VanDerWaalsContact O-CD2 3.31Å; T481-F485 WeakPolarHBondContact O-CD2 3.49Å; T481-F485 WeakPolarHBondContact O-CG 3.35Å; T481-F485 PolarHBondContact O-N 3.47Å
482	L	94.2	Very high	92.6	Very high	59 Å²	59	61.8 Å²	61.8	31%	0.309	32%	0.317	S	S	.	.	H	α-helix	trans	-59.7	-36.7	-179.3	-171.2	68.3	0	0	0	111.2	L426 E429 L430 S486	L426-L482 HydrophobicContact CD1-CB 3.79Å; E429-L482 HydrophobicContact CB-CD1 3.99Å; L430-L482 HydrophobicContact CB-CD1 4.07Å; L430-L482 HydrophobicContact CD1-CD1 4.01Å; L482-S486 VanDerWaalsContact O-CB 3.26Å; L482-S486 WeakPolarHBondContact O-CB 3.43Å; L482-S486 PolarHBondContact O-N 3.41Å; L482-S486 PolarHBondContact O-OG 3.16Å
483	K	95	Very high	92.7	Very high	141 Å²	141	55.9 Å²	55.9	61%	0.613	29%	0.291	S	S	*	.	H	α-helix	trans	-66.3	-52.3	172.1	-170.9	179.9	-173.5	-91.9	0	111.2	T481 F485 S486 D487	T481-K483 PolarHBondContact O-N 2.64Å; K483-F485 PolarHBondContact O-N 3.46Å; K483-S486 WeakPolarHBondContact O-CA 3.28Å; K483-S486 WeakPolarHBondContact O-CB 3.05Å; K483-S486 PolarHBondContact O-N 2.65Å; K483-D487 WeakPolarHBondContact CE-OD2 3.37Å; K483-D487 VanDerWaalsContact CG-OD1 3.28Å; K483-D487 WeakPolarHBondContact CG-OD1 3.48Å; K483-D487 WeakPolarHBondContact CG-OD2 3.49Å; K483-D487 IonicContact NZ-OD1 2.7Å; K483-D487 IonicContact NZ-OD2 3.96Å; K483-D487 PolarHBondContact NZ-OD2 3.46Å; K483-D487 WeakPolarHBondContact O-CB 3.48Å; K483-D487 VanDerWaalsContact O-CG 3.28Å; K483-D487 PolarHBondContact O-N 3.36Å
484	G	95.9	Very high	92.4	Very high	14 Å²	14	60.9 Å²	60.9	14%	0.144	31%	0.31	C	S	.	.	H	α-helix	trans	-57	-35.7	-179	0	0	0	0	0	113.7	Y476 T481 F488	Y476-G484 WeakPolarHBondContact CE2-O 3.48Å; Y476-G484 WeakPolarHBondContact OH-CA 3.46Å; Y476-G484 PolarHBondContact OH-O 3.27Å; T481-G484 PolarHBondContact O-N 2.88Å; T481-G484 VanDerWaalsContact O-N 3.11Å; T481-G484 PolarHBondContact OG1-N 3.13Å; G484-F488 WeakPolarHBondContact O-CB 3.27Å
485	F	97.1	Very high	91.6	Very high	1 Å²	1	62 Å²	62	0%	0.004	32%	0.317	C	S	.	.	H	α-helix	trans	-74.6	-41.1	172.1	-61.4	-42.7	0	0	0	112.5	F409 L426 L430 F463 Y476 H480 T481 K483 L489	F409-F485 AromaticContact CE1-CD1 3.99Å; F409-F485 HydrophobicContact CE1-CD1 3.99Å; F409-F485 HydrophobicContact CE1-CE1 4.36Å; F409-F485 HydrophobicContact CE1-CG 4.28Å; F409-F485 AromaticContact CZ-CD1 3.68Å; F409-F485 HydrophobicContact CZ-CD1 3.68Å; F409-F485 HydrophobicContact CZ-CE1 4.05Å; F409-F485 HydrophobicContact CZ-CG 4.37Å; L426-F485 HydrophobicContact CD2-CD2 4.31Å; L426-F485 HydrophobicContact CD2-CE2 3.68Å; L426-F485 HydrophobicContact CG-CD2 4.48Å; L426-F485 HydrophobicContact CG-CE2 4.14Å; L430-F485 HydrophobicContact CD1-CB 3.73Å; L430-F485 HydrophobicContact CD2-CB 3.79Å; L430-F485 HydrophobicContact CD2-CD2 4.1Å; L430-F485 HydrophobicContact CD2-CG 4.12Å; L430-F485 HydrophobicContact CG-CB 4.43Å; F463-F485 HydrophobicContact CD1-CE1 4.34Å; F463-F485 HydrophobicContact CD1-CZ 4.37Å; F463-F485 AromaticContact CD2-CE1 3.99Å; F463-F485 HydrophobicContact CD2-CE1 3.99Å; F463-F485 HydrophobicContact CD2-CZ 4.17Å; F463-F485 HydrophobicContact CE1-CE1 4.31Å; F463-F485 AromaticContact CE1-CZ 3.88Å; F463-F485 HydrophobicContact CE1-CZ 3.88Å; F463-F485 AromaticContact CE2-CE1 3.99Å; F463-F485 HydrophobicContact CE2-CE1 3.99Å; F463-F485 AromaticContact CE2-CZ 3.7Å; F463-F485 HydrophobicContact CE2-CZ 3.7Å; F463-F485 HydrophobicContact CG-CE1 4.19Å; F463-F485 HydrophobicContact CZ-CE1 4.16Å; F463-F485 HydrophobicContact CZ-CE2 4.37Å; F463-F485 AromaticContact CZ-CZ 3.54Å; F463-F485 HydrophobicContact CZ-CZ 3.54Å; Y476-F485 HydrophobicContact CD1-CD1 4.19Å; Y476-F485 AromaticContact CD1-CE1 3.86Å; Y476-F485 HydrophobicContact CD1-CE1 3.86Å; Y476-F485 AromaticContact CE1-CD1 3.69Å; Y476-F485 HydrophobicContact CE1-CD1 3.69Å; Y476-F485 AromaticContact CE1-CE1 3.51Å; Y476-F485 HydrophobicContact CE1-CE1 3.51Å; Y476-F485 HydrophobicContact CE2-CD1 4.1Å; Y476-F485 AromaticContact CZ-CD1 3.65Å; Y476-F485 AromaticContact CZ-CE1 3.98Å; H480-F485 HydrophobicContact CB-CZ 4.12Å; T481-F485 VanDerWaalsContact O-CD2 3.31Å; T481-F485 WeakPolarHBondContact O-CD2 3.49Å; T481-F485 WeakPolarHBondContact O-CG 3.35Å; T481-F485 PolarHBondContact O-N 3.47Å; K483-F485 PolarHBondContact O-N 3.46Å; F485-L489 WeakPolarHBondContact O-CG 3.39Å; F485-L489 PolarHBondContact O-N 3Å; F485-L489 VanDerWaalsContact O-N 3.12Å
486	S	95.8	Very high	90.7	Very high	10 Å²	10	62.9 Å²	62.9	7%	0.07	32%	0.317	C	S	.	.	H	α-helix	trans	-60.3	-54.6	177.6	-67.4	0	0	0	0	112.6	K433 L482 K483 F488 L489 E490	K433-S486 PolarHBondContact NZ-OG 2.91Å; L482-S486 VanDerWaalsContact O-CB 3.26Å; L482-S486 WeakPolarHBondContact O-CB 3.43Å; L482-S486 PolarHBondContact O-N 3.41Å; L482-S486 PolarHBondContact O-OG 3.16Å; K483-S486 WeakPolarHBondContact O-CA 3.28Å; K483-S486 WeakPolarHBondContact O-CB 3.05Å; K483-S486 PolarHBondContact O-N 2.65Å; S486-F488 PolarHBondContact O-N 2.92Å; S486-L489 PolarHBondContact O-N 3.41Å; S486-E490 WeakPolarHBondContact O-CB 3.41Å; S486-E490 WeakPolarHBondContact O-CG 3.4Å; S486-E490 PolarHBondContact O-N 2.66Å
487	D	95.3	Very high	89.6	Confident	72 Å²	72	65.9 Å²	65.9	39%	0.385	33%	0.333	S	S	.	.	H	α-helix	trans	-56.6	-36.9	-176.5	-66.5	5.8	0	0	0	111.2	K483 S491	K483-D487 WeakPolarHBondContact CE-OD2 3.37Å; K483-D487 VanDerWaalsContact CG-OD1 3.28Å; K483-D487 WeakPolarHBondContact CG-OD1 3.48Å; K483-D487 WeakPolarHBondContact CG-OD2 3.49Å; K483-D487 IonicContact NZ-OD1 2.7Å; K483-D487 IonicContact NZ-OD2 3.96Å; K483-D487 PolarHBondContact NZ-OD2 3.46Å; K483-D487 WeakPolarHBondContact O-CB 3.48Å; K483-D487 VanDerWaalsContact O-CG 3.28Å; K483-D487 PolarHBondContact O-N 3.36Å; D487-S491 VanDerWaalsContact O-CB 3.31Å; D487-S491 WeakPolarHBondContact O-CB 3.06Å; D487-S491 PolarHBondContact O-N 2.63Å; D487-S491 PolarHBondContact O-OG 2.73Å
488	F	95.6	Very high	88.6	Confident	32 Å²	32	62.8 Å²	62.8	14%	0.14	32%	0.321	C	S	.	.	H	α-helix	trans	-74.8	-40.4	179.1	169.4	-95.4	0	0	0	113.9	F409 L465 V474 Y476 G484 S486 S491 H492	F409-F488 HydrophobicContact CD2-CE1 4.28Å; F409-F488 HydrophobicContact CE2-CD1 4.23Å; F409-F488 AromaticContact CE2-CE1 3.93Å; F409-F488 HydrophobicContact CE2-CE1 3.93Å; L465-F488 HydrophobicContact CB-CE1 3.95Å; L465-F488 HydrophobicContact CB-CZ 4.21Å; L465-F488 HydrophobicContact CD2-CE1 4.22Å; L465-F488 HydrophobicContact CD2-CZ 4.49Å; V474-F488 HydrophobicContact CG1-CE2 4.33Å; V474-F488 HydrophobicContact CG1-CZ 4.12Å; Y476-F488 HydrophobicContact CD2-CB 4.18Å; Y476-F488 AromaticContact CD2-CD1 3.53Å; Y476-F488 HydrophobicContact CD2-CD1 3.53Å; Y476-F488 AromaticContact CD2-CD2 3.84Å; Y476-F488 HydrophobicContact CD2-CD2 3.84Å; Y476-F488 AromaticContact CD2-CE1 3.74Å; Y476-F488 HydrophobicContact CD2-CE1 3.74Å; Y476-F488 HydrophobicContact CD2-CE2 4.03Å; Y476-F488 AromaticContact CD2-CG 3.58Å; Y476-F488 HydrophobicContact CD2-CG 3.58Å; Y476-F488 AromaticContact CD2-CZ 3.99Å; Y476-F488 HydrophobicContact CD2-CZ 3.99Å; Y476-F488 HydrophobicContact CE2-CB 3.63Å; Y476-F488 AromaticContact CE2-CD1 3.85Å; Y476-F488 HydrophobicContact CE2-CD1 3.85Å; Y476-F488 HydrophobicContact CE2-CD2 4.02Å; Y476-F488 HydrophobicContact CE2-CE1 4.5Å; Y476-F488 AromaticContact CE2-CG 3.57Å; Y476-F488 HydrophobicContact CE2-CG 3.57Å; G484-F488 WeakPolarHBondContact O-CB 3.27Å; S486-F488 PolarHBondContact O-N 2.92Å; F488-S491 WeakPolarHBondContact CA-OG 3.45Å; F488-S491 PolarHBondContact O-OG 3.12Å; F488-H492 AromaticContact CD2-CD2 3.77Å; F488-H492 AromaticContact CD2-NE2 3.99Å; F488-H492 AromaticContact CE2-CD2 3.39Å; F488-H492 WeakPolarHBondContact CE2-CD2 3.31Å; F488-H492 AromaticContact CE2-NE2 3.27Å; F488-H492 VanDerWaalsContact CE2-NE2 3.27Å; F488-H492 WeakPolarHBondContact CE2-NE2 3.36Å; F488-H492 AromaticContact CZ-CD2 3.51Å; F488-H492 AromaticContact CZ-NE2 3.59Å; F488-H492 PolarHBondContact O-CD2 3.1Å; F488-H492 PolarHBondContact O-N 3.18Å; F488-H492 VanDerWaalsContact O-N 3.1Å
489	L	94.4	Very high	87.4	Confident	3 Å²	3	65.4 Å²	65.4	2%	0.016	33%	0.327	C	S	.	.	H	α-helix	trans	-68	-41.4	174.9	-68.7	172	0	0	0	110.6	F409 L430 Y434 I440 I442 L465 F485 S486 H492 I493	F409-L489 HydrophobicContact CB-CD2 3.95Å; F409-L489 HydrophobicContact CD2-CD2 3.97Å; F409-L489 HydrophobicContact CG-CD2 4.04Å; L430-L489 HydrophobicContact CD1-CD1 4.44Å; L430-L489 HydrophobicContact CD2-CD1 4.37Å; Y434-L489 HydrophobicContact CD2-CD1 4.19Å; Y434-L489 HydrophobicContact CE2-CD1 3.79Å; I440-L489 HydrophobicContact CD1-CB 4.09Å; I440-L489 HydrophobicContact CD1-CD1 4.48Å; I442-L489 HydrophobicContact CD1-CD1 4.04Å; L465-L489 HydrophobicContact CD1-CD2 4.04Å; F485-L489 WeakPolarHBondContact O-CG 3.39Å; F485-L489 PolarHBondContact O-N 3Å; F485-L489 VanDerWaalsContact O-N 3.12Å; S486-L489 PolarHBondContact O-N 3.41Å; L489-H492 PolarHBondContact O-N 3.2Å; L489-I493 PolarHBondContact O-N 3.21Å; L489-I493 VanDerWaalsContact O-N 3.16Å
490	E	92.2	Very high	86	Confident	73 Å²	73	62.9 Å²	62.9	34%	0.341	32%	0.315	S	S	.	.	H	α-helix	trans	-70.2	-32.6	177.7	-71.1	171.3	-148	0	0	112.7	K433 Y434 S486 K494	K433-E490 IonicContact NZ-OE1 3.76Å; K433-E490 PolarHBondContact NZ-OE1 3.01Å; Y434-E490 PolarHBondContact OH-OE1 3.1Å; S486-E490 WeakPolarHBondContact O-CB 3.41Å; S486-E490 WeakPolarHBondContact O-CG 3.4Å; S486-E490 PolarHBondContact O-N 2.66Å; E490-K494 VanDerWaalsContact O-CG 3.28Å; E490-K494 WeakPolarHBondContact O-CG 3.28Å; E490-K494 VanDerWaalsContact O-N 3.17Å; E490-K494 PolarHBondContact O-N 3.22Å
491	S	90.1	Very high	84.5	Confident	52 Å²	52	63.5 Å²	63.5	36%	0.364	32%	0.32	S	S	.	.	H	α-helix	trans	-69.2	-43.6	172.5	64.6	0	0	0	0	112.1	D487 F488 I493 K494 T495	D487-S491 VanDerWaalsContact O-CB 3.31Å; D487-S491 WeakPolarHBondContact O-CB 3.06Å; D487-S491 PolarHBondContact O-N 2.63Å; D487-S491 PolarHBondContact O-OG 2.73Å; F488-S491 WeakPolarHBondContact CA-OG 3.45Å; F488-S491 PolarHBondContact O-OG 3.12Å; S491-I493 PolarHBondContact O-N 3.04Å; S491-I493 VanDerWaalsContact C-N 3.31Å; S491-K494 PolarHBondContact O-N 3.17Å; S491-T495 PolarHBondContact O-N 3.45Å; S491-T495 PolarHBondContact O-OG1 3.3Å
492	H	86.5	Confident	82.7	Confident	67 Å²	67	67.4 Å²	67.4	31%	0.31	34%	0.335	S	S	.	.	H	α-helix	trans	-65.5	-32.2	180	-91.3	-64.1	0	0	0	113.3	L465 F488 L489 R496	L465-H492 HydrophobicContact CD2-CB 3.79Å; F488-H492 AromaticContact CD2-CD2 3.77Å; F488-H492 AromaticContact CD2-NE2 3.99Å; F488-H492 AromaticContact CE2-CD2 3.39Å; F488-H492 WeakPolarHBondContact CE2-CD2 3.31Å; F488-H492 AromaticContact CE2-NE2 3.27Å; F488-H492 VanDerWaalsContact CE2-NE2 3.27Å; F488-H492 WeakPolarHBondContact CE2-NE2 3.36Å; F488-H492 AromaticContact CZ-CD2 3.51Å; F488-H492 AromaticContact CZ-NE2 3.59Å; F488-H492 PolarHBondContact O-CD2 3.1Å; F488-H492 PolarHBondContact O-N 3.18Å; F488-H492 VanDerWaalsContact O-N 3.1Å; L489-H492 PolarHBondContact O-N 3.2Å; H492-R496 PolarHBondContact O-N 2.7Å
493	I	83.7	Confident	81	Confident	33 Å²	33	70.2 Å²	70.2	17%	0.169	35%	0.35	C	S	.	.	H	α-helix	trans	-71	-43.2	172.4	-72	171.8	0	0	0	111.3	I440 L489 S491 R496 I497	I440-I493 HydrophobicContact CD1-CD1 3.55Å; I440-I493 HydrophobicContact CG1-CD1 3.82Å; L489-I493 PolarHBondContact O-N 3.21Å; L489-I493 VanDerWaalsContact O-N 3.16Å; S491-I493 PolarHBondContact O-N 3.04Å; S491-I493 VanDerWaalsContact C-N 3.31Å; I493-R496 PolarHBondContact O-N 3.29Å; I493-I497 WeakPolarHBondContact O-CG1 3.39Å; I493-I497 PolarHBondContact O-N 3.36Å; I493-I497 HydrophobicContact CG2-CG1 4.48Å; I493-I497 HydrophobicContact CG2-CD1 3.76Å
494	K	79.7	Confident	79.3	Confident	118 Å²	118	69.8 Å²	69.8	51%	0.513	35%	0.351	S	S	.	.	H	α-helix	trans	-62	-50.4	-179.6	-77.1	170.6	-176.9	172.9	0	112.3	E490 S491 R496 I497 E498	E490-K494 VanDerWaalsContact O-CG 3.28Å; E490-K494 WeakPolarHBondContact O-CG 3.28Å; E490-K494 VanDerWaalsContact O-N 3.17Å; E490-K494 PolarHBondContact O-N 3.22Å; S491-K494 PolarHBondContact O-N 3.17Å; K494-R496 PolarHBondContact O-N 3.39Å; K494-I497 PolarHBondContact O-N 2.86Å; K494-E498 VanDerWaalsContact O-CG 3.31Å; K494-E498 WeakPolarHBondContact O-CG 3.23Å; K494-E498 PolarHBondContact O-N 3.27Å
495	T	75.4	Confident	77.5	Confident	67 Å²	67	74.5 Å²	74.5	41%	0.411	37%	0.372	S	S	.	.	H	α-helix	trans	-58.3	-38.5	177.4	-56	0	0	0	0	111.2	S491 I497 E498 D499	S491-T495 PolarHBondContact O-N 3.45Å; S491-T495 PolarHBondContact O-OG1 3.3Å; T495-I497 PolarHBondContact O-N 3.45Å; T495-E498 PolarHBondContact O-N 3.01Å; T495-D499 VanDerWaalsContact O-OD2 3.13Å; T495-D499 PolarHBondContact O-N 2.95Å; T495-D499 WeakPolarHBondContact O-CB 3.29Å
496	R	71.7	Confident	75.5	Confident	67 Å²	67	78.7 Å²	78.7	25%	0.253	39%	0.394	S	S	.	.	H	α-helix	trans	-67	-33.5	176.8	-147.9	-163.2	89.6	-154.7	6.5	113.7	D407 T468 H492 I493 K494 E500	D407-R496 IonicContact OD2-NH1 2.76Å; T468-R496 VanDerWaalsContact CB-NH1 3.31Å; T468-R496 PolarHBondContact OG1-NH1 3.46Å; H492-R496 PolarHBondContact O-N 2.7Å; I493-R496 PolarHBondContact O-N 3.29Å; K494-R496 PolarHBondContact O-N 3.39Å; R496-E500 IonicContact NE-OE1 2.73Å; R496-E500 PolarHBondContact O-N 3.01Å; R496-E500 WeakPolarHBondContact O-CG 3.45Å; R496-E500 VanDerWaalsContact O-CG 3.23Å; R496-E500 WeakPolarHBondContact O-CB 3.37Å; R496-E500 VanDerWaalsContact O-CB 3.29Å; R496-E500 PolarHBondContact NH2-OE2 3.29Å; R496-E500 IonicContact NH2-OE2 3.28Å; R496-E500 PolarHBondContact NH2-OE1 2.79Å; R496-E500 IonicContact NH2-OE1 2.99Å; R496-E500 PolarHBondContact NE-OE1 3.26Å; R496-E500 IonicContact CZ-OE1 3.96Å
497	I	71.9	Confident	73.4	Confident	80 Å²	80	80.7 Å²	80.7	41%	0.41	41%	0.408	S	S	.	.	H	α-helix	trans	-72.5	-41	174	-65.9	165.6	0	0	0	110	I493 K494 T495 E500 D501	I493-I497 WeakPolarHBondContact O-CG1 3.39Å; I493-I497 PolarHBondContact O-N 3.36Å; I493-I497 HydrophobicContact CG2-CG1 4.48Å; I493-I497 HydrophobicContact CG2-CD1 3.76Å; K494-I497 PolarHBondContact O-N 2.86Å; T495-I497 PolarHBondContact O-N 3.45Å; I497-E500 PolarHBondContact O-N 3.05Å; I497-D501 WeakPolarHBondContact O-CB 3.34Å; I497-D501 PolarHBondContact O-N 2.97Å
498	E	70.1	Confident	71.5	Confident	114 Å²	114	80.7 Å²	80.7	53%	0.533	41%	0.41	S	S	.	.	H	α-helix	trans	-63	-40.9	175.4	-68.4	158.7	-179.5	0	0	111.1	K494 T495 E502	K494-E498 VanDerWaalsContact O-CG 3.31Å; K494-E498 WeakPolarHBondContact O-CG 3.23Å; K494-E498 PolarHBondContact O-N 3.27Å; T495-E498 PolarHBondContact O-N 3.01Å; E498-E502 PolarHBondContact O-N 3.3Å
499	D	66.1	Low	69.5	Low	94 Å²	94	85.5 Å²	85.5	50%	0.503	43%	0.433	S	S	.	.	H	α-helix	trans	-65.3	-43.8	172.6	-64.1	-33	0	0	0	111.6	T495 E502 D503	T495-D499 VanDerWaalsContact O-OD2 3.13Å; T495-D499 PolarHBondContact O-N 2.95Å; T495-D499 WeakPolarHBondContact O-CB 3.29Å; D499-E502 PolarHBondContact O-N 3.46Å; D499-D503 PolarHBondContact O-N 3.06Å
500	E	63.6	Low	67.3	Low	93 Å²	93	91.9 Å²	91.9	44%	0.435	46%	0.463	S	S	.	.	H	α-helix	trans	-66.2	-40.6	177.6	-80.6	169.5	-167.5	0	0	112.4	R496 I497 E504	R496-E500 IonicContact NE-OE1 2.73Å; R496-E500 PolarHBondContact O-N 3.01Å; R496-E500 WeakPolarHBondContact O-CG 3.45Å; R496-E500 VanDerWaalsContact O-CG 3.23Å; R496-E500 WeakPolarHBondContact O-CB 3.37Å; R496-E500 VanDerWaalsContact O-CB 3.29Å; R496-E500 PolarHBondContact NH2-OE2 3.29Å; R496-E500 IonicContact NH2-OE2 3.28Å; R496-E500 PolarHBondContact NH2-OE1 2.79Å; R496-E500 IonicContact NH2-OE1 2.99Å; R496-E500 PolarHBondContact NE-OE1 3.26Å; R496-E500 IonicContact CZ-OE1 3.96Å; I497-E500 PolarHBondContact O-N 3.05Å; E500-E504 WeakPolarHBondContact O-CB 3.31Å; E500-E504 PolarHBondContact O-N 2.82Å
501	D	64.1	Low	65.2	Low	90 Å²	90	93 Å²	93	48%	0.481	47%	0.472	S	S	.	.	H	α-helix	trans	-65.4	-40.8	175.1	-77.5	-28.2	0	0	0	111	I497 L505	I497-D501 WeakPolarHBondContact O-CB 3.34Å; I497-D501 PolarHBondContact O-N 2.97Å; D501-L505 PolarHBondContact O-N 3.1Å; D501-L505 WeakPolarHBondContact O-CB 3.49Å; D501-L505 WeakPolarHBondContact O-CD1 3.43Å; D501-L505 WeakPolarHBondContact O-CG 3.49Å
502	E	58.3	Low	63.2	Low	135 Å²	135	97.3 Å²	97.3	63%	0.631	49%	0.486	S	S	*	.	H	α-helix	trans	-67.6	-43.2	175.8	-78.6	-165	-177.8	0	0	112.5	E498 D499 L505 L506	E498-E502 PolarHBondContact O-N 3.3Å; D499-E502 PolarHBondContact O-N 3.46Å; E502-L505 PolarHBondContact O-N 3.04Å; E502-L506 WeakPolarHBondContact O-CB 3.29Å; E502-L506 VanDerWaalsContact O-CG 3.29Å; E502-L506 WeakPolarHBondContact O-CG 3.45Å; E502-L506 PolarHBondContact O-N 3.31Å
503	D	58.1	Low	61.3	Low	118 Å²	118	100.2 Å²	100.2	63%	0.631	51%	0.508	S	S	*	.	H	α-helix	trans	-65.1	-38.6	175.5	-99.3	-14.2	0	0	0	111.9	D499 S507	D499-D503 PolarHBondContact O-N 3.06Å; D503-S507 WeakPolarHBondContact O-CB 3.43Å; D503-S507 PolarHBondContact O-N 2.94Å
504	E	60.8	Low	59.5	Low	132 Å²	132	105.1 Å²	105.1	62%	0.617	53%	0.533	S	S	*	.	H	α-helix	trans	-67	-42.9	174.8	-171.6	163.3	-145.5	0	0	111.2	E500 L506 S507 V508	E500-E504 WeakPolarHBondContact O-CB 3.31Å; E500-E504 PolarHBondContact O-N 2.82Å; E504-L506 PolarHBondContact O-N 3.48Å; E504-S507 PolarHBondContact O-N 3.39Å; E504-S507 PolarHBondContact O-OG 2.8Å; E504-S507 VanDerWaalsContact O-N 3.1Å; E504-S507 WeakPolarHBondContact O-CB 3.34Å; E504-S507 WeakPolarHBondContact O-CA 3.19Å; E504-V508 WeakPolarHBondContact O-CG2 3.41Å; E504-V508 PolarHBondContact O-N 2.7Å
505	L	57.8	Low	57.6	Low	114 Å²	114	107 Å²	107	60%	0.597	54%	0.541	S	S	*	.	H	α-helix	trans	-59	-46.1	174.3	-76.7	166.9	0	0	0	112.5	D501 E502 S507 V508 E509	D501-L505 PolarHBondContact O-N 3.1Å; D501-L505 WeakPolarHBondContact O-CB 3.49Å; D501-L505 WeakPolarHBondContact O-CD1 3.43Å; D501-L505 WeakPolarHBondContact O-CG 3.49Å; E502-L505 PolarHBondContact O-N 3.04Å; L505-S507 PolarHBondContact O-N 2.96Å; L505-V508 PolarHBondContact O-N 3.43Å; L505-E509 PolarHBondContact O-N 3.31Å
506	L	54.3	Low	56	Low	89 Å²	89	112.7 Å²	112.7	47%	0.466	56%	0.563	S	S	.	*	H	α-helix	trans	-62.7	-29.1	175.5	-73.1	168.8	0	0	0	112.6	E502 E504 Q510	E502-L506 WeakPolarHBondContact O-CB 3.29Å; E502-L506 VanDerWaalsContact O-CG 3.29Å; E502-L506 WeakPolarHBondContact O-CG 3.45Å; E502-L506 PolarHBondContact O-N 3.31Å; E504-L506 PolarHBondContact O-N 3.48Å; L506-Q510 VanDerWaalsContact O-NE2 3.13Å; L506-Q510 PolarHBondContact O-NE2 3.01Å; L506-Q510 WeakPolarHBondContact O-CG 3.42Å
507	S	52.2	Low	54.1	Low	51 Å²	51	118.7 Å²	118.7	36%	0.357	59%	0.594	S	S	.	*	H	α-helix	trans	-74.8	-32	173.1	89.4	0	0	0	0	112.7	D503 E504 L505 N511	D503-S507 WeakPolarHBondContact O-CB 3.43Å; D503-S507 PolarHBondContact O-N 2.94Å; E504-S507 PolarHBondContact O-N 3.39Å; E504-S507 PolarHBondContact O-OG 2.8Å; E504-S507 VanDerWaalsContact O-N 3.1Å; E504-S507 WeakPolarHBondContact O-CB 3.34Å; E504-S507 WeakPolarHBondContact O-CA 3.19Å; L505-S507 PolarHBondContact O-N 2.96Å; S507-N511 PolarHBondContact O-N 2.97Å; S507-N511 PolarHBondContact O-ND2 3.24Å
508	V	55.7	Low	52.2	Low	72 Å²	72	121.4 Å²	121.4	44%	0.436	61%	0.614	S	S	.	*	H	α-helix	trans	-72.9	-45.4	177.4	171.4	0	0	0	0	110.9	E504 L505 Q510 N511 E512	E504-V508 WeakPolarHBondContact O-CG2 3.41Å; E504-V508 PolarHBondContact O-N 2.7Å; L505-V508 PolarHBondContact O-N 3.43Å; V508-Q510 VanDerWaalsContact C-N 3.29Å; V508-Q510 PolarHBondContact O-N 3.13Å; V508-N511 WeakPolarHBondContact O-CA 3.26Å; V508-N511 PolarHBondContact O-N 3.06Å; V508-E512 PolarHBondContact O-N 3.37Å; V508-E512 VanDerWaalsContact O-N 3.11Å
509	E	52.8	Low	51.4	Low	133 Å²	133	121.7 Å²	121.7	62%	0.621	63%	0.626	S	S	*	*	H	α-helix	trans	-56.6	-42.9	177.1	-70.8	-165.5	154.6	0	0	111.8	L505 N511 E512 V513	L505-E509 PolarHBondContact O-N 3.31Å; E509-N511 PolarHBondContact O-N 3.11Å; E509-E512 PolarHBondContact O-N 3.24Å; E509-V513 WeakPolarHBondContact O-CG2 3.46Å; E509-V513 PolarHBondContact O-N 3.32Å
510	Q	48.9	Very low	49.6	Very low	137 Å²	137	122 Å²	122	64%	0.64	64%	0.642	S	S	*	*	H	α-helix	trans	-63.6	-24.2	175.9	-72.9	177.1	61.4	0	0	113.5	L506 V508 I514	L506-Q510 VanDerWaalsContact O-NE2 3.13Å; L506-Q510 PolarHBondContact O-NE2 3.01Å; L506-Q510 WeakPolarHBondContact O-CG 3.42Å; V508-Q510 VanDerWaalsContact C-N 3.29Å; V508-Q510 PolarHBondContact O-N 3.13Å; Q510-I514 VanDerWaalsContact O-CD1 3.26Å; Q510-I514 WeakPolarHBondContact O-CD1 3.46Å; Q510-I514 WeakPolarHBondContact O-CG1 3.44Å
511	N	46.7	Very low	48.1	Very low	98 Å²	98	126.5 Å²	126.5	52%	0.524	66%	0.66	S	S	.	*	H	α-helix	trans	-91.2	-14.5	178.1	-83.4	-74.1	0	0	0	114.3	S507 V508 E509 K515	S507-N511 PolarHBondContact O-N 2.97Å; S507-N511 PolarHBondContact O-ND2 3.24Å; V508-N511 WeakPolarHBondContact O-CA 3.26Å; V508-N511 PolarHBondContact O-N 3.06Å; E509-N511 PolarHBondContact O-N 3.11Å; N511-K515 WeakPolarHBondContact O-CE 3.48Å
512	E	48.9	Very low	46.4	Very low	142 Å²	142	128.3 Å²	128.3	66%	0.664	67%	0.665	S	S	*	*	H	α-helix	trans	-83.1	-40	172.4	-64.3	-144.7	126.3	0	0	112	V508 E509 I514 K515	V508-E512 PolarHBondContact O-N 3.37Å; V508-E512 VanDerWaalsContact O-N 3.11Å; E509-E512 PolarHBondContact O-N 3.24Å; E512-I514 PolarHBondContact O-N 2.92Å; E512-K515 PolarHBondContact O-N 3.03Å
513	V	47.6	Very low	45.1	Very low	127 Å²	127	130 Å²	130	77%	0.77	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.4	-18.4	-179.1	174.7	0	0	0	0	113.8	E509	E509-V513 WeakPolarHBondContact O-CG2 3.46Å; E509-V513 PolarHBondContact O-N 3.32Å
514	I	44.8	Very low	43.6	Very low	137 Å²	137	133.1 Å²	133.1	70%	0.703	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92	-2	-172.8	-63.3	175.1	0	0	0	113.2	Q510 E512	Q510-I514 VanDerWaalsContact O-CD1 3.26Å; Q510-I514 WeakPolarHBondContact O-CD1 3.46Å; Q510-I514 WeakPolarHBondContact O-CG1 3.44Å; E512-I514 PolarHBondContact O-N 2.92Å
515	K	39.8	Very low	42	Very low	157 Å²	157	133.2 Å²	133.2	68%	0.683	69%	0.691	S	S	*	*	S	Bend	trans	-95.3	-1.8	-167.3	-74.9	175.4	-174.5	155.4	0	117.8	N511 E512	N511-K515 WeakPolarHBondContact O-CE 3.48Å; E512-K515 PolarHBondContact O-N 3.03Å
516	E	41.5	Very low	40.9	Very low	187 Å²	187	133.7 Å²	133.7	87%	0.874	70%	0.7	S	S	*	*	S	Bend	trans	-121.9	83.1	173.3	-70.4	-159.9	131.2	0	0	113.3
517	E	32.8	Very low	39.5	Very low	193 Å²	193	138.3 Å²	138.3	90%	0.902	72%	0.722	S	S	*	*			trans	-177.3	123.2	131.7	-106.4	-171.6	176.8	0	0	113
518	V	31.3	Very low	38.3	Very low	136 Å²	136	142.7 Å²	142.7	82%	0.824	75%	0.746	S	S	*	*			trans	-158.4	141.7	179.6	-165.7	0	0	0	0	109.1
519	P	53.4	Low	37	Very low	120 Å²	120	148.8 Å²	148.8	78%	0.779	77%	0.767	S	S	*	*			cis	-134.2	176.4	-35.1	41	-25.9	0	0	0	113.6
520	A	29.1	Very low	35.8	Very low	102 Å²	102	152.5 Å²	152.5	84%	0.843	78%	0.781	S	S	*	*			trans	-150	157.6	154.4	0	0	0	0	0	112.9
521	K	31.7	Very low	34.8	Very low	187 Å²	187	154.6 Å²	154.6	81%	0.813	79%	0.791	S	S	*	*			trans	-96.9	173.8	178.8	-54	175.3	179.2	172.8	0	109.8
522	E	28.8	Very low	33.8	Very low	128 Å²	128	158.2 Å²	158.2	60%	0.598	81%	0.81	S	S	*	*			cis	-165.3	148.5	22.2	-160.9	159.7	-88.5	0	0	111.8
523	K	29.7	Very low	33.1	Very low	169 Å²	169	156.9 Å²	156.9	74%	0.735	81%	0.813	S	S	*	*			trans	39.9	143.5	157.7	-62.1	162.4	-165.7	151	0	120
524	E	27	Very low	32	Very low	185 Å²	185	160.1 Å²	160.1	86%	0.864	82%	0.82	S	S	*	*			cis	-151.8	-163.9	48.1	-81.2	-166.8	148	0	0	113.5
525	V	27.1	Very low	31.2	Very low	134 Å²	134	162.8 Å²	162.8	81%	0.812	83%	0.829	S	S	*	*			trans	-145.5	152.2	-165	158	0	0	0	0	107.6
526	P	34.3	Very low	30.5	Very low	123 Å²	123	164.7 Å²	164.7	80%	0.799	84%	0.841	S	S	*	*			cis	-131.3	178.8	21.6	29.9	-7.2	0	0	0	116.9
527	M	25.5	Very low	29.9	Very low	187 Å²	187	161.6 Å²	161.6	92%	0.921	84%	0.84	S	S	*	*			trans	-132.1	145.5	163.9	-157.6	178.9	-167	0	0	111.4
528	T	26.9	Very low	29.8	Very low	142 Å²	142	158.5 Å²	158.5	87%	0.871	84%	0.836	S	S	*	*			trans	-79.6	132.6	-173.9	-2.3	0	0	0	0	112.9
529	K	28.2	Very low	29.6	Very low	200 Å²	200	160.2 Å²	160.2	87%	0.87	84%	0.835	S	S	*	*			trans	-85	151.1	167	-76.4	-172.2	174.1	-174.3	0	111.7
530	K	28.2	Very low	28.4	Very low	212 Å²	212	161.3 Å²	161.3	92%	0.922	83%	0.834	S	S	*	*			trans	-142.7	134.9	162	-152	177.5	-172.6	-177.4	0	108.6
531	E	27.3	Very low	28.2	Very low	180 Å²	180	164.4 Å²	164.4	84%	0.841	83%	0.828	S	S	*	*			trans	-100.5	157.9	-167.6	-59.6	163.8	130.9	0	0	112.4
532	L	25.6	Very low	28	Very low	175 Å²	175	162 Å²	162	92%	0.916	83%	0.825	S	S	*	*			trans	-140.6	150.5	143.6	-115.3	109.9	0	0	0	108.7
533	P	33.9	Very low	27.9	Very low	114 Å²	114	161.4 Å²	161.4	74%	0.74	83%	0.829	S	S	*	*			trans	-111.8	160.5	-149.8	40.2	-33.8	0	0	0	115.9
534	E	24.9	Very low	27.7	Very low	195 Å²	195	159.3 Å²	159.3	91%	0.911	83%	0.831	S	S	*	*			trans	-79.8	166	163.6	-61.3	178.5	115.3	0	0	111.9
535	Q	27.3	Very low	27.8	Very low	192 Å²	192	158.2 Å²	158.2	90%	0.897	82%	0.823	S	S	*	*			trans	-125	127.3	165.9	-71.7	-167	-61.3	0	0	111.4
536	Q	25.3	Very low	27.8	Very low	198 Å²	198	158.7 Å²	158.7	93%	0.925	82%	0.816	S	S	*	*			trans	-135.4	159.3	154.6	-77	-162.2	-3.3	0	0	110.6
537	S	30.1	Very low	27.4	Very low	121 Å²	121	158.8 Å²	158.8	85%	0.846	81%	0.814	S	S	*	*			trans	-77.8	159.3	-171.3	-45.5	0	0	0	0	114.2
538	P	30.7	Very low	27.5	Very low	128 Å²	128	154.3 Å²	154.3	83%	0.831	80%	0.801	S	S	*	*			trans	-119	162.6	156.3	37.3	-28	0	0	0	113.9
539	E	25.7	Very low	27.5	Very low	173 Å²	173	156.1 Å²	156.1	81%	0.808	80%	0.797	S	S	*	*			trans	-93.7	178.6	-176.6	-67.2	-167.6	116.3	0	0	115.6
540	L	28.6	Very low	27.4	Very low	142 Å²	142	152.3 Å²	152.3	74%	0.743	79%	0.786	S	S	*	*			trans	-57.3	154.1	-176.6	-70.4	66.7	0	0	0	115.8
541	K	26.1	Very low	27.3	Very low	168 Å²	168	149.7 Å²	149.7	73%	0.73	78%	0.777	S	S	*	*			trans	171.2	149.5	133.9	-86.5	138.7	-140.4	111.4	0	108.2
542	N	26.8	Very low	27.2	Very low	137 Å²	137	149.4 Å²	149.4	73%	0.733	78%	0.775	S	S	*	*			cis	-161.8	161	-1.3	-124.5	1.9	0	0	0	112.1
543	V	27	Very low	27.1	Very low	114 Å²	114	147 Å²	147	69%	0.691	77%	0.774	S	S	*	*			trans	41.9	120.2	137.7	-178.6	0	0	0	0	118.5
544	T	25.8	Very low	26.6	Very low	126 Å²	126	146.5 Å²	146.5	77%	0.773	78%	0.778	S	S	*	*			cis	-156.4	-157.3	47.5	-10.1	0	0	0	0	109.4
545	K	28.1	Very low	26.6	Very low	161 Å²	161	140.7 Å²	140.7	70%	0.7	77%	0.771	S	S	*	*			cis	-158.7	148.3	4.8	-141.5	179.9	-179.3	-173.7	0	111.6
546	H	27.2	Very low	26.5	Very low	144 Å²	144	141.2 Å²	141.2	67%	0.667	77%	0.771	S	S	*	*			trans	58.1	128.8	168	-63.5	-62.1	0	0	0	118.3
547	V	26.9	Very low	26.5	Very low	126 Å²	126	141.1 Å²	141.1	76%	0.764	77%	0.767	S	S	*	*			cis	80.3	119.6	48.9	170.5	0	0	0	0	111.6
548	S	27.2	Very low	26.3	Very low	93 Å²	93	144.4 Å²	144.4	65%	0.65	77%	0.766	S	S	*	*			cis	-173.9	157.5	-0.7	52.3	0	0	0	0	115.8
549	K	26.9	Very low	26	Very low	179 Å²	179	144.3 Å²	144.3	78%	0.778	76%	0.764	S	S	*	*			trans	69.3	124.3	146.5	-76.3	-174	161.3	-157.7	0	119.7
550	L	25.2	Very low	26	Very low	121 Å²	121	141.5 Å²	141.5	63%	0.634	76%	0.763	S	S	*	*				78.3	150.1	101.3	-60.1	176.8	0	0	0	113.9
551	E	25.8	Very low	26	Very low	157 Å²	157	142.9 Å²	142.9	73%	0.734	77%	0.765	S	S	*	*			cis	-152.7	-164.1	3.3	-139.2	141.1	-153.7	0	0	112.3
552	E	25.2	Very low	26	Very low	173 Å²	173	143.1 Å²	143.1	81%	0.808	77%	0.769	S	S	*	*			trans	-62.3	162.7	-173.5	-52.2	173.8	120.6	0	0	117.1
553	S	23.8	Very low	26.1	Very low	126 Å²	126	142.6 Å²	142.6	88%	0.881	77%	0.771	S	S	*	*				148.1	172.7	108.6	68.8	0	0	0	0	117.1
554	A	24.8	Very low	26.1	Very low	102 Å²	102	142.7 Å²	142.7	84%	0.843	77%	0.771	S	S	*	*			trans	-75.8	141.8	-158	0	0	0	0	0	120.1
555	G	23.5	Very low	26.2	Very low	74 Å²	74	143.6 Å²	143.6	76%	0.763	78%	0.776	S	S	*	*				101.2	161.9	104.7	0	0	0	0	0	122.6
556	K	25.8	Very low	26.3	Very low	203 Å²	203	142 Å²	142	88%	0.883	78%	0.779	S	S	*	*			trans	77.2	115.5	161.2	-75.7	176.7	177.6	168.6	0	122.6
557	K	25	Very low	26.4	Very low	196 Å²	196	139.8 Å²	139.8	85%	0.852	79%	0.787	S	S	*	*				45.3	120.9	127.4	-70	-168.8	171.4	-168.6	0	121.6
558	K	25.8	Very low	26.6	Very low	190 Å²	190	143.4 Å²	143.4	83%	0.826	79%	0.792	S	S	*	*				177.6	133.3	110.4	-90.9	174.1	178.4	-174.2	0	106.9
559	T	24.3	Very low	27.4	Very low	126 Å²	126	144.3 Å²	144.3	77%	0.773	80%	0.796	S	S	*	*				63.9	105.5	52.2	67.9	0	0	0	0	115.4
560	S	27.1	Very low	27.7	Very low	113 Å²	113	145.9 Å²	145.9	79%	0.79	80%	0.803	S	S	*	*			trans	-159.8	120.4	157.4	54.5	0	0	0	0	110.3
561	E	28.2	Very low	28.1	Very low	171 Å²	171	143.5 Å²	143.5	80%	0.799	81%	0.807	S	S	*	*			trans	-65.8	174.9	152.9	-56.9	100.3	152.9	0	0	110
562	E	26.4	Very low	28.7	Very low	174 Å²	174	142.1 Å²	142.1	81%	0.813	81%	0.812	S	S	*	*			cis	-151.6	173.4	5.5	-143.9	169.5	-158.1	0	0	107
563	V	27.9	Very low	29.3	Very low	126 Å²	126	139.3 Å²	139.3	76%	0.764	81%	0.808	S	S	*	*				-180	149.6	84.5	160.5	0	0	0	0	108.2
564	V	26.8	Very low	29.6	Very low	116 Å²	116	140.2 Å²	140.2	70%	0.703	81%	0.809	S	S	*	*			trans	-98.2	142.9	179.4	174.9	0	0	0	0	112.8	V566	V564-V566 HydrophobicContact CG1-CG2 3.9Å
565	V	29.3	Very low	30	Very low	144 Å²	144	143.8 Å²	143.8	87%	0.873	81%	0.808	S	S	*	*			trans	-136.3	137.7	156	-176.6	0	0	0	0	109.8
566	V	30.1	Very low	30.4	Very low	127 Å²	127	150.4 Å²	150.4	77%	0.77	82%	0.816	S	S	*	*			trans	-114.3	135.8	-174.1	174.8	0	0	0	0	111.4	V564	V564-V566 HydrophobicContact CG1-CG2 3.9Å
567	A	29	Very low	30.6	Very low	99 Å²	99	149.5 Å²	149.5	82%	0.818	81%	0.812	S	S	*	*			trans	-153.6	132.4	162.5	0	0	0	0	0	113.4
568	K	31.3	Very low	30.9	Very low	202 Å²	202	149.7 Å²	149.7	88%	0.878	81%	0.813	S	S	*	*			trans	-159.2	163.9	169.2	-101.1	-174.5	-179.6	177.7	0	107.4
569	P	43.2	Very low	31.4	Very low	112 Å²	112	146.9 Å²	146.9	73%	0.727	81%	0.814	S	S	*	*			cis	-126.2	179	-22.4	39.5	-25.4	0	0	0	112.1
570	K	33.3	Very low	32	Very low	212 Å²	212	150.3 Å²	150.3	92%	0.922	82%	0.818	S	S	*	*			trans	-139.2	149	155.5	-81.6	-165.4	175.5	178.8	0	111.7
571	G	32.9	Very low	32.2	Very low	70 Å²	70	151.3 Å²	151.3	72%	0.722	82%	0.819	S	S	*	*			trans	-84.7	-177.1	-175.8	0	0	0	0	0	115.4
572	P	39.4	Very low	32.4	Very low	129 Å²	129	151.3 Å²	151.3	84%	0.838	82%	0.816	S	S	*	*			trans	-102.8	158.9	-155.5	38.2	-36.6	0	0	0	115.9
573	P	36.4	Very low	32.7	Very low	113 Å²	113	149.2 Å²	149.2	73%	0.734	81%	0.807	S	S	*	*			trans	-110.7	119.5	161.2	34.7	-24.3	0	0	0	113.7
574	T	31.3	Very low	32.9	Very low	146 Å²	146	151.5 Å²	151.5	90%	0.896	81%	0.809	S	S	*	*			trans	31.8	143.1	139.4	20.7	0	0	0	0	124.2
575	Q	32.1	Very low	33	Very low	176 Å²	176	158 Å²	158	82%	0.822	84%	0.838	S	S	*	*			trans	-67.1	149.9	178.8	-56.5	170.5	-1.7	0	0	115.3
576	K	32.2	Very low	33.2	Very low	214 Å²	214	158.7 Å²	158.7	93%	0.93	84%	0.836	S	S	*	*			trans	-135.1	159.1	150	-78.1	-170.9	176.9	178.1	0	110.5
577	K	31	Very low	33.4	Very low	184 Å²	184	160.3 Å²	160.3	80%	0.8	84%	0.84	S	S	*	*			trans	-110.7	139.9	-168.8	-70.5	174.2	175.2	170.4	0	113.3
578	K	30.6	Very low	33.6	Very low	200 Å²	200	163.7 Å²	163.7	87%	0.87	84%	0.841	S	S	*	*			trans	69	163.8	153.5	-80.7	-177.6	179.5	-176.9	0	116.1
579	P	36.2	Very low	33.8	Very low	130 Å²	130	161.5 Å²	161.5	84%	0.844	84%	0.839	S	S	*	*			cis	-116	-167.5	16.9	42.8	-31	0	0	0	116.7
580	K	36.5	Very low	33.2	Very low	199 Å²	199	164.6 Å²	164.6	87%	0.865	85%	0.846	S	S	*	*			trans	-98.3	142.8	-179.7	-68.1	-178.4	172.1	-171.8	0	112.3
581	V	32.6	Very low	33.2	Very low	133 Å²	133	161.4 Å²	161.4	81%	0.806	84%	0.841	S	S	*	*			trans	-145.2	123.1	147.7	-170.4	0	0	0	0	103.1
582	K	31.6	Very low	33.2	Very low	171 Å²	171	167.9 Å²	167.9	74%	0.743	85%	0.849	S	S	*	*				81.7	139.9	50.9	-153.9	-177.6	178.2	-86.9	0	111.6
583	E	32.4	Very low	32.7	Very low	131 Å²	131	170.9 Å²	170.9	61%	0.612	85%	0.85	S	S	*	*			trans	62.5	152.4	-172.8	-79.6	116	-115.8	0	0	115.7
584	E	33	Very low	32.4	Very low	173 Å²	173	175.8 Å²	175.8	81%	0.808	86%	0.86	S	S	*	*			cis	-163.5	129.1	-33.6	-133.7	170.1	-147.8	0	0	108.7
585	L	29.5	Very low	32.5	Very low	252 Å²	252	178.5 Å²	178.5	100%	1.319	86%	0.856	S	S	*	*			trans	169.2	0	157	-96.6	161.7	0	0	0	110.6

Retrieved 585 of 585 residues in 1316.4 ms (Link to these results)

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