A0A5K4EYW5_SCHMA Loading...

Endo/exonuclease/phosphatase domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4EYW5, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 400 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	40.2	Very low	33.3	Very low	248 Å²	248	166.5 Å²	166.5	100%	1.222	87%	0.87	S	S	*	*				0	116.7	0	-76.7	172	163.4	0	0	107.6
2	A	34.4	Very low	33	Very low	102 Å²	102	160.6 Å²	160.6	84%	0.843	85%	0.848	S	S	*	*			trans	-73.2	129.2	-163.8	0	0	0	0	0	113.3
3	K	33.1	Very low	33	Very low	191 Å²	191	160.5 Å²	160.5	83%	0.83	84%	0.844	S	S	*	*				50.8	107.9	103.1	-77.6	-168.2	179.5	-176.4	0	116.8
4	N	33.9	Very low	32.9	Very low	157 Å²	157	159.1 Å²	159.1	84%	0.84	84%	0.837	S	S	*	*				172.9	143	100	-96.5	-9.8	0	0	0	113
5	Q	34.1	Very low	33	Very low	185 Å²	185	155.7 Å²	155.7	86%	0.864	83%	0.825	S	S	*	*			trans	-76.6	151.4	171.1	-69	163	-42	0	0	111.5
6	Q	33.2	Very low	32.9	Very low	192 Å²	192	156.6 Å²	156.6	90%	0.897	82%	0.823	S	S	*	*			trans	-168.6	132	130.4	-113.6	171.1	-9.4	0	0	112.9
7	F	28.6	Very low	32.8	Very low	208 Å²	208	158.8 Å²	158.8	91%	0.912	83%	0.828	S	S	*	*			trans	-72	136.1	161.1	-86.5	-103.5	0	0	0	109.7
8	S	30	Very low	32.8	Very low	101 Å²	101	156.3 Å²	156.3	71%	0.706	82%	0.816	S	S	*	*			trans	170.4	130.5	138.7	47.5	0	0	0	0	109.4
9	N	33.4	Very low	33.4	Very low	164 Å²	164	153.4 Å²	153.4	88%	0.877	81%	0.81	S	S	*	*			trans	-156.7	75.2	145.1	-92.7	-19.2	0	0	0	106.1
10	I	29.6	Very low	34	Very low	159 Å²	159	151.5 Å²	151.5	82%	0.815	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-68.1	119.1	154.9	-67.5	170.1	0	0	0	104.7	P12	I10-P12 WeakPolarHBondContact O-CD 3.2Å
11	V	35.4	Very low	34.6	Very low	125 Å²	125	145.9 Å²	145.9	76%	0.758	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-65.8	120.7	174.4	177.1	0	0	0	0	107.7	M13	V11-M13 PolarHBondContact O-N 2.91Å
12	P	30.1	Very low	35.2	Very low	95 Å²	95	141.9 Å²	141.9	62%	0.617	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-70.4	119.8	170.4	28.9	-28.9	0	0	0	107.6	I10 D14	I10-P12 WeakPolarHBondContact O-CD 3.2Å; P12-D14 VanDerWaalsContact C-N 3.28Å; P12-D14 PolarHBondContact O-N 3.29Å; P12-D14 VanDerWaalsContact O-N 3.13Å
13	M	33	Very low	36.8	Very low	160 Å²	160	142.1 Å²	142.1	79%	0.788	74%	0.742	S	S	*	*			trans	-80.7	88.1	167.4	-148.3	179.3	78.8	0	0	106.1	V11 V15	V11-M13 PolarHBondContact O-N 2.91Å; M13-V15 VanDerWaalsContact C-N 3.33Å; M13-V15 HydrophobicContact CE-CG2 3.67Å; M13-V15 PolarHBondContact O-N 2.95Å
14	D	31.9	Very low	39.2	Very low	141 Å²	141	136.4 Å²	136.4	75%	0.754	72%	0.723	S	S	*	*			trans	-62	101.2	164.7	-74.3	-36	0	0	0	107.2	P12 E16	P12-D14 VanDerWaalsContact C-N 3.28Å; P12-D14 PolarHBondContact O-N 3.29Å; P12-D14 VanDerWaalsContact O-N 3.13Å; D14-E16 VanDerWaalsContact C-N 3.32Å; D14-E16 PolarHBondContact O-N 2.87Å; D14-E16 VanDerWaalsContact O-N 3.13Å
15	V	34.4	Very low	41.7	Very low	107 Å²	107	133 Å²	133	65%	0.648	70%	0.701	S	S	*	*			trans	-79.4	88	171.6	-177.2	0	0	0	0	106.6	M13 E17	M13-V15 VanDerWaalsContact C-N 3.33Å; M13-V15 HydrophobicContact CE-CG2 3.67Å; M13-V15 PolarHBondContact O-N 2.95Å; V15-E17 PolarHBondContact O-N 3.24Å
16	E	30.6	Very low	44.1	Very low	171 Å²	171	126.6 Å²	126.6	80%	0.799	67%	0.672	S	S	*	*			trans	-69.9	120.1	153	-73.8	-168.7	162.4	0	0	107.8	D14 N18	D14-E16 VanDerWaalsContact C-N 3.32Å; D14-E16 PolarHBondContact O-N 2.87Å; D14-E16 VanDerWaalsContact O-N 3.13Å; E16-N18 PolarHBondContact O-N 2.89Å
17	E	32	Very low	46.8	Very low	193 Å²	193	123.3 Å²	123.3	90%	0.902	66%	0.657	S	S	*	*			trans	-62	79.6	171.1	-76.6	-175.1	138.2	0	0	110.4	V15 S19	V15-E17 PolarHBondContact O-N 3.24Å; E17-S19 PolarHBondContact O-N 3.29Å
18	N	32.4	Very low	49.9	Very low	114 Å²	114	116.5 Å²	116.5	61%	0.61	63%	0.627	S	S	*	*			trans	-93	93.8	170.6	-145.7	-10.4	0	0	0	108.6	E16 N20 G21	E16-N18 PolarHBondContact O-N 2.89Å; N18-N20 PolarHBondContact O-N 3.34Å; N18-G21 PolarHBondContact O-N 3.47Å; N18-G21 VanDerWaalsContact O-N 3.08Å
19	S	44.2	Very low	52.7	Low	101 Å²	101	111.9 Å²	111.9	71%	0.706	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.8	-10.7	178.1	51.2	0	0	0	0	114.2	E17	E17-S19 PolarHBondContact O-N 3.29Å
20	N	44.9	Very low	55.3	Low	115 Å²	115	106.3 Å²	106.3	62%	0.615	56%	0.564	S	S	*	*	H	α-helix	trans	-77	-20.7	173.6	-81.6	-0.5	0	0	0	114.9	N18	N18-N20 PolarHBondContact O-N 3.34Å
21	G	48.2	Very low	58.2	Low	35 Å²	35	102.4 Å²	102.4	36%	0.361	55%	0.545	S	S	.	.	H	α-helix	trans	-74.5	-33.1	-174	0	0	0	0	0	114.4	N18 F25	N18-G21 PolarHBondContact O-N 3.47Å; N18-G21 VanDerWaalsContact O-N 3.08Å; G21-F25 WeakPolarHBondContact O-CD2 3.46Å
22	K	52.1	Low	61.1	Low	164 Å²	164	96.5 Å²	96.5	71%	0.713	51%	0.509	S	S	*	.	H	α-helix	trans	-73.2	-30.4	-178.3	-69.6	-176.6	179.2	177.2	0	112.6	L26	K22-L26 PolarHBondContact O-N 3.12Å
23	D	68.5	Low	63.8	Low	106 Å²	106	92.4 Å²	92.4	57%	0.567	48%	0.483	S	S	*	.	H	α-helix	trans	-68.9	-38.7	177	-93.9	-14.5	0	0	0	112.1	F25 L26 E27	D23-F25 VanDerWaalsContact C-N 3.27Å; D23-F25 PolarHBondContact O-N 2.72Å; D23-L26 PolarHBondContact O-N 2.92Å; D23-E27 VanDerWaalsContact O-CB 3.27Å; D23-E27 WeakPolarHBondContact O-CB 3.41Å; D23-E27 PolarHBondContact O-N 2.93Å
24	V	82.4	Confident	66.5	Low	71 Å²	71	88.4 Å²	88.4	43%	0.43	46%	0.463	S	S	.	.	H	α-helix	trans	-60.9	-38.2	179.4	177.2	0	0	0	0	111.8	K28	V24-K28 VanDerWaalsContact O-CG 3.32Å; V24-K28 WeakPolarHBondContact O-CG 3.34Å; V24-K28 PolarHBondContact O-N 3.36Å
25	F	87.8	Confident	69.4	Low	87 Å²	87	85.1 Å²	85.1	38%	0.382	45%	0.447	S	S	.	.	H	α-helix	trans	-69.3	-47.6	177.4	-68.5	-43.2	0	0	0	111.7	G21 D23 E27 K28 C29 W52	G21-F25 WeakPolarHBondContact O-CD2 3.46Å; D23-F25 VanDerWaalsContact C-N 3.27Å; D23-F25 PolarHBondContact O-N 2.72Å; F25-E27 VanDerWaalsContact C-N 3.3Å; F25-E27 PolarHBondContact O-N 3.23Å; F25-K28 PolarHBondContact O-N 2.98Å; F25-C29 PolarHBondContact O-N 2.82Å; F25-C29 PolarHBondContact O-SG 3.11Å; F25-C29 VanDerWaalsContact O-SG 3.38Å; F25-W52 VanDerWaalsContact CA-CZ3 3.49Å; F25-W52 HydrophobicContact CB-CE3 4.1Å; F25-W52 HydrophobicContact CB-CH2 3.4Å; F25-W52 HydrophobicContact CB-CZ2 4.07Å; F25-W52 HydrophobicContact CB-CZ3 3.46Å; F25-W52 VanDerWaalsContact CB-CZ3 3.46Å; F25-W52 HydrophobicContact CD1-CB 4.34Å; F25-W52 AromaticContact CD1-CD2 3.27Å; F25-W52 HydrophobicContact CD1-CD2 3.27Å; F25-W52 AromaticContact CD1-CE2 3.57Å; F25-W52 AromaticContact CD1-CE3 3.33Å; F25-W52 HydrophobicContact CD1-CE3 3.33Å; F25-W52 AromaticContact CD1-CG 3.78Å; F25-W52 HydrophobicContact CD1-CG 3.78Å; F25-W52 AromaticContact CD1-CH2 3.83Å; F25-W52 HydrophobicContact CD1-CH2 3.83Å; F25-W52 AromaticContact CD1-CZ2 3.84Å; F25-W52 HydrophobicContact CD1-CZ2 3.84Å; F25-W52 AromaticContact CD1-CZ3 3.63Å; F25-W52 HydrophobicContact CD1-CZ3 3.63Å; F25-W52 HydrophobicContact CE1-CB 4.12Å; F25-W52 AromaticContact CE1-CD1 3.92Å; F25-W52 AromaticContact CE1-CD2 3.65Å; F25-W52 HydrophobicContact CE1-CD2 3.65Å; F25-W52 AromaticContact CE1-CE2 3.87Å; F25-W52 HydrophobicContact CE1-CE3 4.15Å; F25-W52 AromaticContact CE1-CG 3.65Å; F25-W52 HydrophobicContact CE1-CG 3.65Å; F25-W52 HydrophobicContact CE1-CZ2 4.47Å; F25-W52 HydrophobicContact CG-CD2 4.2Å; F25-W52 HydrophobicContact CG-CE3 4.09Å; F25-W52 AromaticContact CG-CH2 3.78Å; F25-W52 HydrophobicContact CG-CH2 3.78Å; F25-W52 AromaticContact CG-CZ2 3.96Å; F25-W52 HydrophobicContact CG-CZ2 3.96Å; F25-W52 AromaticContact CG-CZ3 3.89Å; F25-W52 HydrophobicContact CG-CZ3 3.89Å; F25-W52 VanDerWaalsContact O-CZ3 3.28Å; F25-W52 WeakPolarHBondContact O-CZ3 3.2Å
26	L	83.7	Confident	71.9	Confident	50 Å²	50	80.4 Å²	80.4	26%	0.262	42%	0.419	S	S	.	.	H	α-helix	trans	-61.8	-40.3	176.8	-176.8	60.5	0	0	0	111.8	K22 D23 C29 I30	K22-L26 PolarHBondContact O-N 3.12Å; D23-L26 PolarHBondContact O-N 2.92Å; L26-C29 WeakPolarHBondContact O-CB 3.39Å; L26-C29 PolarHBondContact O-N 3.26Å; L26-I30 HydrophobicContact CG-CD1 4.19Å; L26-I30 WeakPolarHBondContact O-CG1 3.25Å; L26-I30 PolarHBondContact O-N 3.29Å
27	E	89	Confident	74.6	Confident	123 Å²	123	77.8 Å²	77.8	58%	0.575	42%	0.419	S	S	*	.	H	α-helix	trans	-64.3	-39.8	177.2	-168.7	163.9	-157.7	0	0	111.7	D23 F25 I30 L31	D23-E27 VanDerWaalsContact O-CB 3.27Å; D23-E27 WeakPolarHBondContact O-CB 3.41Å; D23-E27 PolarHBondContact O-N 2.93Å; F25-E27 VanDerWaalsContact C-N 3.3Å; F25-E27 PolarHBondContact O-N 3.23Å; E27-I30 WeakPolarHBondContact O-CB 3.2Å; E27-I30 PolarHBondContact O-N 3.28Å; E27-L31 PolarHBondContact O-N 2.92Å
28	K	94	Very high	77.2	Confident	64 Å²	64	69.8 Å²	69.8	28%	0.278	38%	0.384	S	S	.	.	H	α-helix	trans	-62.9	-41.6	171.1	-74.8	177.9	177.7	-176.9	0	112.2	V24 F25 I30 L31 F32 L47 W52 L54	V24-K28 VanDerWaalsContact O-CG 3.32Å; V24-K28 WeakPolarHBondContact O-CG 3.34Å; V24-K28 PolarHBondContact O-N 3.36Å; F25-K28 PolarHBondContact O-N 2.98Å; K28-I30 VanDerWaalsContact C-N 3.3Å; K28-I30 PolarHBondContact O-N 2.87Å; K28-L31 PolarHBondContact O-N 2.99Å; K28-F32 WeakPolarHBondContact O-CB 3.35Å; K28-F32 PolarHBondContact O-N 2.77Å; K28-L47 HydrophobicContact CB-CD1 3.67Å; K28-L47 HydrophobicContact CB-CD2 4.07Å; K28-L47 HydrophobicContact CD-CD2 4.46Å; K28-L47 WeakPolarHBondContact O-CD1 3.49Å; K28-W52 HydrophobicContact CB-CE3 4.37Å; K28-W52 HydrophobicContact CD-CB 4.44Å; K28-W52 HydrophobicContact CD-CE3 4.3Å; K28-W52 WeakPolarHBondContact CD-O 3.43Å; K28-W52 WeakPolarHBondContact CE-O 3.4Å; K28-W52 PolarHBondContact NZ-O 2.92Å; K28-L54 HydrophobicContact CG-CB 4.48Å
29	C	89.4	Confident	79.6	Confident	4 Å²	4	66 Å²	66	3%	0.027	36%	0.364	C	S	.	.	H	α-helix	trans	-62.2	-39.4	175.8	-67.2	0	0	0	0	111.7	F25 L26 A33 R40 M44 L47	F25-C29 PolarHBondContact O-N 2.82Å; F25-C29 PolarHBondContact O-SG 3.11Å; F25-C29 VanDerWaalsContact O-SG 3.38Å; L26-C29 WeakPolarHBondContact O-CB 3.39Å; L26-C29 PolarHBondContact O-N 3.26Å; C29-A33 VanDerWaalsContact O-CB 3.26Å; C29-A33 WeakPolarHBondContact O-CB 3.31Å; C29-A33 PolarHBondContact O-N 2.87Å; C29-R40 HydrophobicContact CB-CB 4.31Å; C29-M44 VanDerWaalsContact SG-CA 3.6Å; C29-M44 VanDerWaalsContact SG-SD 3.61Å; C29-L47 HydrophobicContact CB-CD1 4.34Å
30	I	87	Confident	81.6	Confident	48 Å²	48	65 Å²	65	25%	0.246	35%	0.345	C	S	.	.	H	α-helix	trans	-62.8	-52.6	173.7	-68.6	163	0	0	0	110	L26 E27 K28 F32 A33 E34	L26-I30 HydrophobicContact CG-CD1 4.19Å; L26-I30 WeakPolarHBondContact O-CG1 3.25Å; L26-I30 PolarHBondContact O-N 3.29Å; E27-I30 WeakPolarHBondContact O-CB 3.2Å; E27-I30 PolarHBondContact O-N 3.28Å; K28-I30 VanDerWaalsContact C-N 3.3Å; K28-I30 PolarHBondContact O-N 2.87Å; I30-F32 VanDerWaalsContact C-N 3.32Å; I30-F32 PolarHBondContact O-N 3.47Å; I30-A33 PolarHBondContact O-N 3.45Å; I30-E34 HydrophobicContact CG2-CG 4.34Å; I30-E34 WeakPolarHBondContact O-CG 3.29Å; I30-E34 PolarHBondContact O-N 2.86Å
31	L	92.1	Very high	83.3	Confident	77 Å²	77	60.9 Å²	60.9	40%	0.403	33%	0.326	S	S	.	.	H	α-helix	trans	-62.9	-39.3	-177.1	-127.3	81.3	0	0	0	112.2	E27 K28 T35 L54	E27-L31 PolarHBondContact O-N 2.92Å; K28-L31 PolarHBondContact O-N 2.99Å; L31-T35 VanDerWaalsContact O-CB 3.27Å; L31-T35 WeakPolarHBondContact O-CB 3.34Å; L31-T35 PolarHBondContact O-N 2.89Å; L31-T35 PolarHBondContact O-OG1 2.8Å; L31-L54 HydrophobicContact CB-CD1 4.41Å; L31-L54 HydrophobicContact CB-CD2 3.73Å; L31-L54 HydrophobicContact CD2-CD2 3.44Å; L31-L54 VanDerWaalsContact CD2-CD2 3.44Å; L31-L54 HydrophobicContact CG-CD2 4.17Å
32	F	95.5	Very high	84.9	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-58.2	-57.6	173.3	-176.3	-76	0	0	0	109.6	K28 I30 E34 T35 T36 L42 Y46 L47 L54 A57 V58 Y61	K28-F32 WeakPolarHBondContact O-CB 3.35Å; K28-F32 PolarHBondContact O-N 2.77Å; I30-F32 VanDerWaalsContact C-N 3.32Å; I30-F32 PolarHBondContact O-N 3.47Å; F32-E34 VanDerWaalsContact C-N 3.25Å; F32-E34 PolarHBondContact O-N 2.82Å; F32-T35 PolarHBondContact O-N 3.05Å; F32-T36 HydrophobicContact CD1-CG2 4.03Å; F32-T36 WeakPolarHBondContact CD1-OG1 3.24Å; F32-T36 HydrophobicContact CE1-CG2 3.71Å; F32-T36 WeakPolarHBondContact CE1-OG1 3.4Å; F32-T36 HydrophobicContact CE2-CG2 4.24Å; F32-T36 HydrophobicContact CG-CG2 4.45Å; F32-T36 HydrophobicContact CZ-CG2 3.83Å; F32-T36 PolarHBondContact O-N 2.78Å; F32-T36 PolarHBondContact O-OG1 3.05Å; F32-L42 HydrophobicContact CE1-CG 4.43Å; F32-Y46 HydrophobicContact CE1-CD2 4.42Å; F32-Y46 VanDerWaalsContact CE2-CB 3.43Å; F32-Y46 HydrophobicContact CE2-CD1 4.16Å; F32-Y46 HydrophobicContact CE2-CD2 4.44Å; F32-Y46 AromaticContact CE2-CG 3.78Å; F32-Y46 HydrophobicContact CE2-CG 3.78Å; F32-Y46 HydrophobicContact CZ-CD1 4.07Å; F32-Y46 AromaticContact CZ-CD2 3.71Å; F32-Y46 HydrophobicContact CZ-CD2 3.71Å; F32-Y46 HydrophobicContact CZ-CE2 4.48Å; F32-Y46 AromaticContact CZ-CG 3.5Å; F32-Y46 HydrophobicContact CZ-CG 3.5Å; F32-L47 HydrophobicContact CB-CD1 4.29Å; F32-L54 HydrophobicContact CB-CD1 3.69Å; F32-L54 HydrophobicContact CD2-CD1 4.27Å; F32-L54 HydrophobicContact CG-CD1 4.49Å; F32-A57 HydrophobicContact CD2-CB 3.95Å; F32-A57 HydrophobicContact CE2-CB 3.83Å; F32-V58 HydrophobicContact CD2-CG2 3.7Å; F32-V58 HydrophobicContact CE2-CG2 4.14Å; F32-V58 HydrophobicContact CG-CG2 4.35Å; F32-Y61 HydrophobicContact CZ-CD2 4.14Å; F32-Y61 HydrophobicContact CZ-CG 4.09Å
33	A	85.8	Confident	86.6	Confident	10 Å²	10	51.4 Å²	51.4	8%	0.083	28%	0.275	C	S	.	.	H	α-helix	trans	-54	-42.5	-177.5	0	0	0	0	0	112.1	C29 I30 S37 T38 R40	C29-A33 VanDerWaalsContact O-CB 3.26Å; C29-A33 WeakPolarHBondContact O-CB 3.31Å; C29-A33 PolarHBondContact O-N 2.87Å; I30-A33 PolarHBondContact O-N 3.45Å; A33-S37 CarbonylContact O-C 3.49Å; A33-S37 WeakPolarHBondContact O-CA 3.43Å; A33-S37 PolarHBondContact O-N 3.13Å; A33-T38 WeakPolarHBondContact CB-O 3.35Å; A33-T38 PolarHBondContact O-N 3.46Å; A33-R40 HydrophobicContact CB-CG 4.3Å
34	E	89.9	Confident	87.5	Confident	76 Å²	76	49.6 Å²	49.6	36%	0.355	26%	0.264	S	S	.	.	H	α-helix	trans	-68.1	-40.7	176.4	-68.8	-173.2	129.5	0	0	113	I30 F32 R344	I30-E34 HydrophobicContact CG2-CG 4.34Å; I30-E34 WeakPolarHBondContact O-CG 3.29Å; I30-E34 PolarHBondContact O-N 2.86Å; F32-E34 VanDerWaalsContact C-N 3.25Å; F32-E34 PolarHBondContact O-N 2.82Å; E34-R344 IonicContact OE1-CZ 2.69Å; E34-R344 IonicContact OE1-NE 3.47Å; E34-R344 PolarHBondContact OE1-NE 3.44Å; E34-R344 IonicContact OE1-NH2 3.17Å; E34-R344 PolarHBondContact OE1-NH2 3.08Å; E34-R344 VanDerWaalsContact OE1-NH2 3.16Å; E34-R344 IonicContact OE2-CZ 3.55Å; E34-R344 IonicContact OE2-NE 2.81Å; E34-R344 IonicContact OE2-NH2 3.75Å; E34-R344 PolarHBondContact OE2-NH2 3.37Å
35	T	92.6	Very high	87.9	Confident	71 Å²	71	47.8 Å²	47.8	44%	0.436	25%	0.251	S	S	.	.	H	α-helix	trans	-71	-38.5	-178.2	-56.6	0	0	0	0	111.8	L31 F32 V58	L31-T35 VanDerWaalsContact O-CB 3.27Å; L31-T35 WeakPolarHBondContact O-CB 3.34Å; L31-T35 PolarHBondContact O-N 2.89Å; L31-T35 PolarHBondContact O-OG1 2.8Å; F32-T35 PolarHBondContact O-N 3.05Å; T35-V58 HydrophobicContact CG2-CG1 3.7Å; T35-V58 HydrophobicContact CG2-CG2 4.23Å
36	T	88.5	Confident	88	Confident	9 Å²	9	44.5 Å²	44.5	6%	0.055	24%	0.236	C	C	.	.	H	α-helix	trans	-91.6	-7.4	-177.5	55.9	0	0	0	0	113.2	F32 T38 V58 Y61 F62	F32-T36 HydrophobicContact CD1-CG2 4.03Å; F32-T36 WeakPolarHBondContact CD1-OG1 3.24Å; F32-T36 HydrophobicContact CE1-CG2 3.71Å; F32-T36 WeakPolarHBondContact CE1-OG1 3.4Å; F32-T36 HydrophobicContact CE2-CG2 4.24Å; F32-T36 HydrophobicContact CG-CG2 4.45Å; F32-T36 HydrophobicContact CZ-CG2 3.83Å; F32-T36 PolarHBondContact O-N 2.78Å; F32-T36 PolarHBondContact O-OG1 3.05Å; T36-T38 VanDerWaalsContact C-N 3.33Å; T36-T38 PolarHBondContact OG1-OG1 3.02Å; T36-V58 HydrophobicContact CG2-CG1 4.39Å; T36-V58 HydrophobicContact CG2-CG2 4.29Å; T36-Y61 HydrophobicContact CG2-CD1 3.36Å; T36-Y61 HydrophobicContact CG2-CE1 3.85Å; T36-Y61 HydrophobicContact CG2-CG 3.77Å; T36-F62 HydrophobicContact CG2-CE2 4.42Å; T36-F62 HydrophobicContact CG2-CZ 4.39Å
37	S	87.6	Confident	88.5	Confident	115 Å²	115	42.1 Å²	42.1	80%	0.804	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.1	44.1	-170.7	-57.4	0	0	0	0	112.7	A33	A33-S37 CarbonylContact O-C 3.49Å; A33-S37 WeakPolarHBondContact O-CA 3.43Å; A33-S37 PolarHBondContact O-N 3.13Å
38	T	86.2	Confident	88.6	Confident	26 Å²	26	39.9 Å²	39.9	16%	0.16	21%	0.214	C	C	.	.	S	Bend	trans	-125.2	-169.5	179.3	66.6	0	0	0	0	110.8	A33 T36 L42 Y61	A33-T38 WeakPolarHBondContact CB-O 3.35Å; A33-T38 PolarHBondContact O-N 3.46Å; T36-T38 VanDerWaalsContact C-N 3.33Å; T36-T38 PolarHBondContact OG1-OG1 3.02Å; T38-L42 HydrophobicContact CG2-CD2 3.75Å; T38-Y61 HydrophobicContact CG2-CE1 4.45Å; T38-Y61 HydrophobicContact CG2-CE2 3.96Å; T38-Y61 WeakPolarHBondContact CG2-OH 3.37Å
39	D	82	Confident	88.4	Confident	33 Å²	33	43.9 Å²	43.9	18%	0.176	23%	0.231	C	C	.	.			trans	-95.7	170.7	175	68.9	45.2	0	0	0	113.3	A41 L42 G43 C254	D39-A41 VanDerWaalsContact C-N 3.33Å; D39-A41 WeakPolarHBondContact OD1-CA 3.14Å; D39-A41 WeakPolarHBondContact OD1-CB 3.24Å; D39-A41 PolarHBondContact OD1-N 2.88Å; D39-L42 PolarHBondContact OD1-N 3.35Å; D39-G43 PolarHBondContact O-N 3.11Å; D39-G43 VanDerWaalsContact O-N 3.16Å; D39-C254 VanDerWaalsContact CG-SG 3.53Å; D39-C254 PolarHBondContact OD2-SG 3.04Å
40	R	85.8	Confident	88.6	Confident	82 Å²	82	45.7 Å²	45.7	31%	0.309	24%	0.238	S	C	.	.	H	α-helix	trans	-70.3	-26.9	-179.8	-64.1	-180	-172.6	167.5	-3.2	112.9	C29 A33 G43 M44 E133	C29-R40 HydrophobicContact CB-CB 4.31Å; A33-R40 HydrophobicContact CB-CG 4.3Å; R40-G43 PolarHBondContact O-N 2.63Å; R40-M44 WeakPolarHBondContact O-CB 3.17Å; R40-M44 PolarHBondContact O-N 3.12Å; R40-E133 IonicContact CZ-OE2 2.69Å; R40-E133 IonicContact NH1-OE2 2.69Å; R40-E133 PolarHBondContact NH1-OE2 3.1Å
41	A	81.3	Confident	88.9	Confident	27 Å²	27	50.6 Å²	50.6	22%	0.223	26%	0.264	C	S	.	.	H	α-helix	trans	-68.4	-40.9	178.8	0	0	0	0	0	110	D39 M44 M45	D39-A41 VanDerWaalsContact C-N 3.33Å; D39-A41 WeakPolarHBondContact OD1-CA 3.14Å; D39-A41 WeakPolarHBondContact OD1-CB 3.24Å; D39-A41 PolarHBondContact OD1-N 2.88Å; A41-M44 WeakPolarHBondContact O-CB 3.5Å; A41-M44 PolarHBondContact O-N 3.34Å; A41-M45 PolarHBondContact O-N 3.36Å; A41-M45 VanDerWaalsContact O-N 3.12Å
42	L	82.5	Confident	89	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-65.7	-42	171.7	-173.8	59.2	0	0	0	112.3	F32 T38 D39 M44 M45 Y46 Y61 M220 E256 Y257	F32-L42 HydrophobicContact CE1-CG 4.43Å; T38-L42 HydrophobicContact CG2-CD2 3.75Å; D39-L42 PolarHBondContact OD1-N 3.35Å; L42-M44 VanDerWaalsContact C-N 3.34Å; L42-M44 PolarHBondContact O-N 2.88Å; L42-M45 HydrophobicContact CD1-CE 3.68Å; L42-M45 HydrophobicContact CD1-SD 4.27Å; L42-M45 PolarHBondContact O-N 2.92Å; L42-Y46 HydrophobicContact CD1-CD2 3.83Å; L42-Y46 HydrophobicContact CD1-CE2 3.79Å; L42-Y46 HydrophobicContact CG-CD2 4.09Å; L42-Y46 HydrophobicContact CG-CE2 4.26Å; L42-Y46 PolarHBondContact O-N 3.27Å; L42-Y61 HydrophobicContact CD2-CD2 4.42Å; L42-Y61 HydrophobicContact CD2-CE2 3.87Å; L42-M220 HydrophobicContact CD1-CE 4.24Å; L42-E256 WeakPolarHBondContact CD2-OE1 3.37Å; L42-Y257 HydrophobicContact CD1-CE2 3.54Å; L42-Y257 VanDerWaalsContact CD1-OH 3.24Å; L42-Y257 WeakPolarHBondContact CD1-OH 3.49Å; L42-Y257 HydrophobicContact CD2-CE2 4.32Å
43	G	86.8	Confident	89	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-58.4	-45.7	174.7	0	0	0	0	0	112.4	D39 R40 M45 Y46 L47	D39-G43 PolarHBondContact O-N 3.11Å; D39-G43 VanDerWaalsContact O-N 3.16Å; R40-G43 PolarHBondContact O-N 2.63Å; G43-M45 VanDerWaalsContact C-N 3.34Å; G43-M45 PolarHBondContact O-N 3.4Å; G43-Y46 PolarHBondContact O-N 3.13Å; G43-L47 VanDerWaalsContact O-CB 3.27Å; G43-L47 WeakPolarHBondContact O-CB 3.49Å; G43-L47 WeakPolarHBondContact O-CD1 3Å; G43-L47 WeakPolarHBondContact O-CG 3.39Å; G43-L47 PolarHBondContact O-N 3.35Å
44	M	88.5	Confident	89.4	Confident	69 Å²	69	54.1 Å²	54.1	34%	0.34	28%	0.278	S	S	.	.	H	α-helix	trans	-55.2	-48.7	175	-173.5	66.7	124.6	0	0	111.4	C29 R40 A41 L42 Y46 L47 Q48 W52	C29-M44 VanDerWaalsContact SG-CA 3.6Å; C29-M44 VanDerWaalsContact SG-SD 3.61Å; R40-M44 WeakPolarHBondContact O-CB 3.17Å; R40-M44 PolarHBondContact O-N 3.12Å; A41-M44 WeakPolarHBondContact O-CB 3.5Å; A41-M44 PolarHBondContact O-N 3.34Å; L42-M44 VanDerWaalsContact C-N 3.34Å; L42-M44 PolarHBondContact O-N 2.88Å; M44-Y46 PolarHBondContact O-N 3.46Å; M44-L47 PolarHBondContact O-N 2.99Å; M44-Q48 HydrophobicContact CG-CG 4.48Å; M44-Q48 WeakPolarHBondContact O-CB 3.21Å; M44-Q48 VanDerWaalsContact O-CG 3.31Å; M44-Q48 WeakPolarHBondContact O-CG 3.46Å; M44-Q48 PolarHBondContact O-N 3.36Å; M44-Q48 HydrophobicContact SD-CG 4.45Å; M44-W52 HydrophobicContact CE-CH2 4.08Å; M44-W52 HydrophobicContact CE-CZ2 4.48Å; M44-W52 HydrophobicContact SD-CH2 3.18Å; M44-W52 WeakPolarHBondContact SD-CH2 3.39Å; M44-W52 HydrophobicContact SD-CZ2 3.66Å; M44-W52 HydrophobicContact SD-CZ3 4.1Å
45	M	89.7	Confident	89.7	Confident	33 Å²	33	57.4 Å²	57.4	16%	0.163	29%	0.294	C	S	.	.	H	α-helix	trans	-61.6	-46.1	179.7	-176.5	-150	75.1	0	0	112.3	A41 L42 G43 K49 V219	A41-M45 PolarHBondContact O-N 3.36Å; A41-M45 VanDerWaalsContact O-N 3.12Å; L42-M45 HydrophobicContact CD1-CE 3.68Å; L42-M45 HydrophobicContact CD1-SD 4.27Å; L42-M45 PolarHBondContact O-N 2.92Å; G43-M45 VanDerWaalsContact C-N 3.34Å; G43-M45 PolarHBondContact O-N 3.4Å; M45-K49 WeakPolarHBondContact O-CB 3.48Å; M45-K49 PolarHBondContact O-N 3Å; M45-K49 VanDerWaalsContact O-N 3.12Å; M45-V219 WeakPolarHBondContact CG-O 3.41Å; M45-V219 HydrophobicContact SD-CB 3.69Å; M45-V219 HydrophobicContact SD-CG2 3.46Å; M45-V219 WeakPolarHBondContact SD-CG2 3.33Å; M45-V219 VanDerWaalsContact SD-O 3.39Å
46	Y	91	Very high	89.8	Confident	17 Å²	17	57.3 Å²	57.3	7%	0.067	29%	0.29	C	S	.	.	H	α-helix	trans	-65.5	-44.6	177.3	-93.9	-95.9	0	0	0	111.5	F32 L42 G43 M44 K49 Y50 A57 K60 Y61	F32-Y46 HydrophobicContact CE1-CD2 4.42Å; F32-Y46 VanDerWaalsContact CE2-CB 3.43Å; F32-Y46 HydrophobicContact CE2-CD1 4.16Å; F32-Y46 HydrophobicContact CE2-CD2 4.44Å; F32-Y46 AromaticContact CE2-CG 3.78Å; F32-Y46 HydrophobicContact CE2-CG 3.78Å; F32-Y46 HydrophobicContact CZ-CD1 4.07Å; F32-Y46 AromaticContact CZ-CD2 3.71Å; F32-Y46 HydrophobicContact CZ-CD2 3.71Å; F32-Y46 HydrophobicContact CZ-CE2 4.48Å; F32-Y46 AromaticContact CZ-CG 3.5Å; F32-Y46 HydrophobicContact CZ-CG 3.5Å; L42-Y46 HydrophobicContact CD1-CD2 3.83Å; L42-Y46 HydrophobicContact CD1-CE2 3.79Å; L42-Y46 HydrophobicContact CG-CD2 4.09Å; L42-Y46 HydrophobicContact CG-CE2 4.26Å; L42-Y46 PolarHBondContact O-N 3.27Å; G43-Y46 PolarHBondContact O-N 3.13Å; M44-Y46 PolarHBondContact O-N 3.46Å; Y46-K49 PolarHBondContact O-N 3.1Å; Y46-Y50 HydrophobicContact CD1-CD2 4.12Å; Y46-Y50 AromaticContact CD1-CE2 3.62Å; Y46-Y50 HydrophobicContact CD1-CE2 3.62Å; Y46-Y50 HydrophobicContact CE1-CE2 4.09Å; Y46-Y50 WeakPolarHBondContact O-CD2 3.32Å; Y46-Y50 PolarHBondContact O-N 3.14Å; Y46-Y50 VanDerWaalsContact O-N 3.08Å; Y46-A57 WeakPolarHBondContact CD1-O 3.47Å; Y46-K60 HydrophobicContact CE1-CB 4.3Å; Y46-Y61 HydrophobicContact CE1-CD2 4.47Å; Y46-Y61 AromaticContact CE2-CD2 3.87Å; Y46-Y61 HydrophobicContact CE2-CD2 3.87Å; Y46-Y61 AromaticContact CZ-CD2 3.86Å
47	L	93.5	Very high	90.2	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-63.3	-47	-179.8	-73.1	162.6	0	0	0	111.2	K28 C29 F32 G43 M44 K49 Y50 N51 W52 L54 A57	K28-L47 HydrophobicContact CB-CD1 3.67Å; K28-L47 HydrophobicContact CB-CD2 4.07Å; K28-L47 HydrophobicContact CD-CD2 4.46Å; K28-L47 WeakPolarHBondContact O-CD1 3.49Å; C29-L47 HydrophobicContact CB-CD1 4.34Å; F32-L47 HydrophobicContact CB-CD1 4.29Å; G43-L47 VanDerWaalsContact O-CB 3.27Å; G43-L47 WeakPolarHBondContact O-CB 3.49Å; G43-L47 WeakPolarHBondContact O-CD1 3Å; G43-L47 WeakPolarHBondContact O-CG 3.39Å; G43-L47 PolarHBondContact O-N 3.35Å; M44-L47 PolarHBondContact O-N 2.99Å; L47-K49 VanDerWaalsContact C-N 3.28Å; L47-K49 PolarHBondContact O-N 2.83Å; L47-Y50 CarbonylContact O-C 3.54Å; L47-Y50 PolarHBondContact O-N 2.61Å; L47-Y50 VanDerWaalsContact O-N 3.15Å; L47-N51 PolarHBondContact O-N 2.9Å; L47-W52 HydrophobicContact CB-CD2 4.01Å; L47-W52 HydrophobicContact CB-CE3 3.58Å; L47-W52 HydrophobicContact CB-CZ3 4Å; L47-W52 HydrophobicContact CD1-CE3 4.02Å; L47-W52 HydrophobicContact CD1-CZ3 3.98Å; L47-W52 HydrophobicContact CD2-CE3 4.42Å; L47-W52 HydrophobicContact CG-CE3 4.22Å; L47-W52 WeakPolarHBondContact O-CA 3.31Å; L47-W52 PolarHBondContact O-N 3.1Å; L47-L54 HydrophobicContact CD2-CB 4.14Å; L47-L54 HydrophobicContact CD2-CD1 4.1Å; L47-A57 HydrophobicContact CD2-CB 4.06Å; L47-A57 HydrophobicContact CG-CB 4.43Å
48	Q	91.5	Very high	90.6	Very high	77 Å²	77	52.2 Å²	52.2	36%	0.36	25%	0.254	S	S	.	.	H	α-helix	trans	-56.3	-43.2	174.5	-76.8	177.5	-23.3	0	0	111.6	M44 Y50 W52 D190	M44-Q48 HydrophobicContact CG-CG 4.48Å; M44-Q48 WeakPolarHBondContact O-CB 3.21Å; M44-Q48 VanDerWaalsContact O-CG 3.31Å; M44-Q48 WeakPolarHBondContact O-CG 3.46Å; M44-Q48 PolarHBondContact O-N 3.36Å; M44-Q48 HydrophobicContact SD-CG 4.45Å; Q48-Y50 VanDerWaalsContact C-N 3.29Å; Q48-Y50 PolarHBondContact O-N 2.89Å; Q48-W52 HydrophobicContact CG-CZ2 4.13Å; Q48-D190 PolarHBondContact NE2-OD2 3.09Å
49	K	90	Very high	91	Very high	148 Å²	148	54.9 Å²	54.9	64%	0.643	27%	0.267	S	S	*	.	H	α-helix	trans	-66	-28.7	-180	-175	171.4	-178	171.9	0	113.8	M45 Y46 L47	M45-K49 WeakPolarHBondContact O-CB 3.48Å; M45-K49 PolarHBondContact O-N 3Å; M45-K49 VanDerWaalsContact O-N 3.12Å; Y46-K49 PolarHBondContact O-N 3.1Å; L47-K49 VanDerWaalsContact C-N 3.28Å; L47-K49 PolarHBondContact O-N 2.83Å
50	Y	93.4	Very high	91.7	Very high	42 Å²	42	57.1 Å²	57.1	17%	0.165	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-114.5	37.5	-176.1	-59.8	-64.4	0	0	0	112.3	Y46 L47 Q48 W52 D53 L56 A57 K60	Y46-Y50 HydrophobicContact CD1-CD2 4.12Å; Y46-Y50 AromaticContact CD1-CE2 3.62Å; Y46-Y50 HydrophobicContact CD1-CE2 3.62Å; Y46-Y50 HydrophobicContact CE1-CE2 4.09Å; Y46-Y50 WeakPolarHBondContact O-CD2 3.32Å; Y46-Y50 PolarHBondContact O-N 3.14Å; Y46-Y50 VanDerWaalsContact O-N 3.08Å; L47-Y50 CarbonylContact O-C 3.54Å; L47-Y50 PolarHBondContact O-N 2.61Å; L47-Y50 VanDerWaalsContact O-N 3.15Å; Q48-Y50 VanDerWaalsContact C-N 3.29Å; Q48-Y50 PolarHBondContact O-N 2.89Å; Y50-W52 PolarHBondContact O-N 2.93Å; Y50-W52 VanDerWaalsContact O-N 3.12Å; Y50-D53 WeakPolarHBondContact O-CB 3.47Å; Y50-D53 PolarHBondContact O-N 3.13Å; Y50-L56 HydrophobicContact CD1-CD2 4.15Å; Y50-L56 HydrophobicContact CD1-CG 4.21Å; Y50-L56 HydrophobicContact CG-CD2 4.41Å; Y50-L56 HydrophobicContact CG-CG 4.26Å; Y50-A57 HydrophobicContact CD2-CB 4.12Å; Y50-K60 HydrophobicContact CD1-CG 4.25Å; Y50-K60 HydrophobicContact CD2-CB 4.24Å; Y50-K60 HydrophobicContact CD2-CG 4.34Å; Y50-K60 HydrophobicContact CE1-CB 4.3Å; Y50-K60 HydrophobicContact CE1-CD 4.1Å; Y50-K60 HydrophobicContact CE1-CG 3.72Å; Y50-K60 HydrophobicContact CE2-CB 3.53Å; Y50-K60 HydrophobicContact CE2-CG 3.85Å; Y50-K60 VanDerWaalsContact CZ-CG 3.49Å
51	N	93.1	Very high	92	Very high	151 Å²	151	54 Å²	54	81%	0.807	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.3	36	175	-65.1	-27.5	0	0	0	113.8	L47 D53	L47-N51 PolarHBondContact O-N 2.9Å; N51-D53 PolarHBondContact O-N 2.86Å; N51-D53 VanDerWaalsContact O-N 3.16Å
52	W	92.7	Very high	92.6	Very high	49 Å²	49	56.9 Å²	56.9	19%	0.186	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	57.9	22.4	-176.8	-65.2	88.5	0	0	0	114.4	F25 K28 M44 L47 Q48 Y50 L54	F25-W52 VanDerWaalsContact CA-CZ3 3.49Å; F25-W52 HydrophobicContact CB-CE3 4.1Å; F25-W52 HydrophobicContact CB-CH2 3.4Å; F25-W52 HydrophobicContact CB-CZ2 4.07Å; F25-W52 HydrophobicContact CB-CZ3 3.46Å; F25-W52 VanDerWaalsContact CB-CZ3 3.46Å; F25-W52 HydrophobicContact CD1-CB 4.34Å; F25-W52 AromaticContact CD1-CD2 3.27Å; F25-W52 HydrophobicContact CD1-CD2 3.27Å; F25-W52 AromaticContact CD1-CE2 3.57Å; F25-W52 AromaticContact CD1-CE3 3.33Å; F25-W52 HydrophobicContact CD1-CE3 3.33Å; F25-W52 AromaticContact CD1-CG 3.78Å; F25-W52 HydrophobicContact CD1-CG 3.78Å; F25-W52 AromaticContact CD1-CH2 3.83Å; F25-W52 HydrophobicContact CD1-CH2 3.83Å; F25-W52 AromaticContact CD1-CZ2 3.84Å; F25-W52 HydrophobicContact CD1-CZ2 3.84Å; F25-W52 AromaticContact CD1-CZ3 3.63Å; F25-W52 HydrophobicContact CD1-CZ3 3.63Å; F25-W52 HydrophobicContact CE1-CB 4.12Å; F25-W52 AromaticContact CE1-CD1 3.92Å; F25-W52 AromaticContact CE1-CD2 3.65Å; F25-W52 HydrophobicContact CE1-CD2 3.65Å; F25-W52 AromaticContact CE1-CE2 3.87Å; F25-W52 HydrophobicContact CE1-CE3 4.15Å; F25-W52 AromaticContact CE1-CG 3.65Å; F25-W52 HydrophobicContact CE1-CG 3.65Å; F25-W52 HydrophobicContact CE1-CZ2 4.47Å; F25-W52 HydrophobicContact CG-CD2 4.2Å; F25-W52 HydrophobicContact CG-CE3 4.09Å; F25-W52 AromaticContact CG-CH2 3.78Å; F25-W52 HydrophobicContact CG-CH2 3.78Å; F25-W52 AromaticContact CG-CZ2 3.96Å; F25-W52 HydrophobicContact CG-CZ2 3.96Å; F25-W52 AromaticContact CG-CZ3 3.89Å; F25-W52 HydrophobicContact CG-CZ3 3.89Å; F25-W52 VanDerWaalsContact O-CZ3 3.28Å; F25-W52 WeakPolarHBondContact O-CZ3 3.2Å; K28-W52 HydrophobicContact CB-CE3 4.37Å; K28-W52 HydrophobicContact CD-CB 4.44Å; K28-W52 HydrophobicContact CD-CE3 4.3Å; K28-W52 WeakPolarHBondContact CD-O 3.43Å; K28-W52 WeakPolarHBondContact CE-O 3.4Å; K28-W52 PolarHBondContact NZ-O 2.92Å; M44-W52 HydrophobicContact CE-CH2 4.08Å; M44-W52 HydrophobicContact CE-CZ2 4.48Å; M44-W52 HydrophobicContact SD-CH2 3.18Å; M44-W52 WeakPolarHBondContact SD-CH2 3.39Å; M44-W52 HydrophobicContact SD-CZ2 3.66Å; M44-W52 HydrophobicContact SD-CZ3 4.1Å; L47-W52 HydrophobicContact CB-CD2 4.01Å; L47-W52 HydrophobicContact CB-CE3 3.58Å; L47-W52 HydrophobicContact CB-CZ3 4Å; L47-W52 HydrophobicContact CD1-CE3 4.02Å; L47-W52 HydrophobicContact CD1-CZ3 3.98Å; L47-W52 HydrophobicContact CD2-CE3 4.42Å; L47-W52 HydrophobicContact CG-CE3 4.22Å; L47-W52 WeakPolarHBondContact O-CA 3.31Å; L47-W52 PolarHBondContact O-N 3.1Å; Q48-W52 HydrophobicContact CG-CZ2 4.13Å; Y50-W52 PolarHBondContact O-N 2.93Å; Y50-W52 VanDerWaalsContact O-N 3.12Å; W52-L54 PolarHBondContact O-N 3.5Å
53	D	95.5	Very high	93	Very high	76 Å²	76	60.9 Å²	60.9	41%	0.406	29%	0.292	S	S	.	.			trans	-78.6	105.8	167.5	-174.4	-31.5	0	0	0	109	Y50 N51 E55 L56 A57	Y50-D53 WeakPolarHBondContact O-CB 3.47Å; Y50-D53 PolarHBondContact O-N 3.13Å; N51-D53 PolarHBondContact O-N 2.86Å; N51-D53 VanDerWaalsContact O-N 3.16Å; D53-E55 PolarHBondContact OD1-N 2.92Å; D53-E55 VanDerWaalsContact OD1-N 3.1Å; D53-L56 HydrophobicContact CB-CB 3.86Å; D53-L56 VanDerWaalsContact CG-CB 3.49Å; D53-L56 PolarHBondContact OD1-N 3.36Å; D53-A57 WeakPolarHBondContact O-CB 3.19Å; D53-A57 PolarHBondContact O-N 3.07Å
54	L	94.7	Very high	93	Very high	35 Å²	35	63.4 Å²	63.4	18%	0.183	31%	0.308	C	S	.	.	H	α-helix	trans	-64.1	-42.8	-176.4	175.2	65.9	0	0	0	112.1	K28 L31 F32 L47 W52 A57 V58	K28-L54 HydrophobicContact CG-CB 4.48Å; L31-L54 HydrophobicContact CB-CD1 4.41Å; L31-L54 HydrophobicContact CB-CD2 3.73Å; L31-L54 HydrophobicContact CD2-CD2 3.44Å; L31-L54 VanDerWaalsContact CD2-CD2 3.44Å; L31-L54 HydrophobicContact CG-CD2 4.17Å; F32-L54 HydrophobicContact CB-CD1 3.69Å; F32-L54 HydrophobicContact CD2-CD1 4.27Å; F32-L54 HydrophobicContact CG-CD1 4.49Å; L47-L54 HydrophobicContact CD2-CB 4.14Å; L47-L54 HydrophobicContact CD2-CD1 4.1Å; W52-L54 PolarHBondContact O-N 3.5Å; L54-A57 PolarHBondContact O-N 3.12Å; L54-V58 HydrophobicContact CD1-CG2 3.96Å; L54-V58 HydrophobicContact CG-CG2 4.43Å; L54-V58 WeakPolarHBondContact O-CB 3.45Å; L54-V58 VanDerWaalsContact O-CG2 3.26Å; L54-V58 WeakPolarHBondContact O-CG2 3.36Å; L54-V58 PolarHBondContact O-N 3.22Å
55	E	95.8	Very high	92.6	Very high	146 Å²	146	62.6 Å²	62.6	68%	0.682	30%	0.303	S	S	*	.	H	α-helix	trans	-68.5	-43.5	-177.1	-173.1	174.8	-176.9	0	0	110.2	D53 V58 N59	D53-E55 PolarHBondContact OD1-N 2.92Å; D53-E55 VanDerWaalsContact OD1-N 3.1Å; E55-V58 PolarHBondContact O-N 3.08Å; E55-N59 VanDerWaalsContact O-CB 3.28Å; E55-N59 WeakPolarHBondContact O-CB 3.22Å; E55-N59 VanDerWaalsContact O-CG 3.28Å; E55-N59 PolarHBondContact O-N 3.08Å; E55-N59 PolarHBondContact O-ND2 3.29Å; E55-N59 VanDerWaalsContact O-ND2 3.16Å
56	L	95.9	Very high	92	Very high	69 Å²	69	67 Å²	67	36%	0.361	32%	0.323	S	S	.	.	H	α-helix	trans	-62.5	-44.4	174.3	-176.8	59.1	0	0	0	111.5	Y50 D53 N59 K60	Y50-L56 HydrophobicContact CD1-CD2 4.15Å; Y50-L56 HydrophobicContact CD1-CG 4.21Å; Y50-L56 HydrophobicContact CG-CD2 4.41Å; Y50-L56 HydrophobicContact CG-CG 4.26Å; D53-L56 HydrophobicContact CB-CB 3.86Å; D53-L56 VanDerWaalsContact CG-CB 3.49Å; D53-L56 PolarHBondContact OD1-N 3.36Å; L56-N59 PolarHBondContact O-N 2.82Å; L56-K60 HydrophobicContact CD1-CG 4.12Å; L56-K60 HydrophobicContact CG-CG 4.41Å; L56-K60 WeakPolarHBondContact O-CB 3.07Å; L56-K60 WeakPolarHBondContact O-CG 3.26Å; L56-K60 PolarHBondContact O-N 3.18Å
57	A	96.2	Very high	91	Very high	0 Å²	0	71.1 Å²	71.1	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-59.1	-49.7	178.1	0	0	0	0	0	111.8	F32 Y46 L47 Y50 D53 L54 K60 Y61	F32-A57 HydrophobicContact CD2-CB 3.95Å; F32-A57 HydrophobicContact CE2-CB 3.83Å; Y46-A57 WeakPolarHBondContact CD1-O 3.47Å; L47-A57 HydrophobicContact CD2-CB 4.06Å; L47-A57 HydrophobicContact CG-CB 4.43Å; Y50-A57 HydrophobicContact CD2-CB 4.12Å; D53-A57 WeakPolarHBondContact O-CB 3.19Å; D53-A57 PolarHBondContact O-N 3.07Å; L54-A57 PolarHBondContact O-N 3.12Å; A57-K60 PolarHBondContact O-N 3.11Å; A57-Y61 PolarHBondContact O-N 3.22Å
58	V	96.4	Very high	89.2	Confident	16 Å²	16	74.9 Å²	74.9	10%	0.097	37%	0.367	C	S	.	.	H	α-helix	trans	-63.2	-45.1	178.3	169.4	0	0	0	0	111.2	F32 T35 T36 L54 E55 K60 Y61 F62	F32-V58 HydrophobicContact CD2-CG2 3.7Å; F32-V58 HydrophobicContact CE2-CG2 4.14Å; F32-V58 HydrophobicContact CG-CG2 4.35Å; T35-V58 HydrophobicContact CG2-CG1 3.7Å; T35-V58 HydrophobicContact CG2-CG2 4.23Å; T36-V58 HydrophobicContact CG2-CG1 4.39Å; T36-V58 HydrophobicContact CG2-CG2 4.29Å; L54-V58 HydrophobicContact CD1-CG2 3.96Å; L54-V58 HydrophobicContact CG-CG2 4.43Å; L54-V58 WeakPolarHBondContact O-CB 3.45Å; L54-V58 VanDerWaalsContact O-CG2 3.26Å; L54-V58 WeakPolarHBondContact O-CG2 3.36Å; L54-V58 PolarHBondContact O-N 3.22Å; E55-V58 PolarHBondContact O-N 3.08Å; V58-K60 VanDerWaalsContact C-N 3.31Å; V58-K60 PolarHBondContact O-N 2.71Å; V58-Y61 WeakPolarHBondContact O-CB 3.4Å; V58-Y61 PolarHBondContact O-N 3.3Å; V58-F62 HydrophobicContact CG1-CD2 3.76Å; V58-F62 HydrophobicContact CG1-CE2 3.51Å; V58-F62 WeakPolarHBondContact O-CD2 3.34Å; V58-F62 PolarHBondContact O-N 3.29Å; V58-F62 VanDerWaalsContact O-N 3.09Å
59	N	95.3	Very high	87.4	Confident	82 Å²	82	74.5 Å²	74.5	44%	0.439	37%	0.372	S	S	.	.	H	α-helix	trans	-60	-42.6	177	-80.1	-33.4	0	0	0	111.7	E55 L56 Y61 F62 L63	E55-N59 VanDerWaalsContact O-CB 3.28Å; E55-N59 WeakPolarHBondContact O-CB 3.22Å; E55-N59 VanDerWaalsContact O-CG 3.28Å; E55-N59 PolarHBondContact O-N 3.08Å; E55-N59 PolarHBondContact O-ND2 3.29Å; E55-N59 VanDerWaalsContact O-ND2 3.16Å; L56-N59 PolarHBondContact O-N 2.82Å; N59-Y61 VanDerWaalsContact C-N 3.35Å; N59-F62 PolarHBondContact O-N 3.02Å; N59-L63 WeakPolarHBondContact O-CB 3.26Å; N59-L63 VanDerWaalsContact O-CG 3.32Å; N59-L63 WeakPolarHBondContact O-CG 3.33Å; N59-L63 PolarHBondContact O-N 3.28Å
60	K	95.1	Very high	85.3	Confident	80 Å²	80	72.4 Å²	72.4	35%	0.348	37%	0.372	S	S	.	.	H	α-helix	trans	-66.5	-35.3	176.9	-70.7	-72.6	-178.6	-173	0	112.4	Y46 Y50 L56 A57 V58 T64	Y46-K60 HydrophobicContact CE1-CB 4.3Å; Y50-K60 HydrophobicContact CD1-CG 4.25Å; Y50-K60 HydrophobicContact CD2-CB 4.24Å; Y50-K60 HydrophobicContact CD2-CG 4.34Å; Y50-K60 HydrophobicContact CE1-CB 4.3Å; Y50-K60 HydrophobicContact CE1-CD 4.1Å; Y50-K60 HydrophobicContact CE1-CG 3.72Å; Y50-K60 HydrophobicContact CE2-CB 3.53Å; Y50-K60 HydrophobicContact CE2-CG 3.85Å; Y50-K60 VanDerWaalsContact CZ-CG 3.49Å; L56-K60 HydrophobicContact CD1-CG 4.12Å; L56-K60 HydrophobicContact CG-CG 4.41Å; L56-K60 WeakPolarHBondContact O-CB 3.07Å; L56-K60 WeakPolarHBondContact O-CG 3.26Å; L56-K60 PolarHBondContact O-N 3.18Å; A57-K60 PolarHBondContact O-N 3.11Å; V58-K60 VanDerWaalsContact C-N 3.31Å; V58-K60 PolarHBondContact O-N 2.71Å; K60-T64 WeakPolarHBondContact O-CB 3.19Å; K60-T64 PolarHBondContact O-N 2.84Å; K60-T64 VanDerWaalsContact O-N 3.11Å; K60-T64 PolarHBondContact O-OG1 3.48Å
61	Y	93.9	Very high	82.9	Confident	16 Å²	16	75.2 Å²	75.2	6%	0.063	40%	0.398	C	S	.	.	H	α-helix	trans	-59.4	-54.5	172.6	175.1	-95.7	0	0	0	111.2	F32 T36 T38 L42 Y46 A57 V58 N59 L63 T64 Q65 E256	F32-Y61 HydrophobicContact CZ-CD2 4.14Å; F32-Y61 HydrophobicContact CZ-CG 4.09Å; T36-Y61 HydrophobicContact CG2-CD1 3.36Å; T36-Y61 HydrophobicContact CG2-CE1 3.85Å; T36-Y61 HydrophobicContact CG2-CG 3.77Å; T38-Y61 HydrophobicContact CG2-CE1 4.45Å; T38-Y61 HydrophobicContact CG2-CE2 3.96Å; T38-Y61 WeakPolarHBondContact CG2-OH 3.37Å; L42-Y61 HydrophobicContact CD2-CD2 4.42Å; L42-Y61 HydrophobicContact CD2-CE2 3.87Å; Y46-Y61 HydrophobicContact CE1-CD2 4.47Å; Y46-Y61 AromaticContact CE2-CD2 3.87Å; Y46-Y61 HydrophobicContact CE2-CD2 3.87Å; Y46-Y61 AromaticContact CZ-CD2 3.86Å; A57-Y61 PolarHBondContact O-N 3.22Å; V58-Y61 WeakPolarHBondContact O-CB 3.4Å; V58-Y61 PolarHBondContact O-N 3.3Å; N59-Y61 VanDerWaalsContact C-N 3.35Å; Y61-L63 PolarHBondContact O-N 3.05Å; Y61-T64 WeakPolarHBondContact O-CB 3.5Å; Y61-T64 PolarHBondContact O-N 2.67Å; Y61-T64 VanDerWaalsContact O-N 3.11Å; Y61-Q65 HydrophobicContact CD1-CG 4.35Å; Y61-Q65 HydrophobicContact CE1-CG 3.9Å; Y61-Q65 HydrophobicContact CE2-CG 4.28Å; Y61-Q65 WeakPolarHBondContact O-CG 3.38Å; Y61-Q65 PolarHBondContact O-N 2.72Å; Y61-Q65 PolarHBondContact OH-NE2 2.92Å; Y61-E256 PolarHBondContact OH-OE1 3.29Å
62	F	93.4	Very high	80.2	Confident	88 Å²	88	76 Å²	76	39%	0.386	39%	0.394	S	S	.	.	H	α-helix	trans	-65.2	-36.6	-178	-72.2	-59.8	0	0	0	113.6	T36 V58 N59 T64 Q65 Q66	T36-F62 HydrophobicContact CG2-CE2 4.42Å; T36-F62 HydrophobicContact CG2-CZ 4.39Å; V58-F62 HydrophobicContact CG1-CD2 3.76Å; V58-F62 HydrophobicContact CG1-CE2 3.51Å; V58-F62 WeakPolarHBondContact O-CD2 3.34Å; V58-F62 PolarHBondContact O-N 3.29Å; V58-F62 VanDerWaalsContact O-N 3.09Å; N59-F62 PolarHBondContact O-N 3.02Å; F62-T64 VanDerWaalsContact C-N 3.3Å; F62-T64 PolarHBondContact O-N 3.17Å; F62-Q65 PolarHBondContact O-N 3.47Å; F62-Q66 WeakPolarHBondContact O-CG 3.46Å; F62-Q66 PolarHBondContact O-N 2.88Å
63	L	90.7	Very high	77.4	Confident	85 Å²	85	82.7 Å²	82.7	45%	0.445	43%	0.425	S	S	.	.	H	α-helix	trans	-59.6	-41.6	172.5	-77.1	165.9	0	0	0	111.8	N59 Y61 Q65 Q66 N67	N59-L63 WeakPolarHBondContact O-CB 3.26Å; N59-L63 VanDerWaalsContact O-CG 3.32Å; N59-L63 WeakPolarHBondContact O-CG 3.33Å; N59-L63 PolarHBondContact O-N 3.28Å; Y61-L63 PolarHBondContact O-N 3.05Å; L63-Q65 VanDerWaalsContact C-N 3.35Å; L63-Q66 PolarHBondContact O-N 3.02Å; L63-N67 PolarHBondContact O-N 3.21Å; L63-N67 VanDerWaalsContact O-N 3.14Å; L63-N67 PolarHBondContact O-ND2 3.48Å
64	T	86.2	Confident	74.4	Confident	53 Å²	53	88.1 Å²	88.1	33%	0.325	45%	0.448	S	S	.	.	H	α-helix	trans	-65	-40.7	177.8	-53.8	0	0	0	0	111	K60 Y61 F62 N67 N68	K60-T64 WeakPolarHBondContact O-CB 3.19Å; K60-T64 PolarHBondContact O-N 2.84Å; K60-T64 VanDerWaalsContact O-N 3.11Å; K60-T64 PolarHBondContact O-OG1 3.48Å; Y61-T64 WeakPolarHBondContact O-CB 3.5Å; Y61-T64 PolarHBondContact O-N 2.67Å; Y61-T64 VanDerWaalsContact O-N 3.11Å; F62-T64 VanDerWaalsContact C-N 3.3Å; F62-T64 PolarHBondContact O-N 3.17Å; T64-N67 PolarHBondContact O-N 3.24Å; T64-N68 PolarHBondContact O-N 2.88Å; T64-N68 VanDerWaalsContact O-N 3.08Å; T64-N68 PolarHBondContact O-ND2 2.96Å
65	Q	80.7	Confident	71.2	Confident	51 Å²	51	95.4 Å²	95.4	24%	0.238	48%	0.478	C	S	.	.	H	α-helix	trans	-68.1	-36.4	177.2	-61	-62.9	37.6	0	0	113.2	Y61 F62 L63 N68 S69	Y61-Q65 HydrophobicContact CD1-CG 4.35Å; Y61-Q65 HydrophobicContact CE1-CG 3.9Å; Y61-Q65 HydrophobicContact CE2-CG 4.28Å; Y61-Q65 WeakPolarHBondContact O-CG 3.38Å; Y61-Q65 PolarHBondContact O-N 2.72Å; Y61-Q65 PolarHBondContact OH-NE2 2.92Å; F62-Q65 PolarHBondContact O-N 3.47Å; L63-Q65 VanDerWaalsContact C-N 3.35Å; Q65-N68 PolarHBondContact O-N 3.02Å; Q65-S69 WeakPolarHBondContact O-CB 3.45Å; Q65-S69 PolarHBondContact O-N 2.87Å; Q65-S69 PolarHBondContact O-OG 2.91Å
66	Q	76.1	Confident	67.9	Low	126 Å²	126	100.4 Å²	100.4	59%	0.589	49%	0.49	S	S	*	.	H	α-helix	trans	-63.2	-42.5	174	-75.2	-177.7	0.2	0	0	111.9	F62 L63 N68 S69 T70	F62-Q66 WeakPolarHBondContact O-CG 3.46Å; F62-Q66 PolarHBondContact O-N 2.88Å; L63-Q66 PolarHBondContact O-N 3.02Å; Q66-N68 VanDerWaalsContact C-N 3.32Å; Q66-N68 PolarHBondContact O-N 3.45Å; Q66-S69 WeakPolarHBondContact O-CB 3.29Å; Q66-S69 PolarHBondContact O-N 2.76Å; Q66-S69 VanDerWaalsContact O-N 3.11Å; Q66-T70 PolarHBondContact O-N 2.91Å; Q66-T70 VanDerWaalsContact O-N 3.13Å; Q66-T70 PolarHBondContact O-OG1 2.97Å
67	N	69.9	Low	64.4	Low	104 Å²	104	107.2 Å²	107.2	56%	0.556	52%	0.517	S	S	*	.	H	α-helix	trans	-66.3	-33.1	177.6	-69.6	-18.6	0	0	0	112.8	L63 T64 S69 T70 S71	L63-N67 PolarHBondContact O-N 3.21Å; L63-N67 VanDerWaalsContact O-N 3.14Å; L63-N67 PolarHBondContact O-ND2 3.48Å; T64-N67 PolarHBondContact O-N 3.24Å; N67-S69 VanDerWaalsContact C-N 3.33Å; N67-T70 PolarHBondContact O-OG1 3.4Å; N67-S71 PolarHBondContact O-OG 2.88Å
68	N	56.5	Low	61.1	Low	79 Å²	79	118.9 Å²	118.9	42%	0.422	56%	0.561	S	S	.	*	H	α-helix	trans	-73.1	-26.7	173.5	-74.3	-22.2	0	0	0	112.6	T64 Q65 Q66	T64-N68 PolarHBondContact O-N 2.88Å; T64-N68 VanDerWaalsContact O-N 3.08Å; T64-N68 PolarHBondContact O-ND2 2.96Å; Q65-N68 PolarHBondContact O-N 3.02Å; Q66-N68 VanDerWaalsContact C-N 3.32Å; Q66-N68 PolarHBondContact O-N 3.45Å
69	S	53	Low	57.7	Low	68 Å²	68	124.5 Å²	124.5	48%	0.476	60%	0.596	S	S	.	*	H	α-helix	trans	-78.2	-34.9	-179.9	-56.9	0	0	0	0	112.8	Q65 Q66 N67 S71 K72	Q65-S69 WeakPolarHBondContact O-CB 3.45Å; Q65-S69 PolarHBondContact O-N 2.87Å; Q65-S69 PolarHBondContact O-OG 2.91Å; Q66-S69 WeakPolarHBondContact O-CB 3.29Å; Q66-S69 PolarHBondContact O-N 2.76Å; Q66-S69 VanDerWaalsContact O-N 3.11Å; N67-S69 VanDerWaalsContact C-N 3.33Å; S69-S71 VanDerWaalsContact C-N 3.27Å; S69-S71 PolarHBondContact O-N 2.85Å; S69-K72 PolarHBondContact O-N 2.8Å
70	T	46.5	Very low	54.3	Low	105 Å²	105	131.6 Å²	131.6	64%	0.644	62%	0.618	S	S	*	*	H	α-helix	trans	-67.9	-28	175.2	44.1	0	0	0	0	112.3	Q66 N67	Q66-T70 PolarHBondContact O-N 2.91Å; Q66-T70 VanDerWaalsContact O-N 3.13Å; Q66-T70 PolarHBondContact O-OG1 2.97Å; N67-T70 PolarHBondContact O-OG1 3.4Å
71	S	42.6	Very low	51	Low	101 Å²	101	136.1 Å²	136.1	71%	0.706	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.9	-17.8	177.2	-56.2	0	0	0	0	114.1	N67 S69	N67-S71 PolarHBondContact O-OG 2.88Å; S69-S71 VanDerWaalsContact C-N 3.27Å; S69-S71 PolarHBondContact O-N 2.85Å
72	K	36.9	Very low	47.7	Very low	166 Å²	166	144.2 Å²	144.2	72%	0.722	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.6	-2.9	-173.6	-74.1	179.5	-178.8	173.9	0	115.3	S69 Q74	S69-K72 PolarHBondContact O-N 2.8Å; K72-Q74 PolarHBondContact O-N 2.84Å; K72-Q74 VanDerWaalsContact O-N 3.12Å
73	K	33.6	Very low	44.6	Very low	190 Å²	190	145.5 Å²	145.5	83%	0.826	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.7	3	-175.6	-89.8	-176.6	177.3	177.7	0	116.5
74	Q	32	Very low	41.4	Very low	191 Å²	191	148.9 Å²	148.9	89%	0.893	72%	0.717	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.5	-1.1	-179.7	-83.7	-174.5	-7	0	0	116.7	K72	K72-Q74 PolarHBondContact O-N 2.84Å; K72-Q74 VanDerWaalsContact O-N 3.12Å
75	K	27.6	Very low	38.6	Very low	188 Å²	188	155.4 Å²	155.4	82%	0.817	74%	0.744	S	S	*	*	S	Bend	trans	-141.2	92	179.4	-96.6	179	175.4	173.4	0	112
76	R	27.1	Very low	36.1	Very low	251 Å²	251	161.9 Å²	161.9	95%	0.947	77%	0.774	S	S	*	*			trans	162.7	98.3	131.3	-90.9	169.7	150.9	169.3	-6.7	111.3
77	K	23.3	Very low	33.9	Very low	212 Å²	212	161.2 Å²	161.2	92%	0.922	78%	0.781	S	S	*	*			trans	-109.2	106.1	148.2	-124.8	-176.7	-177.2	-178.5	0	105.1
78	R	27.1	Very low	31.8	Very low	244 Å²	244	164 Å²	164	92%	0.921	79%	0.794	S	S	*	*			trans	-161.2	112.1	156.3	-108.6	172.2	-170.6	-165.2	1.3	109.2
79	T	23.7	Very low	30.5	Very low	134 Å²	134	166.2 Å²	166.2	82%	0.822	81%	0.81	S	S	*	*			trans	-53.4	140.6	174.1	-35.2	0	0	0	0	110.9
80	Y	24.2	Very low	29.5	Very low	231 Å²	231	169.5 Å²	169.5	91%	0.906	82%	0.821	S	S	*	*			trans	-116.6	116.9	166.6	-128.4	-93.1	0	0	0	107.4
81	E	26.3	Very low	28.9	Very low	176 Å²	176	169.9 Å²	169.9	82%	0.822	82%	0.819	S	S	*	*			trans	-77.5	147.7	173.1	-76.5	174.6	156.4	0	0	110.3
82	Q	24.3	Very low	28.3	Very low	186 Å²	186	172.8 Å²	172.8	87%	0.869	83%	0.826	S	S	*	*			trans	-60	133.1	178.2	-79.6	164.2	-40.5	0	0	111.8
83	S	28.2	Very low	27.9	Very low	115 Å²	115	169.8 Å²	169.8	80%	0.804	82%	0.821	S	S	*	*			trans	-120.8	122.9	149.7	43.7	0	0	0	0	108.4
84	N	23.9	Very low	28	Very low	155 Å²	155	168.6 Å²	168.6	83%	0.829	82%	0.824	S	S	*	*			trans	-84.1	107.8	173.4	-84	-25.2	0	0	0	108
85	E	28.2	Very low	28.1	Very low	191 Å²	191	164.2 Å²	164.2	89%	0.893	82%	0.815	S	S	*	*			trans	-131.2	117.1	157.2	-75.6	-173.3	164.8	0	0	108.2
86	Q	27.8	Very low	28.3	Very low	186 Å²	186	161.8 Å²	161.8	87%	0.869	81%	0.811	S	S	*	*			trans	-75.6	137.6	175.3	-71.7	-171.4	-18.6	0	0	109.5
87	P	28.7	Very low	28.5	Very low	113 Å²	113	157.2 Å²	157.2	73%	0.734	81%	0.805	S	S	*	*			trans	-74.4	133.4	174.3	29.6	-30.4	0	0	0	110.2	V89	P87-V89 PolarHBondContact O-N 2.81Å
88	I	26.8	Very low	28.7	Very low	161 Å²	161	152.3 Å²	152.3	83%	0.826	80%	0.798	S	S	*	*			trans	-65.6	115.4	172.3	-63.4	168.6	0	0	0	108.2	I90	I88-I90 HydrophobicContact CG2-CG1 4.39Å
89	V	29.4	Very low	28.9	Very low	126 Å²	126	146.7 Å²	146.7	76%	0.764	79%	0.794	S	S	*	*			trans	-88.1	116	172.4	178.2	0	0	0	0	107.9	P87	P87-V89 PolarHBondContact O-N 2.81Å
90	I	31.9	Very low	29.1	Very low	138 Å²	138	147.3 Å²	147.3	71%	0.708	79%	0.793	S	S	*	*			trans	-90.6	108	168.6	-61.3	171.9	0	0	0	106.9	I88 L92	I88-I90 HydrophobicContact CG2-CG1 4.39Å; I90-L92 HydrophobicContact CG2-CD2 4.29Å; I90-L92 HydrophobicContact CG2-CG 4.28Å
91	D	33.2	Very low	29.3	Very low	113 Å²	113	143.1 Å²	143.1	60%	0.604	79%	0.786	S	S	*	*			trans	-84.5	116.1	173.5	-175.2	-7.1	0	0	0	109.1	T93	D91-T93 PolarHBondContact OD1-N 2.9Å; D91-T93 PolarHBondContact OD1-OG1 2.78Å
92	L	31.3	Very low	29.5	Very low	161 Å²	161	140.8 Å²	140.8	84%	0.843	78%	0.784	S	S	*	*			trans	-99.4	23.7	178.6	-71.9	173.6	0	0	0	112.6	I90	I90-L92 HydrophobicContact CG2-CD2 4.29Å; I90-L92 HydrophobicContact CG2-CG 4.28Å
93	T	28.4	Very low	30	Very low	103 Å²	103	140.7 Å²	140.7	63%	0.632	79%	0.788	S	S	*	*			trans	-115.6	77.3	176.6	58.9	0	0	0	0	111.4	D91	D91-T93 PolarHBondContact OD1-N 2.9Å; D91-T93 PolarHBondContact OD1-OG1 2.78Å
94	N	35.2	Very low	30.1	Very low	166 Å²	166	139 Å²	139	89%	0.888	78%	0.782	S	S	*	*			trans	-162.7	118.1	145.3	-86.4	-34.8	0	0	0	109.6
95	S	33.9	Very low	30.3	Very low	99 Å²	99	138.8 Å²	138.8	69%	0.692	78%	0.78	S	S	*	*			trans	-84.1	154.9	167.3	50.4	0	0	0	0	110.7
96	D	30.9	Very low	30.6	Very low	137 Å²	137	138.4 Å²	138.4	73%	0.733	78%	0.778	S	S	*	*			trans	84.8	98.3	161	-48.9	-27.7	0	0	0	117.4
97	D	31.8	Very low	30.6	Very low	154 Å²	154	135.9 Å²	135.9	82%	0.824	78%	0.776	S	S	*	*				160.4	133.3	92	-95.2	-27.2	0	0	0	113.8
98	S	27.9	Very low	30.8	Very low	110 Å²	110	135.9 Å²	135.9	77%	0.769	77%	0.774	S	S	*	*			trans	52.1	107	146.7	-167.1	0	0	0	0	121.2
99	C	30.7	Very low	31.1	Very low	125 Å²	125	133 Å²	133	85%	0.845	77%	0.768	S	S	*	*			trans	-152.7	110.9	130.7	58.3	0	0	0	0	112.7
100	N	27.6	Very low	31.2	Very low	148 Å²	148	133.3 Å²	133.3	79%	0.791	77%	0.77	S	S	*	*			trans	-69.3	128.2	158.8	-78.7	-28.7	0	0	0	109.8
101	N	29.8	Very low	31.3	Very low	142 Å²	142	132.7 Å²	132.7	76%	0.759	77%	0.773	S	S	*	*				167.6	137	112.1	-91	-21.4	0	0	0	113.8
102	T	28.9	Very low	31.5	Very low	127 Å²	127	130.4 Å²	130.4	78%	0.779	78%	0.776	S	S	*	*			trans	63.7	89.5	147.2	44.8	0	0	0	0	119.2
103	L	35.6	Very low	31.7	Very low	184 Å²	184	129.2 Å²	129.2	96%	0.963	78%	0.775	S	S	*	*			trans	-136	94.2	135.3	-94	157.8	0	0	0	107.7
104	A	29.5	Very low	32.5	Very low	81 Å²	81	130.9 Å²	130.9	67%	0.669	78%	0.776	S	S	*	*			trans	-73.5	149.3	166.7	0	0	0	0	0	109.8
105	D	29.5	Very low	33.1	Very low	149 Å²	149	126.3 Å²	126.3	80%	0.797	76%	0.757	S	S	*	*			trans	64.2	69.3	161.7	-61.9	-17.5	0	0	0	118.3
106	Q	33.8	Very low	33.9	Very low	183 Å²	183	128.3 Å²	128.3	86%	0.855	76%	0.758	S	S	*	*			trans	-129.4	89.7	136.4	-74.8	-172.9	25.5	0	0	109.4	V108	Q106-V108 VanDerWaalsContact C-N 3.27Å; Q106-V108 PolarHBondContact O-N 2.92Å
107	T	27.7	Very low	34.9	Very low	134 Å²	134	130.7 Å²	130.7	82%	0.822	77%	0.765	S	S	*	*			trans	-63.7	89.7	162.5	44.9	0	0	0	0	108.8	S109	T107-S109 PolarHBondContact O-N 3.14Å
108	V	34	Very low	36.8	Very low	113 Å²	113	126.7 Å²	126.7	69%	0.685	75%	0.749	S	S	*	*			trans	-68.5	113.2	160.6	177.6	0	0	0	0	106.2	Q106 T110	Q106-V108 VanDerWaalsContact C-N 3.27Å; Q106-V108 PolarHBondContact O-N 2.92Å; V108-T110 PolarHBondContact O-N 3Å
109	S	32.7	Very low	39.3	Very low	100 Å²	100	124.3 Å²	124.3	70%	0.699	73%	0.727	S	S	*	*			trans	-55.8	99.4	169	-82	0	0	0	0	109.7	T107 T111	T107-S109 PolarHBondContact O-N 3.14Å; S109-T111 PolarHBondContact O-N 3.07Å
110	T	30.8	Very low	42.2	Very low	132 Å²	132	119.7 Å²	119.7	81%	0.81	70%	0.696	S	S	*	*			trans	-74.8	67.6	164.1	8.7	0	0	0	0	108.8	V108 G112	V108-T110 PolarHBondContact O-N 3Å; T110-G112 PolarHBondContact O-N 2.82Å
111	T	33.4	Very low	45.4	Very low	126 Å²	126	114.2 Å²	114.2	77%	0.773	67%	0.666	S	S	*	*			trans	-75.9	103.6	163.8	47.8	0	0	0	0	108.1	S109	S109-T111 PolarHBondContact O-N 3.07Å
112	G	38.1	Very low	48.6	Very low	64 Å²	64	107.4 Å²	107.4	66%	0.66	63%	0.63	S	S	*	*			trans	79.4	86.6	163.7	0	0	0	0	0	115.2	T110 E114	T110-G112 PolarHBondContact O-N 2.82Å; G112-E114 PolarHBondContact O-N 2.82Å
113	T	36.1	Very low	51.9	Low	136 Å²	136	102.9 Å²	102.9	83%	0.834	60%	0.601	S	S	*	*			trans	-66.2	81.3	147	31.7	0	0	0	0	107.8	S115	T113-S115 PolarHBondContact O-N 3.39Å
114	E	44.6	Very low	54.9	Low	139 Å²	139	94.1 Å²	94.1	65%	0.65	56%	0.555	S	S	*	*			trans	-54.2	124.2	151.8	-74.3	-174.8	173.7	0	0	106	G112 I116	G112-E114 PolarHBondContact O-N 2.82Å; E114-I116 PolarHBondContact O-N 2.73Å
115	S	48.5	Very low	58.2	Low	69 Å²	69	90.2 Å²	90.2	48%	0.483	52%	0.523	S	S	.	.			trans	-57.6	136.2	175.7	52.1	0	0	0	0	107.4	T113 E117 S118	T113-S115 PolarHBondContact O-N 3.39Å; S115-E117 PolarHBondContact O-N 3.07Å; S115-S118 PolarHBondContact O-N 3.09Å; S115-S118 PolarHBondContact O-OG 3.29Å
116	I	50.3	Low	61.5	Low	141 Å²	141	83.1 Å²	83.1	72%	0.723	49%	0.485	S	S	*	.	G	3₁₀ helix	trans	-52.4	-26.7	178.3	-67.6	170.2	0	0	0	111.1	E114 S118 L119	E114-I116 PolarHBondContact O-N 2.73Å; I116-S118 VanDerWaalsContact C-N 3.28Å; I116-S118 PolarHBondContact O-N 3.21Å; I116-L119 HydrophobicContact CG2-CD1 4.43Å; I116-L119 WeakPolarHBondContact O-CB 3.44Å; I116-L119 PolarHBondContact O-N 2.97Å
117	E	52.6	Low	64.6	Low	188 Å²	188	74.4 Å²	74.4	88%	0.879	44%	0.444	S	S	*	.	G	3₁₀ helix	trans	-62.8	-23.3	174.2	-68.4	-177.4	165.1	0	0	114.9	S115	S115-E117 PolarHBondContact O-N 3.07Å
118	S	70.3	Confident	68	Low	69 Å²	69	68 Å²	68	48%	0.483	41%	0.405	S	S	.	.	G	3₁₀ helix	trans	-90.8	-3.6	176.4	69.4	0	0	0	0	113.8	S115 I116	S115-S118 PolarHBondContact O-N 3.09Å; S115-S118 PolarHBondContact O-OG 3.29Å; I116-S118 VanDerWaalsContact C-N 3.28Å; I116-S118 PolarHBondContact O-N 3.21Å
119	L	81.5	Confident	71.1	Confident	60 Å²	60	62.8 Å²	62.8	31%	0.314	37%	0.373	S	S	.	.	S	Bend	trans	-71.1	137.9	177.8	-67.9	174.2	0	0	0	109.9	I116 I121 L396	I116-L119 HydrophobicContact CG2-CD1 4.43Å; I116-L119 WeakPolarHBondContact O-CB 3.44Å; I116-L119 PolarHBondContact O-N 2.97Å; L119-I121 HydrophobicContact CB-CD1 4.39Å; L119-I121 HydrophobicContact CB-CG1 3.87Å; L119-I121 PolarHBondContact O-N 2.9Å; L119-L396 HydrophobicContact CB-CD1 4.08Å; L119-L396 HydrophobicContact CD2-CD1 4.32Å
120	P	91.4	Very high	74.2	Confident	29 Å²	29	59 Å²	59	19%	0.188	34%	0.344	C	S	.	.			trans	-73.2	80.8	178.7	32.1	-37.5	0	0	0	110.1	F234 L396 L397	P120-F234 HydrophobicContact CB-CB 4.07Å; P120-F234 HydrophobicContact CB-CD1 4.43Å; P120-F234 VanDerWaalsContact CB-O 3.24Å; P120-F234 WeakPolarHBondContact CB-O 3.34Å; P120-L396 HydrophobicContact CG-CD1 4.21Å; P120-L397 HydrophobicContact CB-CB 4.2Å; P120-L397 HydrophobicContact CG-CB 4.41Å; P120-L397 VanDerWaalsContact CG-O 3.25Å; P120-L397 WeakPolarHBondContact CG-O 3.18Å; P120-L397 WeakPolarHBondContact O-CB 3.34Å; P120-L397 WeakPolarHBondContact O-CG 3.48Å; P120-L397 PolarHBondContact O-N 3.47Å
121	I	94.3	Very high	77.4	Confident	32 Å²	32	52.7 Å²	52.7	16%	0.164	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	127.2	-176.1	-61.9	-76.6	0	0	0	109.9	L119 H154 V368 R394 F395 L396	L119-I121 HydrophobicContact CB-CD1 4.39Å; L119-I121 HydrophobicContact CB-CG1 3.87Å; L119-I121 PolarHBondContact O-N 2.9Å; I121-H154 PolarHBondContact O-CE1 3.01Å; I121-H154 VanDerWaalsContact O-CE1 3.29Å; I121-V368 HydrophobicContact CD1-CG2 3.86Å; I121-R394 HydrophobicContact CG2-CB 4.19Å; I121-F395 CarbonylContact C-O 3.55Å; I121-F395 VanDerWaalsContact CA-O 3.29Å; I121-F395 WeakPolarHBondContact CA-O 3.37Å; I121-L396 HydrophobicContact CD1-CB 3.95Å; I121-L396 HydrophobicContact CD1-CD1 3.95Å
122	I	97.1	Very high	80.4	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	137.1	165.2	-167.5	167.1	0	0	0	110.2	H154 V155 L231 L244 I365 F395 L397	I122-H154 HydrophobicContact CD1-CB 4.32Å; I122-H154 HydrophobicContact CG1-CB 3.67Å; I122-V155 HydrophobicContact CD1-CG2 4.43Å; I122-L231 HydrophobicContact CD1-CD1 3.55Å; I122-L231 HydrophobicContact CD1-CD2 4.02Å; I122-L231 HydrophobicContact CD1-CG 4.45Å; I122-L244 HydrophobicContact CD1-CD2 4.01Å; I122-I365 HydrophobicContact CG2-CD1 4.36Å; I122-F395 HydrophobicContact CG2-CB 3.74Å; I122-F395 HydrophobicContact CG2-CD2 4.28Å; I122-F395 HydrophobicContact CG2-CG 4.39Å; I122-F395 PolarHBondContact N-O 2.77Å; I122-F395 PolarHBondContact O-N 2.71Å; I122-L397 HydrophobicContact CB-CD1 4.49Å; I122-L397 HydrophobicContact CG2-CD2 3.78Å; I122-L397 HydrophobicContact CG2-CG 4.34Å
123	N	98.2	Very high	83.1	Confident	31 Å²	31	47.4 Å²	47.4	17%	0.166	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	118	-176	-69.2	-41.5	0	0	0	107.8	F153 H154 V155 L392 R394	N123-F153 HydrophobicContact CB-CD1 4.44Å; N123-H154 PolarHBondContact N-ND1 2.77Å; N123-H154 WeakPolarHBondContact O-CB 3.24Å; N123-H154 PolarHBondContact O-N 3.33Å; N123-V155 PolarHBondContact O-N 3.05Å; N123-V155 VanDerWaalsContact O-N 3.14Å; N123-L392 HydrophobicContact CB-CD1 4.16Å; N123-R394 WeakPolarHBondContact OD1-CG 3.4Å
124	V	98.9	Very high	86	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	120	-179.1	-174.9	0	0	0	0	108.7	V155 I292 M358 L392 G393 F395	V124-V155 WeakPolarHBondContact CA-O 3.45Å; V124-V155 HydrophobicContact CG1-CB 4.21Å; V124-V155 HydrophobicContact CG1-CG1 4.26Å; V124-V155 HydrophobicContact CG2-CB 4.25Å; V124-I292 HydrophobicContact CG1-CG2 4.45Å; V124-I292 HydrophobicContact CG2-CD1 3.95Å; V124-M358 HydrophobicContact CB-CE 4.06Å; V124-M358 HydrophobicContact CB-SD 4.47Å; V124-M358 HydrophobicContact CG1-CE 3.84Å; V124-M358 WeakPolarHBondContact O-CE 3.26Å; V124-L392 WeakPolarHBondContact O-CA 3.33Å; V124-G393 PolarHBondContact N-O 2.95Å; V124-G393 PolarHBondContact O-N 3.16Å; V124-F395 HydrophobicContact CB-CE2 4.14Å; V124-F395 HydrophobicContact CG2-CD2 4.21Å; V124-F395 HydrophobicContact CG2-CE2 3.98Å
125	L	98.9	Very high	88.4	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	139.7	172.8	-169.8	80	0	0	0	109.6	W127 I148 F153 V155 V156 C157 R373 A390 I391 L392	L125-W127 HydrophobicContact CD2-CE3 4.4Å; L125-I148 HydrophobicContact CD2-CG1 4.46Å; L125-F153 HydrophobicContact CB-CB 4.32Å; L125-F153 HydrophobicContact CB-CD1 4.21Å; L125-F153 HydrophobicContact CB-CD2 4.01Å; L125-F153 HydrophobicContact CB-CE2 4.38Å; L125-F153 HydrophobicContact CB-CG 3.9Å; L125-F153 HydrophobicContact CD1-CE1 4.09Å; L125-F153 HydrophobicContact CD1-CE2 4.06Å; L125-F153 HydrophobicContact CD1-CZ 3.81Å; L125-F153 HydrophobicContact CD2-CD2 3.82Å; L125-F153 HydrophobicContact CD2-CE2 3.66Å; L125-F153 HydrophobicContact CD2-CZ 4.28Å; L125-F153 HydrophobicContact CG-CD2 4.33Å; L125-F153 HydrophobicContact CG-CE2 4.25Å; L125-F153 HydrophobicContact CG-CZ 4.47Å; L125-V155 PolarHBondContact N-O 2.88Å; L125-V156 HydrophobicContact CB-CG1 4.32Å; L125-V156 HydrophobicContact CB-CG2 4.24Å; L125-V156 HydrophobicContact CD2-CG1 3.96Å; L125-V156 CarbonylContact O-C 3.59Å; L125-V156 WeakPolarHBondContact O-CA 3.24Å; L125-C157 PolarHBondContact O-N 3.5Å; L125-R373 HydrophobicContact CD1-CB 4.31Å; L125-R373 HydrophobicContact CD1-CG 4.26Å; L125-A390 HydrophobicContact CD1-CB 3.86Å; L125-A390 HydrophobicContact CD2-CB 4.5Å; L125-A390 HydrophobicContact CG-CB 4.27Å; L125-I391 CarbonylContact C-O 3.46Å; L125-I391 WeakPolarHBondContact CA-O 3.14Å; L125-L392 HydrophobicContact CD1-CB 4.25Å
126	S	99	Very high	90.6	Very high	0 Å²	0	41 Å²	41	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	137.4	162.3	-174.9	0	0	0	0	110.9	C157 Q159 G295 A390 I391	S126-C157 CarbonylContact C-O 3.58Å; S126-C157 VanDerWaalsContact CA-O 3.23Å; S126-C157 WeakPolarHBondContact CA-O 3.43Å; S126-Q159 PolarHBondContact OG-NE2 3.31Å; S126-Q159 PolarHBondContact OG-OE1 3.38Å; S126-G295 VanDerWaalsContact OG-CA 3.23Å; S126-G295 WeakPolarHBondContact OG-CA 3.43Å; S126-G295 PolarHBondContact OG-N 3.16Å; S126-A390 CarbonylContact O-C 3.54Å; S126-A390 VanDerWaalsContact O-CA 3.29Å; S126-A390 WeakPolarHBondContact O-CA 3.35Å; S126-I391 PolarHBondContact N-O 2.95Å; S126-I391 PolarHBondContact O-N 3.42Å
127	W	98.9	Very high	92.9	Very high	0 Å²	0	35 Å²	35	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	117.8	-179.6	-159.4	0.6	0	0	0	112.8	L125 I129 V144 T147 C157 L158 Q159 P385 H388 A390	L125-W127 HydrophobicContact CD2-CE3 4.4Å; W127-I129 HydrophobicContact CB-CG2 4.2Å; W127-I129 HydrophobicContact CD2-CG2 4.1Å; W127-I129 HydrophobicContact CE3-CG2 4.43Å; W127-I129 HydrophobicContact CG-CG2 3.99Å; W127-I129 PolarHBondContact O-N 3.06Å; W127-V144 HydrophobicContact CE3-CB 4.44Å; W127-V144 HydrophobicContact CE3-CG1 3.88Å; W127-V144 HydrophobicContact CE3-CG2 4.12Å; W127-V144 HydrophobicContact CH2-CG2 3.89Å; W127-V144 HydrophobicContact CZ2-CG2 4.37Å; W127-V144 HydrophobicContact CZ3-CB 4.03Å; W127-V144 HydrophobicContact CZ3-CG1 3.9Å; W127-V144 HydrophobicContact CZ3-CG2 3.76Å; W127-T147 HydrophobicContact CZ3-CG2 4.49Å; W127-C157 PolarHBondContact N-O 3.38Å; W127-L158 HydrophobicContact CB-CD2 3.97Å; W127-L158 WeakPolarHBondContact O-CA 3.45Å; W127-Q159 PolarHBondContact O-N 3.46Å; W127-Q159 PolarHBondContact O-OE1 3.41Å; W127-P385 HydrophobicContact CH2-CB 3.65Å; W127-P385 HydrophobicContact CH2-CG 3.83Å; W127-P385 HydrophobicContact CZ2-CB 3.57Å; W127-P385 HydrophobicContact CZ2-CG 3.93Å; W127-H388 PolarHBondContact NE1-O 3.24Å; W127-A390 HydrophobicContact CB-CB 3.73Å; W127-A390 HydrophobicContact CD2-CB 3.5Å; W127-A390 HydrophobicContact CE3-CB 3.88Å; W127-A390 HydrophobicContact CG-CB 3.44Å; W127-A390 VanDerWaalsContact CG-CB 3.44Å
128	N	98.9	Very high	95	Very high	0 Å²	0	31 Å²	31	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	110.5	157.9	-176.9	-21.4	0	0	0	108.3	Q130 Q159 E160 D296 S386 H388	N128-Q130 VanDerWaalsContact C-N 3.31Å; N128-Q130 PolarHBondContact OD1-N 3.14Å; N128-Q159 HydrophobicContact CB-CB 4.12Å; N128-Q159 VanDerWaalsContact N-OE1 3.07Å; N128-E160 PolarHBondContact ND2-OE1 2.81Å; N128-E160 WeakPolarHBondContact OD1-CB 3.06Å; N128-E160 VanDerWaalsContact OD1-CD 3.26Å; N128-E160 VanDerWaalsContact OD1-CG 3.3Å; N128-E160 WeakPolarHBondContact OD1-CG 3.21Å; N128-E160 PolarHBondContact OD1-OE1 3.08Å; N128-D296 HydrophobicContact CB-CB 4.03Å; N128-D296 PolarHBondContact ND2-OD2 2.79Å; N128-S386 VanDerWaalsContact O-CB 3.29Å; N128-S386 WeakPolarHBondContact O-CB 3.39Å; N128-S386 PolarHBondContact O-OG 3.38Å; N128-H388 HydrophobicContact CB-CB 4.16Å
129	I	98.7	Very high	96.3	Very high	2 Å²	2	33.3 Å²	33.3	1%	0.01	18%	0.177	C	C	.	.			trans	-89.6	1.3	-174.2	54.7	154.1	0	0	0	113.1	W127 G131 M141 V144 L158 Q159 V161 C165	W127-I129 HydrophobicContact CB-CG2 4.2Å; W127-I129 HydrophobicContact CD2-CG2 4.1Å; W127-I129 HydrophobicContact CE3-CG2 4.43Å; W127-I129 HydrophobicContact CG-CG2 3.99Å; W127-I129 PolarHBondContact O-N 3.06Å; I129-G131 VanDerWaalsContact C-N 3.32Å; I129-G131 PolarHBondContact O-N 3.27Å; I129-M141 HydrophobicContact CD1-CE 3.92Å; I129-M141 HydrophobicContact CD1-SD 3.51Å; I129-M141 VanDerWaalsContact CD1-SD 3.51Å; I129-V144 HydrophobicContact CG2-CG1 3.97Å; I129-V144 HydrophobicContact CG2-CG2 4.03Å; I129-L158 HydrophobicContact CG2-CD2 3.85Å; I129-Q159 WeakPolarHBondContact CG1-O 3.22Å; I129-Q159 PolarHBondContact N-O 2.87Å; I129-V161 HydrophobicContact CD1-CB 4.5Å; I129-V161 HydrophobicContact CD1-CG2 3.96Å; I129-V161 HydrophobicContact CG1-CG2 4.3Å; I129-C165 HydrophobicContact CD1-CB 4.15Å
130	Q	97.6	Very high	97.1	Very high	21 Å²	21	30.7 Å²	30.7	10%	0.098	16%	0.163	C	C	.	.			trans	53.9	46	176.5	-162.1	-168.5	26.5	0	0	112.4	N128 L132 E133 R140 E160 S386 D387	N128-Q130 VanDerWaalsContact C-N 3.31Å; N128-Q130 PolarHBondContact OD1-N 3.14Å; Q130-L132 PolarHBondContact O-N 3.5Å; Q130-L132 VanDerWaalsContact O-N 3.16Å; Q130-E133 HydrophobicContact CG-CB 3.89Å; Q130-E133 PolarHBondContact O-N 2.85Å; Q130-R140 PolarHBondContact O-NH2 3.19Å; Q130-R140 VanDerWaalsContact OE1-NH1 3.07Å; Q130-E160 WeakPolarHBondContact CA-OE2 3.24Å; Q130-S386 WeakPolarHBondContact CB-OG 3.27Å; Q130-D387 WeakPolarHBondContact CB-OD1 3.46Å; Q130-D387 VanDerWaalsContact CD-CG 3.41Å; Q130-D387 WeakPolarHBondContact CG-OD1 3.28Å; Q130-D387 PolarHBondContact NE2-OD1 3.33Å; Q130-D387 VanDerWaalsContact NE2-OD1 3.16Å; Q130-D387 PolarHBondContact OE1-OD1 3.36Å
131	G	97.9	Very high	97.4	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-17	-177.7	0	0	0	0	0	113.5	I129 E133 E160 I162	I129-G131 VanDerWaalsContact C-N 3.32Å; I129-G131 PolarHBondContact O-N 3.27Å; G131-E133 VanDerWaalsContact C-N 3.26Å; G131-E133 PolarHBondContact O-N 3.09Å; G131-E160 WeakPolarHBondContact CA-O 3.11Å; G131-E160 PolarHBondContact N-O 3.38Å; G131-I162 WeakPolarHBondContact O-CD1 3.22Å
132	L	96.1	Very high	97.6	Very high	57 Å²	57	31 Å²	31	30%	0.298	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-19.1	173.1	-65	176.8	0	0	0	113.4	Q130 L134 E160 I162 Y191	Q130-L132 PolarHBondContact O-N 3.5Å; Q130-L132 VanDerWaalsContact O-N 3.16Å; L132-L134 PolarHBondContact O-N 2.96Å; L132-E160 HydrophobicContact CD1-CG 4.47Å; L132-I162 HydrophobicContact CD2-CG2 4.04Å; L132-Y191 HydrophobicContact CD1-CD1 4.01Å; L132-Y191 HydrophobicContact CD1-CE1 4.21Å; L132-Y191 HydrophobicContact CD1-CG 4.18Å; L132-Y191 HydrophobicContact CD2-CD1 3.96Å; L132-Y191 HydrophobicContact CD2-CG 4.17Å; L132-Y191 HydrophobicContact CG-CD1 4.42Å; L132-Y191 HydrophobicContact CG-CG 4.37Å
133	E	96.1	Very high	97.7	Very high	21 Å²	21	31.9 Å²	31.9	10%	0.098	17%	0.168	C	C	.	.			trans	-86.9	104.9	174.4	173.3	57.9	-98	0	0	110.5	R40 Q130 G131 A135 R140	R40-E133 IonicContact CZ-OE2 2.69Å; R40-E133 IonicContact NH1-OE2 2.69Å; R40-E133 PolarHBondContact NH1-OE2 3.1Å; Q130-E133 HydrophobicContact CG-CB 3.89Å; Q130-E133 PolarHBondContact O-N 2.85Å; G131-E133 VanDerWaalsContact C-N 3.26Å; G131-E133 PolarHBondContact O-N 3.09Å; E133-A135 VanDerWaalsContact C-N 3.28Å; E133-A135 HydrophobicContact CG-CB 4.36Å; E133-A135 PolarHBondContact O-N 3.25Å; E133-A135 WeakPolarHBondContact OE1-CB 3.41Å; E133-A135 PolarHBondContact OE1-N 3.49Å; E133-R140 PolarHBondContact O-NH2 3.42Å
134	L	95.6	Very high	97.7	Very high	97 Å²	97	30.4 Å²	30.4	51%	0.508	16%	0.16	S	C	.	.			trans	-73.6	-20.8	-174.4	-57	-176.4	0	0	0	112.8	L132 N136 L137 I162	L132-L134 PolarHBondContact O-N 2.96Å; L134-N136 PolarHBondContact O-N 2.77Å; L134-N136 VanDerWaalsContact O-N 3.15Å; L134-L137 HydrophobicContact CD2-CD2 4.27Å; L134-L137 WeakPolarHBondContact O-CB 3.33Å; L134-L137 PolarHBondContact O-N 3.43Å; L134-L137 VanDerWaalsContact O-N 3.15Å; L134-I162 HydrophobicContact CD2-CD1 4.28Å
135	A	94.9	Very high	97.7	Very high	40 Å²	40	30.5 Å²	30.5	33%	0.331	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	120.8	-179.4	0	0	0	0	0	111.4	E133 L137 R140	E133-A135 VanDerWaalsContact C-N 3.28Å; E133-A135 HydrophobicContact CG-CB 4.36Å; E133-A135 PolarHBondContact O-N 3.25Å; E133-A135 WeakPolarHBondContact OE1-CB 3.41Å; E133-A135 PolarHBondContact OE1-N 3.49Å; A135-L137 PolarHBondContact O-N 2.77Å; A135-L137 VanDerWaalsContact O-N 3.12Å; A135-R140 PolarHBondContact O-NE 3.37Å
136	N	95.7	Very high	97.7	Very high	73 Å²	73	35.6 Å²	35.6	39%	0.39	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.5	22.2	-178.4	-57.2	-68.9	0	0	0	114.5	L134 N138 K139 R140 L381	L134-N136 PolarHBondContact O-N 2.77Å; L134-N136 VanDerWaalsContact O-N 3.15Å; N136-N138 VanDerWaalsContact C-N 3.34Å; N136-N138 PolarHBondContact O-N 3.22Å; N136-K139 PolarHBondContact O-N 3.41Å; N136-R140 HydrophobicContact CB-CG 4.34Å; N136-R140 WeakPolarHBondContact O-CG 3.42Å; N136-R140 PolarHBondContact O-N 2.96Å; N136-L381 HydrophobicContact CB-CD1 3.85Å
137	L	97.4	Very high	97.6	Very high	15 Å²	15	36.6 Å²	36.6	8%	0.079	19%	0.19	C	C	.	.	H	α-helix	trans	-48	-51.1	-171.6	-177.7	65.1	0	0	0	113.1	L134 A135 K139 R140 M141 I162 V164	L134-L137 HydrophobicContact CD2-CD2 4.27Å; L134-L137 WeakPolarHBondContact O-CB 3.33Å; L134-L137 PolarHBondContact O-N 3.43Å; L134-L137 VanDerWaalsContact O-N 3.15Å; A135-L137 PolarHBondContact O-N 2.77Å; A135-L137 VanDerWaalsContact O-N 3.12Å; L137-K139 PolarHBondContact O-N 3.5Å; L137-R140 PolarHBondContact O-N 3.05Å; L137-M141 HydrophobicContact CD1-CG 4.13Å; L137-M141 HydrophobicContact CG-CG 4.34Å; L137-M141 WeakPolarHBondContact O-CB 3.32Å; L137-M141 WeakPolarHBondContact O-CG 3.28Å; L137-M141 PolarHBondContact O-N 3.26Å; L137-I162 HydrophobicContact CD2-CD1 3.89Å; L137-V164 HydrophobicContact CD2-CG1 4.3Å
138	N	97.6	Very high	97.6	Very high	104 Å²	104	36.6 Å²	36.6	56%	0.556	19%	0.19	S	C	*	.	H	α-helix	trans	-55.8	-46.5	178.1	-79.6	-55.3	0	0	0	113	N136 M141 M142 I168	N136-N138 VanDerWaalsContact C-N 3.34Å; N136-N138 PolarHBondContact O-N 3.22Å; N138-M141 PolarHBondContact O-N 3.03Å; N138-M142 VanDerWaalsContact O-CG 3.31Å; N138-M142 WeakPolarHBondContact O-CG 3.38Å; N138-M142 PolarHBondContact O-N 3.46Å; N138-I168 VanDerWaalsContact OD1-CD1 3.28Å; N138-I168 WeakPolarHBondContact OD1-CD1 3.4Å
139	K	97.9	Very high	97.6	Very high	118 Å²	118	41.4 Å²	41.4	51%	0.513	21%	0.211	S	C	.	.	H	α-helix	trans	-68.8	-38.2	-179.9	-67.1	-179.3	179.3	176.4	0	111.5	N136 L137 M142 S143 V378 L381	N136-K139 PolarHBondContact O-N 3.41Å; L137-K139 PolarHBondContact O-N 3.5Å; K139-M142 PolarHBondContact O-N 2.96Å; K139-S143 PolarHBondContact O-N 2.87Å; K139-S143 VanDerWaalsContact O-N 3.15Å; K139-V378 HydrophobicContact CB-CG1 4.14Å; K139-V378 WeakPolarHBondContact O-CG1 3.38Å; K139-L381 HydrophobicContact CB-CD1 3.8Å; K139-L381 HydrophobicContact CD-CD1 3.76Å; K139-L381 HydrophobicContact CD-CD2 4.13Å; K139-L381 HydrophobicContact CD-CG 4.18Å; K139-L381 HydrophobicContact CG-CD1 4.44Å
140	R	98.3	Very high	97.5	Very high	5 Å²	5	49.5 Å²	49.5	2%	0.019	25%	0.246	C	C	.	.	H	α-helix	trans	-63.6	-46.9	174.5	-64.9	-166.7	-53.2	130.4	0.2	111.1	Q130 E133 A135 N136 L137 M142 S143 V144 V378 P385	Q130-R140 PolarHBondContact O-NH2 3.19Å; Q130-R140 VanDerWaalsContact OE1-NH1 3.07Å; E133-R140 PolarHBondContact O-NH2 3.42Å; A135-R140 PolarHBondContact O-NE 3.37Å; N136-R140 HydrophobicContact CB-CG 4.34Å; N136-R140 WeakPolarHBondContact O-CG 3.42Å; N136-R140 PolarHBondContact O-N 2.96Å; L137-R140 PolarHBondContact O-N 3.05Å; R140-M142 PolarHBondContact O-N 3.27Å; R140-S143 WeakPolarHBondContact O-CA 3.38Å; R140-S143 VanDerWaalsContact O-CB 3.28Å; R140-S143 WeakPolarHBondContact O-CB 3.39Å; R140-S143 PolarHBondContact O-N 3.01Å; R140-S143 VanDerWaalsContact O-N 3.08Å; R140-V144 PolarHBondContact O-N 3.01Å; R140-V378 HydrophobicContact CG-CG2 4.25Å; R140-P385 WeakPolarHBondContact CB-O 3.35Å; R140-P385 WeakPolarHBondContact CD-O 3.47Å; R140-P385 PolarHBondContact NH1-O 3.05Å
141	M	98.5	Very high	97.5	Very high	2 Å²	2	51.4 Å²	51.4	1%	0.01	26%	0.255	C	S	.	.	H	α-helix	trans	-60.5	-41.9	176.1	-76.9	-55.1	-60.1	0	0	112.7	I129 L137 N138 S143 V144 V145 C165 I168 L169	I129-M141 HydrophobicContact CD1-CE 3.92Å; I129-M141 HydrophobicContact CD1-SD 3.51Å; I129-M141 VanDerWaalsContact CD1-SD 3.51Å; L137-M141 HydrophobicContact CD1-CG 4.13Å; L137-M141 HydrophobicContact CG-CG 4.34Å; L137-M141 WeakPolarHBondContact O-CB 3.32Å; L137-M141 WeakPolarHBondContact O-CG 3.28Å; L137-M141 PolarHBondContact O-N 3.26Å; N138-M141 PolarHBondContact O-N 3.03Å; M141-S143 VanDerWaalsContact C-N 3.27Å; M141-S143 PolarHBondContact O-N 2.98Å; M141-V144 WeakPolarHBondContact O-CB 3.15Å; M141-V144 PolarHBondContact O-N 3.31Å; M141-V144 VanDerWaalsContact O-N 3.15Å; M141-V145 WeakPolarHBondContact O-CG2 3.22Å; M141-V145 PolarHBondContact O-N 2.6Å; M141-C165 HydrophobicContact CE-CB 3.82Å; M141-C165 HydrophobicContact CG-CB 4.46Å; M141-C165 HydrophobicContact SD-CB 3.95Å; M141-C165 VanDerWaalsContact SD-SG 3.67Å; M141-I168 HydrophobicContact CB-CD1 3.9Å; M141-I168 HydrophobicContact CB-CG2 4.25Å; M141-I168 HydrophobicContact CG-CD1 4.12Å; M141-L169 HydrophobicContact CE-CD1 4.37Å; M141-L169 HydrophobicContact CE-CD2 4Å; M141-L169 HydrophobicContact CE-CG 3.91Å
142	M	98.2	Very high	97.4	Very high	66 Å²	66	56.4 Å²	56.4	33%	0.325	28%	0.279	S	S	.	.	H	α-helix	trans	-61.1	-37.4	174.3	-71.5	-53.4	-56.6	0	0	112	N138 K139 R140 V145 E146 I168 K172	N138-M142 VanDerWaalsContact O-CG 3.31Å; N138-M142 WeakPolarHBondContact O-CG 3.38Å; N138-M142 PolarHBondContact O-N 3.46Å; K139-M142 PolarHBondContact O-N 2.96Å; R140-M142 PolarHBondContact O-N 3.27Å; M142-V145 PolarHBondContact O-N 2.68Å; M142-E146 WeakPolarHBondContact O-CB 3.4Å; M142-E146 VanDerWaalsContact O-CG 3.27Å; M142-E146 WeakPolarHBondContact O-CG 3.44Å; M142-E146 PolarHBondContact O-N 3.24Å; M142-I168 HydrophobicContact SD-CG2 4.26Å; M142-K172 HydrophobicContact CE-CD 4.49Å; M142-K172 HydrophobicContact SD-CG 4.27Å
143	S	98.3	Very high	97.5	Very high	17 Å²	17	53.8 Å²	53.8	12%	0.119	27%	0.265	C	S	.	.	H	α-helix	trans	-64.8	-38.7	173.8	-163.3	0	0	0	0	112.8	K139 R140 M141 T147	K139-S143 PolarHBondContact O-N 2.87Å; K139-S143 VanDerWaalsContact O-N 3.15Å; R140-S143 WeakPolarHBondContact O-CA 3.38Å; R140-S143 VanDerWaalsContact O-CB 3.28Å; R140-S143 WeakPolarHBondContact O-CB 3.39Å; R140-S143 PolarHBondContact O-N 3.01Å; R140-S143 VanDerWaalsContact O-N 3.08Å; M141-S143 VanDerWaalsContact C-N 3.27Å; M141-S143 PolarHBondContact O-N 2.98Å; S143-T147 PolarHBondContact O-N 3.48Å; S143-T147 VanDerWaalsContact O-N 3.08Å; S143-T147 PolarHBondContact O-OG1 2.78Å
144	V	98.7	Very high	97.6	Very high	1 Å²	1	53.9 Å²	53.9	1%	0.006	27%	0.265	C	S	.	.	H	α-helix	trans	-62	-49.6	173.2	173.8	0	0	0	0	110	W127 I129 R140 M141 E146 T147 I148 P385	W127-V144 HydrophobicContact CE3-CB 4.44Å; W127-V144 HydrophobicContact CE3-CG1 3.88Å; W127-V144 HydrophobicContact CE3-CG2 4.12Å; W127-V144 HydrophobicContact CH2-CG2 3.89Å; W127-V144 HydrophobicContact CZ2-CG2 4.37Å; W127-V144 HydrophobicContact CZ3-CB 4.03Å; W127-V144 HydrophobicContact CZ3-CG1 3.9Å; W127-V144 HydrophobicContact CZ3-CG2 3.76Å; I129-V144 HydrophobicContact CG2-CG1 3.97Å; I129-V144 HydrophobicContact CG2-CG2 4.03Å; R140-V144 PolarHBondContact O-N 3.01Å; M141-V144 WeakPolarHBondContact O-CB 3.15Å; M141-V144 PolarHBondContact O-N 3.31Å; M141-V144 VanDerWaalsContact O-N 3.15Å; V144-E146 PolarHBondContact O-N 3.13Å; V144-T147 WeakPolarHBondContact O-CB 3.24Å; V144-T147 PolarHBondContact O-N 2.76Å; V144-I148 HydrophobicContact CG1-CD1 3.91Å; V144-I148 WeakPolarHBondContact O-CG1 3.34Å; V144-I148 PolarHBondContact O-N 2.93Å; V144-P385 HydrophobicContact CG2-CB 3.93Å
145	V	98.7	Very high	97.8	Very high	1 Å²	1	49.2 Å²	49.2	1%	0.006	24%	0.241	C	C	.	.	H	α-helix	trans	-59.4	-44.9	178.3	167.1	0	0	0	0	111.7	M141 M142 T147 I148 K149 I168 L169 K172 L173	M141-V145 WeakPolarHBondContact O-CG2 3.22Å; M141-V145 PolarHBondContact O-N 2.6Å; M142-V145 PolarHBondContact O-N 2.68Å; V145-T147 VanDerWaalsContact C-N 3.31Å; V145-T147 PolarHBondContact O-N 3.02Å; V145-I148 PolarHBondContact O-N 3.11Å; V145-K149 HydrophobicContact CG1-CD 4.15Å; V145-K149 HydrophobicContact CG1-CG 4.47Å; V145-K149 WeakPolarHBondContact O-CG 3.41Å; V145-K149 PolarHBondContact O-N 3.22Å; V145-I168 HydrophobicContact CG2-CG2 4.28Å; V145-L169 HydrophobicContact CG2-CD2 4.29Å; V145-K172 HydrophobicContact CG1-CB 3.62Å; V145-K172 HydrophobicContact CG1-CG 4.19Å; V145-K172 HydrophobicContact CG2-CB 4.3Å; V145-L173 HydrophobicContact CG1-CD2 4.15Å; V145-L173 HydrophobicContact CG1-CG 4.32Å; V145-L173 HydrophobicContact CG2-CD1 4.3Å
146	E	98	Very high	98	Very high	107 Å²	107	47.3 Å²	47.3	50%	0.5	23%	0.225	S	C	.	.	H	α-helix	trans	-60.6	-40.8	177.2	-78.1	172.3	-169.4	0	0	111.6	M142 V144 K149 K150	M142-E146 WeakPolarHBondContact O-CB 3.4Å; M142-E146 VanDerWaalsContact O-CG 3.27Å; M142-E146 WeakPolarHBondContact O-CG 3.44Å; M142-E146 PolarHBondContact O-N 3.24Å; V144-E146 PolarHBondContact O-N 3.13Å; E146-K149 PolarHBondContact O-N 3.2Å; E146-K150 WeakPolarHBondContact O-CB 3.47Å; E146-K150 PolarHBondContact O-N 2.81Å
147	T	98.4	Very high	98.1	Very high	21 Å²	21	43.9 Å²	43.9	13%	0.129	21%	0.207	C	C	.	.	H	α-helix	trans	-61.9	-48.3	175.7	-54.7	0	0	0	0	110.9	W127 S143 V144 V145 K149 K150 E151 F153	W127-T147 HydrophobicContact CZ3-CG2 4.49Å; S143-T147 PolarHBondContact O-N 3.48Å; S143-T147 VanDerWaalsContact O-N 3.08Å; S143-T147 PolarHBondContact O-OG1 2.78Å; V144-T147 WeakPolarHBondContact O-CB 3.24Å; V144-T147 PolarHBondContact O-N 2.76Å; V145-T147 VanDerWaalsContact C-N 3.31Å; V145-T147 PolarHBondContact O-N 3.02Å; T147-K149 VanDerWaalsContact C-N 3.34Å; T147-K149 PolarHBondContact O-N 2.86Å; T147-K150 PolarHBondContact O-N 2.9Å; T147-E151 PolarHBondContact O-N 2.81Å; T147-E151 VanDerWaalsContact O-N 3.09Å; T147-F153 HydrophobicContact CG2-CE2 4.33Å
148	I	98.7	Very high	98.2	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-61.5	-41.2	178.6	-66.2	166.8	0	0	0	111.6	L125 V144 V145 E152 F153 V156 L173 Y177	L125-I148 HydrophobicContact CD2-CG1 4.46Å; V144-I148 HydrophobicContact CG1-CD1 3.91Å; V144-I148 WeakPolarHBondContact O-CG1 3.34Å; V144-I148 PolarHBondContact O-N 2.93Å; V145-I148 PolarHBondContact O-N 3.11Å; I148-E152 WeakPolarHBondContact O-CA 3.26Å; I148-E152 PolarHBondContact O-N 2.94Å; I148-F153 HydrophobicContact CG1-CD2 4.47Å; I148-V156 HydrophobicContact CD1-CG1 4Å; I148-V156 HydrophobicContact CG1-CG1 4.37Å; I148-V156 HydrophobicContact CG1-CG2 4.27Å; I148-V156 HydrophobicContact CG2-CG2 4.15Å; I148-L173 HydrophobicContact CB-CD1 4.46Å; I148-L173 HydrophobicContact CD1-CD1 4.05Å; I148-L173 HydrophobicContact CG2-CD1 4.07Å; I148-L173 HydrophobicContact CG2-CD2 4.18Å; I148-Y177 HydrophobicContact CG2-CE1 4.35Å; I148-Y177 HydrophobicContact CG2-CE2 3.88Å; I148-Y177 PolarHBondContact O-OH 2.85Å
149	K	97.7	Very high	98.3	Very high	102 Å²	102	38.2 Å²	38.2	44%	0.443	18%	0.176	S	C	.	.	H	α-helix	trans	-68.5	-38.8	177.7	-74.9	-175.4	176.7	-172.3	0	112.8	V145 E146 T147 E152 K172 L173	V145-K149 HydrophobicContact CG1-CD 4.15Å; V145-K149 HydrophobicContact CG1-CG 4.47Å; V145-K149 WeakPolarHBondContact O-CG 3.41Å; V145-K149 PolarHBondContact O-N 3.22Å; E146-K149 PolarHBondContact O-N 3.2Å; T147-K149 VanDerWaalsContact C-N 3.34Å; T147-K149 PolarHBondContact O-N 2.86Å; K149-E152 WeakPolarHBondContact O-CG 3.27Å; K149-K172 WeakPolarHBondContact CE-O 3.47Å; K149-K172 PolarHBondContact NZ-O 3.26Å; K149-L173 HydrophobicContact CD-CD2 4.29Å; K149-L173 HydrophobicContact CG-CD2 3.66Å
150	K	97.4	Very high	98.3	Very high	171 Å²	171	33.7 Å²	33.7	74%	0.743	16%	0.157	S	C	*	.	H	α-helix	trans	-70.5	-42.9	-176.4	-179.4	-175.9	174.3	-169.9	0	112.1	E146 T147	E146-K150 WeakPolarHBondContact O-CB 3.47Å; E146-K150 PolarHBondContact O-N 2.81Å; T147-K150 PolarHBondContact O-N 2.9Å
151	E	97.1	Very high	98.3	Very high	61 Å²	61	33.4 Å²	33.4	29%	0.285	16%	0.156	S	C	.	.	H	α-helix	trans	-96.8	-9.1	-176	-72.7	-167.1	-116.7	0	0	114	T147 F153 R373	T147-E151 PolarHBondContact O-N 2.81Å; T147-E151 VanDerWaalsContact O-N 3.09Å; E151-F153 VanDerWaalsContact C-N 3.3Å; E151-F153 HydrophobicContact CB-CD1 4.23Å; E151-F153 HydrophobicContact CB-CD2 4.34Å; E151-F153 HydrophobicContact CB-CE1 3.6Å; E151-F153 HydrophobicContact CB-CE2 3.73Å; E151-F153 HydrophobicContact CB-CZ 3.32Å; E151-F153 HydrophobicContact CG-CE1 4.39Å; E151-F153 HydrophobicContact CG-CZ 3.98Å; E151-F153 PolarHBondContact O-N 2.84Å; E151-R373 WeakPolarHBondContact OE1-CD 3.27Å; E151-R373 IonicContact OE1-CZ 3.92Å; E151-R373 IonicContact OE1-NE 3.4Å; E151-R373 PolarHBondContact OE1-NE 3.41Å; E151-R373 IonicContact OE2-CZ 3.47Å; E151-R373 VanDerWaalsContact OE2-CZ 3.26Å; E151-R373 IonicContact OE2-NE 3.55Å; E151-R373 PolarHBondContact OE2-NE 3.29Å; E151-R373 IonicContact OE2-NH2 3.76Å; E151-R373 PolarHBondContact OE2-NH2 3.24Å
152	E	96.8	Very high	98.2	Very high	106 Å²	106	34.4 Å²	34.4	50%	0.495	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.9	47.9	172.9	-60.9	-163	87.1	0	0	114.2	I148 K149 K198	I148-E152 WeakPolarHBondContact O-CA 3.26Å; I148-E152 PolarHBondContact O-N 2.94Å; K149-E152 WeakPolarHBondContact O-CG 3.27Å; E152-K198 HydrophobicContact CB-CD 4.5Å; E152-K198 VanDerWaalsContact OE1-CE 3.28Å; E152-K198 WeakPolarHBondContact OE1-CE 3.42Å; E152-K198 IonicContact OE1-NZ 2.85Å; E152-K198 PolarHBondContact OE1-NZ 2.96Å; E152-K198 IonicContact OE2-NZ 3.89Å
153	F	98.3	Very high	98.2	Very high	2 Å²	2	35.9 Å²	35.9	1%	0.009	17%	0.17	C	C	.	.			trans	-54.3	142.4	178.6	-52.5	-68.8	0	0	0	111.4	N123 L125 T147 I148 E151 V156 Y177 R373 L392	N123-F153 HydrophobicContact CB-CD1 4.44Å; L125-F153 HydrophobicContact CB-CB 4.32Å; L125-F153 HydrophobicContact CB-CD1 4.21Å; L125-F153 HydrophobicContact CB-CD2 4.01Å; L125-F153 HydrophobicContact CB-CE2 4.38Å; L125-F153 HydrophobicContact CB-CG 3.9Å; L125-F153 HydrophobicContact CD1-CE1 4.09Å; L125-F153 HydrophobicContact CD1-CE2 4.06Å; L125-F153 HydrophobicContact CD1-CZ 3.81Å; L125-F153 HydrophobicContact CD2-CD2 3.82Å; L125-F153 HydrophobicContact CD2-CE2 3.66Å; L125-F153 HydrophobicContact CD2-CZ 4.28Å; L125-F153 HydrophobicContact CG-CD2 4.33Å; L125-F153 HydrophobicContact CG-CE2 4.25Å; L125-F153 HydrophobicContact CG-CZ 4.47Å; T147-F153 HydrophobicContact CG2-CE2 4.33Å; I148-F153 HydrophobicContact CG1-CD2 4.47Å; E151-F153 VanDerWaalsContact C-N 3.3Å; E151-F153 HydrophobicContact CB-CD1 4.23Å; E151-F153 HydrophobicContact CB-CD2 4.34Å; E151-F153 HydrophobicContact CB-CE1 3.6Å; E151-F153 HydrophobicContact CB-CE2 3.73Å; E151-F153 HydrophobicContact CB-CZ 3.32Å; E151-F153 HydrophobicContact CG-CE1 4.39Å; E151-F153 HydrophobicContact CG-CZ 3.98Å; E151-F153 PolarHBondContact O-N 2.84Å; F153-V156 HydrophobicContact CB-CG2 3.79Å; F153-V156 HydrophobicContact CD2-CG2 4.12Å; F153-V156 HydrophobicContact CG-CG2 4.37Å; F153-Y177 PolarHBondContact N-OH 2.87Å; F153-Y177 VanDerWaalsContact O-CE1 3.24Å; F153-Y177 WeakPolarHBondContact O-CE1 3.32Å; F153-Y177 PolarHBondContact O-OH 2.84Å; F153-R373 HydrophobicContact CZ-CG 4.34Å; F153-L392 HydrophobicContact CD1-CD1 3.68Å; F153-L392 HydrophobicContact CE1-CD1 3.72Å; F153-L392 HydrophobicContact CE1-CD2 4.11Å; F153-L392 HydrophobicContact CE1-CG 4.42Å
154	H	98.4	Very high	98.1	Very high	22 Å²	22	38 Å²	38	10%	0.102	18%	0.182	C	C	.	.	S	Bend	trans	-72.2	-36.8	-179.7	-64.8	106.5	0	0	0	111.6	I121 I122 N123 K198 I203	I121-H154 PolarHBondContact O-CE1 3.01Å; I121-H154 VanDerWaalsContact O-CE1 3.29Å; I122-H154 HydrophobicContact CD1-CB 4.32Å; I122-H154 HydrophobicContact CG1-CB 3.67Å; N123-H154 PolarHBondContact N-ND1 2.77Å; N123-H154 WeakPolarHBondContact O-CB 3.24Å; N123-H154 PolarHBondContact O-N 3.33Å; H154-K198 PolarHBondContact O-N 2.88Å; H154-I203 HydrophobicContact CB-CD1 3.92Å
155	V	98.9	Very high	98.1	Very high	0 Å²	0	38 Å²	38	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	138.3	176.1	-179.3	0	0	0	0	109.1	I122 N123 V124 L125 I195 L196 L229 I246	I122-V155 HydrophobicContact CD1-CG2 4.43Å; N123-V155 PolarHBondContact O-N 3.05Å; N123-V155 VanDerWaalsContact O-N 3.14Å; V124-V155 WeakPolarHBondContact CA-O 3.45Å; V124-V155 HydrophobicContact CG1-CB 4.21Å; V124-V155 HydrophobicContact CG1-CG1 4.26Å; V124-V155 HydrophobicContact CG2-CB 4.25Å; L125-V155 PolarHBondContact N-O 2.88Å; V155-I195 HydrophobicContact CG1-CG2 4.07Å; V155-L196 CarbonylContact C-O 3.59Å; V155-L196 WeakPolarHBondContact CA-O 3.44Å; V155-L229 HydrophobicContact CG2-CD1 3.68Å; V155-I246 HydrophobicContact CG1-CD1 4.23Å; V155-I246 HydrophobicContact CG1-CG1 4.03Å; V155-I246 HydrophobicContact CG1-CG2 3.88Å; V155-I246 HydrophobicContact CG2-CD1 4.24Å; V155-I246 HydrophobicContact CG2-CG1 4.24Å
156	V	99	Very high	98.1	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	123	174.5	-176.9	0	0	0	0	109.7	L125 I148 F153 L158 Y177 I195 L196	L125-V156 HydrophobicContact CB-CG1 4.32Å; L125-V156 HydrophobicContact CB-CG2 4.24Å; L125-V156 HydrophobicContact CD2-CG1 3.96Å; L125-V156 CarbonylContact O-C 3.59Å; L125-V156 WeakPolarHBondContact O-CA 3.24Å; I148-V156 HydrophobicContact CD1-CG1 4Å; I148-V156 HydrophobicContact CG1-CG1 4.37Å; I148-V156 HydrophobicContact CG1-CG2 4.27Å; I148-V156 HydrophobicContact CG2-CG2 4.15Å; F153-V156 HydrophobicContact CB-CG2 3.79Å; F153-V156 HydrophobicContact CD2-CG2 4.12Å; F153-V156 HydrophobicContact CG-CG2 4.37Å; V156-L158 HydrophobicContact CG1-CD2 3.54Å; V156-L158 HydrophobicContact CG1-CG 3.92Å; V156-Y177 HydrophobicContact CG2-CE1 4.42Å; V156-I195 CarbonylContact O-C 3.58Å; V156-I195 WeakPolarHBondContact O-CA 3.38Å; V156-L196 HydrophobicContact CB-CB 4.15Å; V156-L196 HydrophobicContact CB-CD1 4.23Å; V156-L196 HydrophobicContact CG1-CD1 4.34Å; V156-L196 PolarHBondContact N-O 2.79Å; V156-L196 PolarHBondContact O-N 3.02Å
157	C	99	Very high	98.1	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	116.4	177.1	-65.2	0	0	0	0	109.5	L125 S126 W127 Q159 V194 T248	L125-C157 PolarHBondContact O-N 3.5Å; S126-C157 CarbonylContact C-O 3.58Å; S126-C157 VanDerWaalsContact CA-O 3.23Å; S126-C157 WeakPolarHBondContact CA-O 3.43Å; W127-C157 PolarHBondContact N-O 3.38Å; C157-Q159 PolarHBondContact O-NE2 2.81Å; C157-V194 WeakPolarHBondContact CA-O 3.41Å; C157-T248 HydrophobicContact CB-CG2 4.33Å
158	L	98.9	Very high	98.1	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	142.3	-177.7	-56.5	-178.7	0	0	0	111.1	W127 I129 V156 V161 L169 V193 V194 L196	W127-L158 HydrophobicContact CB-CD2 3.97Å; W127-L158 WeakPolarHBondContact O-CA 3.45Å; I129-L158 HydrophobicContact CG2-CD2 3.85Å; V156-L158 HydrophobicContact CG1-CD2 3.54Å; V156-L158 HydrophobicContact CG1-CG 3.92Å; L158-V161 HydrophobicContact CB-CG2 3.62Å; L158-L169 HydrophobicContact CD1-CD1 3.67Å; L158-L169 HydrophobicContact CD1-CD2 3.96Å; L158-L169 HydrophobicContact CD1-CG 4.49Å; L158-V193 CarbonylContact O-C 3.59Å; L158-V193 WeakPolarHBondContact O-CA 3.46Å; L158-V193 WeakPolarHBondContact O-CB 3.3Å; L158-V194 HydrophobicContact CB-CB 4.44Å; L158-V194 PolarHBondContact N-O 3.45Å; L158-V194 PolarHBondContact O-N 3.48Å; L158-L196 HydrophobicContact CD1-CD1 3.76Å; L158-L196 HydrophobicContact CG-CD1 4.02Å
159	Q	98.8	Very high	98.1	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	159.1	172.7	-55.1	80.8	48.2	0	0	110.5	S126 W127 N128 I129 C157 V161 V193 T248 H250 D296	S126-Q159 PolarHBondContact OG-NE2 3.31Å; S126-Q159 PolarHBondContact OG-OE1 3.38Å; W127-Q159 PolarHBondContact O-N 3.46Å; W127-Q159 PolarHBondContact O-OE1 3.41Å; N128-Q159 HydrophobicContact CB-CB 4.12Å; N128-Q159 VanDerWaalsContact N-OE1 3.07Å; I129-Q159 WeakPolarHBondContact CG1-O 3.22Å; I129-Q159 PolarHBondContact N-O 2.87Å; C157-Q159 PolarHBondContact O-NE2 2.81Å; Q159-V161 VanDerWaalsContact C-N 3.28Å; Q159-V161 PolarHBondContact O-N 2.94Å; Q159-V193 HydrophobicContact CB-CG1 4.33Å; Q159-V193 HydrophobicContact CG-CG1 3.92Å; Q159-T248 PolarHBondContact NE2-OG1 3Å; Q159-H250 HydrophobicContact CB-CB 4.05Å; Q159-H250 HydrophobicContact CG-CB 4.02Å; Q159-D296 HydrophobicContact CG-CB 4.41Å
160	E	98.1	Very high	98.1	Very high	23 Å²	23	37.7 Å²	37.7	11%	0.107	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	55.2	38.9	-172.1	-62.1	-170.8	-155.3	0	0	113.9	N128 Q130 G131 L132 Y191 H250	N128-E160 PolarHBondContact ND2-OE1 2.81Å; N128-E160 WeakPolarHBondContact OD1-CB 3.06Å; N128-E160 VanDerWaalsContact OD1-CD 3.26Å; N128-E160 VanDerWaalsContact OD1-CG 3.3Å; N128-E160 WeakPolarHBondContact OD1-CG 3.21Å; N128-E160 PolarHBondContact OD1-OE1 3.08Å; Q130-E160 WeakPolarHBondContact CA-OE2 3.24Å; G131-E160 WeakPolarHBondContact CA-O 3.11Å; G131-E160 PolarHBondContact N-O 3.38Å; L132-E160 HydrophobicContact CD1-CG 4.47Å; E160-Y191 HydrophobicContact CG-CD2 4.23Å; E160-Y191 HydrophobicContact CG-CE2 4.5Å; E160-H250 IonicContact OE1-CE1 3.4Å; E160-H250 PolarHBondContact OE1-CE1 3.42Å
161	V	98.6	Very high	98.2	Very high	0 Å²	0	36 Å²	36	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79	129.4	171.3	-170.8	0	0	0	0	108.6	I129 L158 Q159 C165 L166 L169 Y191 F192 V194	I129-V161 HydrophobicContact CD1-CB 4.5Å; I129-V161 HydrophobicContact CD1-CG2 3.96Å; I129-V161 HydrophobicContact CG1-CG2 4.3Å; L158-V161 HydrophobicContact CB-CG2 3.62Å; Q159-V161 VanDerWaalsContact C-N 3.28Å; Q159-V161 PolarHBondContact O-N 2.94Å; V161-C165 HydrophobicContact CG1-CB 3.72Å; V161-L166 HydrophobicContact CG1-CB 4.19Å; V161-L169 HydrophobicContact CG1-CD1 4.14Å; V161-Y191 CarbonylContact O-C 3.34Å; V161-Y191 WeakPolarHBondContact O-CA 3.31Å; V161-F192 HydrophobicContact CB-CD2 4.04Å; V161-F192 HydrophobicContact CB-CE2 3.9Å; V161-F192 WeakPolarHBondContact CB-O 3.4Å; V161-F192 HydrophobicContact CG1-CD2 4.37Å; V161-F192 HydrophobicContact CG1-CE2 3.74Å; V161-F192 HydrophobicContact CG1-CZ 4.31Å; V161-F192 PolarHBondContact N-O 3.4Å; V161-F192 PolarHBondContact O-N 2.81Å; V161-V194 HydrophobicContact CB-CG2 3.91Å; V161-V194 HydrophobicContact CG1-CG2 3.89Å; V161-V194 HydrophobicContact CG2-CB 4.14Å; V161-V194 HydrophobicContact CG2-CG2 3.71Å
162	I	97.1	Very high	98.2	Very high	23 Å²	23	35.9 Å²	35.9	12%	0.118	17%	0.171	C	C	.	.			trans	-105.4	168.8	168.1	67.6	166.6	0	0	0	110.2	G131 L132 L134 L137 V164 C165 L166 D190	G131-I162 WeakPolarHBondContact O-CD1 3.22Å; L132-I162 HydrophobicContact CD2-CG2 4.04Å; L134-I162 HydrophobicContact CD2-CD1 4.28Å; L137-I162 HydrophobicContact CD2-CD1 3.89Å; I162-V164 VanDerWaalsContact C-N 3.3Å; I162-V164 HydrophobicContact CD1-CB 4.19Å; I162-V164 HydrophobicContact CD1-CG2 4.46Å; I162-V164 HydrophobicContact CG1-CB 4.33Å; I162-V164 PolarHBondContact O-N 2.91Å; I162-C165 HydrophobicContact CG1-CB 4.29Å; I162-C165 WeakPolarHBondContact O-CA 3.17Å; I162-C165 VanDerWaalsContact O-CB 3.3Å; I162-C165 WeakPolarHBondContact O-CB 3.49Å; I162-C165 PolarHBondContact O-N 3.29Å; I162-L166 PolarHBondContact O-N 2.83Å; I162-D190 WeakPolarHBondContact CG2-O 3.38Å
163	L	96.7	Very high	98.3	Very high	96 Å²	96	30.9 Å²	30.9	50%	0.503	15%	0.147	S	C	.	.	H	α-helix	trans	-53.2	-43.7	-178.6	-68.8	176.1	0	0	0	113.4	C165 L166 E167 F192	L163-C165 VanDerWaalsContact C-N 3.28Å; L163-C165 PolarHBondContact O-N 3.44Å; L163-L166 WeakPolarHBondContact O-CB 3.44Å; L163-L166 PolarHBondContact O-N 3.47Å; L163-L166 VanDerWaalsContact O-N 3.09Å; L163-E167 WeakPolarHBondContact O-CG 3.21Å; L163-E167 PolarHBondContact O-N 2.84Å; L163-F192 HydrophobicContact CD2-CE1 4.09Å; L163-F192 HydrophobicContact CD2-CZ 4.09Å; L163-F192 HydrophobicContact CG-CE1 4.4Å
164	V	97.1	Very high	98.3	Very high	63 Å²	63	35.3 Å²	35.3	38%	0.382	17%	0.168	S	C	.	.	H	α-helix	trans	-60.7	-37.6	176.2	-179.8	0	0	0	0	111.8	L137 I162 I168	L137-V164 HydrophobicContact CD2-CG1 4.3Å; I162-V164 VanDerWaalsContact C-N 3.3Å; I162-V164 HydrophobicContact CD1-CB 4.19Å; I162-V164 HydrophobicContact CD1-CG2 4.46Å; I162-V164 HydrophobicContact CG1-CB 4.33Å; I162-V164 PolarHBondContact O-N 2.91Å; V164-I168 HydrophobicContact CG1-CD1 4.43Å; V164-I168 WeakPolarHBondContact O-CG1 3.23Å; V164-I168 PolarHBondContact O-N 3.02Å
165	C	98.4	Very high	98.3	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-67.3	-42.9	175	-63.3	0	0	0	0	110.9	I129 M141 V161 I162 L163 E167 I168 L169	I129-C165 HydrophobicContact CD1-CB 4.15Å; M141-C165 HydrophobicContact CE-CB 3.82Å; M141-C165 HydrophobicContact CG-CB 4.46Å; M141-C165 HydrophobicContact SD-CB 3.95Å; M141-C165 VanDerWaalsContact SD-SG 3.67Å; V161-C165 HydrophobicContact CG1-CB 3.72Å; I162-C165 HydrophobicContact CG1-CB 4.29Å; I162-C165 WeakPolarHBondContact O-CA 3.17Å; I162-C165 VanDerWaalsContact O-CB 3.3Å; I162-C165 WeakPolarHBondContact O-CB 3.49Å; I162-C165 PolarHBondContact O-N 3.29Å; L163-C165 VanDerWaalsContact C-N 3.28Å; L163-C165 PolarHBondContact O-N 3.44Å; C165-E167 VanDerWaalsContact C-N 3.35Å; C165-E167 PolarHBondContact O-N 3.2Å; C165-I168 PolarHBondContact O-N 3.45Å; C165-L169 VanDerWaalsContact O-CG 3.27Å; C165-L169 WeakPolarHBondContact O-CG 3.33Å; C165-L169 PolarHBondContact O-N 2.74Å
166	L	98.1	Very high	98.3	Very high	3 Å²	3	41.9 Å²	41.9	2%	0.016	21%	0.214	C	C	.	.	H	α-helix	trans	-62.5	-40.4	178.8	-178.8	62.5	0	0	0	112.1	V161 I162 L163 L169 R170 I179 S183 F192 V194	V161-L166 HydrophobicContact CG1-CB 4.19Å; I162-L166 PolarHBondContact O-N 2.83Å; L163-L166 WeakPolarHBondContact O-CB 3.44Å; L163-L166 PolarHBondContact O-N 3.47Å; L163-L166 VanDerWaalsContact O-N 3.09Å; L166-L169 PolarHBondContact O-N 3.38Å; L166-R170 HydrophobicContact CD1-CG 4.44Å; L166-R170 WeakPolarHBondContact O-CG 3.44Å; L166-R170 PolarHBondContact O-N 3.45Å; L166-I179 HydrophobicContact CD1-CG2 3.98Å; L166-S183 VanDerWaalsContact CD2-OG 3.29Å; L166-S183 WeakPolarHBondContact CD2-OG 3.44Å; L166-F192 HydrophobicContact CB-CE2 4.25Å; L166-F192 HydrophobicContact CB-CZ 4.18Å; L166-F192 HydrophobicContact CD2-CE2 4.01Å; L166-F192 HydrophobicContact CD2-CZ 4.02Å; L166-V194 HydrophobicContact CD1-CG2 4.33Å
167	E	97.6	Very high	98.2	Very high	130 Å²	130	42.1 Å²	42.1	61%	0.607	22%	0.215	S	C	*	.	H	α-helix	trans	-58.6	-47.6	174.2	-74	172.3	-173	0	0	111.4	L163 C165 L169 R170 E171	L163-E167 WeakPolarHBondContact O-CG 3.21Å; L163-E167 PolarHBondContact O-N 2.84Å; C165-E167 VanDerWaalsContact C-N 3.35Å; C165-E167 PolarHBondContact O-N 3.2Å; E167-L169 PolarHBondContact O-N 2.83Å; E167-R170 PolarHBondContact O-N 3.02Å; E167-E171 WeakPolarHBondContact O-CB 3.35Å; E167-E171 PolarHBondContact O-N 3.13Å
168	I	98.6	Very high	98.2	Very high	13 Å²	13	45.7 Å²	45.7	7%	0.067	23%	0.232	C	C	.	.	H	α-helix	trans	-62.1	-43.6	176	-63.4	164.3	0	0	0	110.9	N138 M141 M142 V145 V164 C165 R170 E171 K172	N138-I168 VanDerWaalsContact OD1-CD1 3.28Å; N138-I168 WeakPolarHBondContact OD1-CD1 3.4Å; M141-I168 HydrophobicContact CB-CD1 3.9Å; M141-I168 HydrophobicContact CB-CG2 4.25Å; M141-I168 HydrophobicContact CG-CD1 4.12Å; M142-I168 HydrophobicContact SD-CG2 4.26Å; V145-I168 HydrophobicContact CG2-CG2 4.28Å; V164-I168 HydrophobicContact CG1-CD1 4.43Å; V164-I168 WeakPolarHBondContact O-CG1 3.23Å; V164-I168 PolarHBondContact O-N 3.02Å; C165-I168 PolarHBondContact O-N 3.45Å; I168-R170 PolarHBondContact O-N 3.37Å; I168-E171 PolarHBondContact O-N 3.17Å; I168-K172 HydrophobicContact CG2-CG 4.17Å; I168-K172 WeakPolarHBondContact O-CB 3.29Å; I168-K172 VanDerWaalsContact O-CG 3.26Å; I168-K172 WeakPolarHBondContact O-CG 3.37Å; I168-K172 PolarHBondContact O-N 3.24Å
169	L	98.7	Very high	98.2	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-60.6	-45.9	178.1	-70	168.4	0	0	0	111	M141 V145 L158 V161 C165 L166 E167 K172 L173 I179 L196	M141-L169 HydrophobicContact CE-CD1 4.37Å; M141-L169 HydrophobicContact CE-CD2 4Å; M141-L169 HydrophobicContact CE-CG 3.91Å; V145-L169 HydrophobicContact CG2-CD2 4.29Å; L158-L169 HydrophobicContact CD1-CD1 3.67Å; L158-L169 HydrophobicContact CD1-CD2 3.96Å; L158-L169 HydrophobicContact CD1-CG 4.49Å; V161-L169 HydrophobicContact CG1-CD1 4.14Å; C165-L169 VanDerWaalsContact O-CG 3.27Å; C165-L169 WeakPolarHBondContact O-CG 3.33Å; C165-L169 PolarHBondContact O-N 2.74Å; L166-L169 PolarHBondContact O-N 3.38Å; E167-L169 PolarHBondContact O-N 2.83Å; L169-K172 PolarHBondContact O-N 2.81Å; L169-L173 HydrophobicContact CD2-CD1 3.81Å; L169-L173 WeakPolarHBondContact O-CA 3.27Å; L169-L173 VanDerWaalsContact O-CB 3.25Å; L169-L173 WeakPolarHBondContact O-CB 3.41Å; L169-L173 PolarHBondContact O-N 2.91Å; L169-I179 HydrophobicContact CB-CD1 4.41Å; L169-L196 HydrophobicContact CD2-CD2 4.45Å
170	R	98.4	Very high	98.2	Very high	79 Å²	79	47.9 Å²	47.9	30%	0.298	24%	0.242	S	C	.	.	H	α-helix	trans	-61.5	-53.7	176.6	-76.4	179.5	172.2	153.8	2.1	111.6	L166 E167 I168 K172 E174 I179 D184	L166-R170 HydrophobicContact CD1-CG 4.44Å; L166-R170 WeakPolarHBondContact O-CG 3.44Å; L166-R170 PolarHBondContact O-N 3.45Å; E167-R170 PolarHBondContact O-N 3.02Å; I168-R170 PolarHBondContact O-N 3.37Å; R170-K172 PolarHBondContact O-N 3.48Å; R170-E174 WeakPolarHBondContact O-CB 3.29Å; R170-E174 PolarHBondContact O-N 2.83Å; R170-I179 HydrophobicContact CG-CD1 4.1Å; R170-D184 IonicContact CZ-OD1 3.86Å; R170-D184 IonicContact NH1-OD1 2.83Å; R170-D184 IonicContact NH2-OD1 3.16Å; R170-D184 PolarHBondContact NH2-OD1 3.41Å; R170-D184 IonicContact NH2-OD2 3.41Å; R170-D184 PolarHBondContact NH2-OD2 2.9Å
171	E	98.6	Very high	98.1	Very high	136 Å²	136	46.9 Å²	46.9	64%	0.636	24%	0.237	S	C	*	.	H	α-helix	trans	-55.3	-40.4	-179.8	-165.5	-150.5	148.4	0	0	112	E167 I168	E167-E171 WeakPolarHBondContact O-CB 3.35Å; E167-E171 PolarHBondContact O-N 3.13Å; I168-E171 PolarHBondContact O-N 3.17Å
172	K	98.7	Very high	97.9	Very high	58 Å²	58	46.9 Å²	46.9	25%	0.252	24%	0.237	S	C	.	.	H	α-helix	trans	-95.8	-24.6	-171.9	-57.6	-53.7	-177.8	-165.1	0	115.1	M142 V145 K149 I168 L169 R170	M142-K172 HydrophobicContact CE-CD 4.49Å; M142-K172 HydrophobicContact SD-CG 4.27Å; V145-K172 HydrophobicContact CG1-CB 3.62Å; V145-K172 HydrophobicContact CG1-CG 4.19Å; V145-K172 HydrophobicContact CG2-CB 4.3Å; K149-K172 WeakPolarHBondContact CE-O 3.47Å; K149-K172 PolarHBondContact NZ-O 3.26Å; I168-K172 HydrophobicContact CG2-CG 4.17Å; I168-K172 WeakPolarHBondContact O-CB 3.29Å; I168-K172 VanDerWaalsContact O-CG 3.26Å; I168-K172 WeakPolarHBondContact O-CG 3.37Å; I168-K172 PolarHBondContact O-N 3.24Å; L169-K172 PolarHBondContact O-N 2.81Å; R170-K172 PolarHBondContact O-N 3.48Å
173	L	98.8	Very high	97.6	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-125.8	-14.8	-169.4	-60.1	173.2	0	0	0	114.5	V145 I148 K149 L169 S175 T176 Y177 I179 L196	V145-L173 HydrophobicContact CG1-CD2 4.15Å; V145-L173 HydrophobicContact CG1-CG 4.32Å; V145-L173 HydrophobicContact CG2-CD1 4.3Å; I148-L173 HydrophobicContact CB-CD1 4.46Å; I148-L173 HydrophobicContact CD1-CD1 4.05Å; I148-L173 HydrophobicContact CG2-CD1 4.07Å; I148-L173 HydrophobicContact CG2-CD2 4.18Å; K149-L173 HydrophobicContact CD-CD2 4.29Å; K149-L173 HydrophobicContact CG-CD2 3.66Å; L169-L173 HydrophobicContact CD2-CD1 3.81Å; L169-L173 WeakPolarHBondContact O-CA 3.27Å; L169-L173 VanDerWaalsContact O-CB 3.25Å; L169-L173 WeakPolarHBondContact O-CB 3.41Å; L169-L173 PolarHBondContact O-N 2.91Å; L173-S175 PolarHBondContact O-N 3.36Å; L173-S175 VanDerWaalsContact O-N 3.11Å; L173-T176 CarbonylContact O-C 3.53Å; L173-T176 PolarHBondContact O-N 2.89Å; L173-T176 PolarHBondContact O-OG1 3.44Å; L173-Y177 HydrophobicContact CB-CD2 4.2Å; L173-Y177 HydrophobicContact CD2-CD2 4.33Å; L173-Y177 HydrophobicContact CD2-CE2 4.41Å; L173-Y177 PolarHBondContact O-N 3.21Å; L173-I179 HydrophobicContact CB-CD1 4.44Å; L173-L196 HydrophobicContact CB-CD2 4.35Å; L173-L196 HydrophobicContact CD1-CD2 3.63Å
174	E	97.8	Very high	97.2	Very high	96 Å²	96	45.6 Å²	45.6	45%	0.449	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-19.9	-175.1	-170	164.7	-148.5	0	0	113.4	R170 T176 Y177 I179 K199	R170-E174 WeakPolarHBondContact O-CB 3.29Å; R170-E174 PolarHBondContact O-N 2.83Å; E174-T176 VanDerWaalsContact C-N 3.34Å; E174-Y177 CarbonylContact C-O 3.58Å; E174-Y177 WeakPolarHBondContact CA-O 3.42Å; E174-I179 HydrophobicContact CB-CD1 4.12Å; E174-K199 VanDerWaalsContact O-CE 3.32Å; E174-K199 WeakPolarHBondContact O-CE 3.08Å; E174-K199 PolarHBondContact O-NZ 2.83Å
175	S	98	Very high	96.5	Very high	95 Å²	95	48.9 Å²	48.9	66%	0.664	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67	-34.3	171.7	59.8	0	0	0	0	112.5	L173 K199	L173-S175 PolarHBondContact O-N 3.36Å; L173-S175 VanDerWaalsContact O-N 3.11Å; S175-K199 WeakPolarHBondContact O-CD 3.39Å; S175-K199 PolarHBondContact O-NZ 2.89Å; S175-K199 VanDerWaalsContact O-NZ 3.13Å
176	T	98.3	Very high	95.7	Very high	64 Å²	64	51.3 Å²	51.3	39%	0.393	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113	-11.5	-174.3	53.9	0	0	0	0	114.5	L173 E174 K199	L173-T176 CarbonylContact O-C 3.53Å; L173-T176 PolarHBondContact O-N 2.89Å; L173-T176 PolarHBondContact O-OG1 3.44Å; E174-T176 VanDerWaalsContact C-N 3.34Å; T176-K199 WeakPolarHBondContact O-CB 3.42Å; T176-K199 PolarHBondContact O-N 3.03Å
177	Y	98.8	Very high	94.7	Very high	5 Å²	5	55.8 Å²	55.8	2%	0.02	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	144.3	177.8	-71.5	-101	0	0	0	110.9	I148 F153 V156 L173 E174 L196 V197 K198 K199	I148-Y177 HydrophobicContact CG2-CE1 4.35Å; I148-Y177 HydrophobicContact CG2-CE2 3.88Å; I148-Y177 PolarHBondContact O-OH 2.85Å; F153-Y177 PolarHBondContact N-OH 2.87Å; F153-Y177 VanDerWaalsContact O-CE1 3.24Å; F153-Y177 WeakPolarHBondContact O-CE1 3.32Å; F153-Y177 PolarHBondContact O-OH 2.84Å; V156-Y177 HydrophobicContact CG2-CE1 4.42Å; L173-Y177 HydrophobicContact CB-CD2 4.2Å; L173-Y177 HydrophobicContact CD2-CD2 4.33Å; L173-Y177 HydrophobicContact CD2-CE2 4.41Å; L173-Y177 PolarHBondContact O-N 3.21Å; E174-Y177 CarbonylContact C-O 3.58Å; E174-Y177 WeakPolarHBondContact CA-O 3.42Å; Y177-L196 HydrophobicContact CD1-CB 3.8Å; Y177-L196 HydrophobicContact CG-CB 4.28Å; Y177-V197 CarbonylContact C-O 3.56Å; Y177-V197 VanDerWaalsContact CA-O 3.29Å; Y177-V197 WeakPolarHBondContact CA-O 3.48Å; Y177-V197 VanDerWaalsContact CD1-C 3.48Å; Y177-K198 VanDerWaalsContact CD1-CA 3.47Å; Y177-K198 HydrophobicContact CD1-CB 4.09Å; Y177-K198 VanDerWaalsContact CD1-N 3.31Å; Y177-K198 HydrophobicContact CE1-CB 3.71Å; Y177-K198 HydrophobicContact CE1-CG 4.33Å; Y177-K199 WeakPolarHBondContact O-CE 3.47Å
178	H	98.5	Very high	94	Very high	76 Å²	76	56.4 Å²	56.4	35%	0.352	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	133.7	156.6	-62.7	-74.4	0	0	0	108.4	F180 L196 V197	H178-F180 HydrophobicContact CB-CD2 4.49Å; H178-F180 HydrophobicContact CB-CE2 3.53Å; H178-F180 HydrophobicContact CB-CZ 3.76Å; H178-L196 CarbonylContact O-C 3.58Å; H178-L196 VanDerWaalsContact O-CA 3.26Å; H178-L196 WeakPolarHBondContact O-CA 3.45Å; H178-V197 PolarHBondContact N-O 2.98Å; H178-V197 PolarHBondContact O-N 3.33Å
179	I	98.5	Very high	93.5	Very high	18 Å²	18	57 Å²	57	9%	0.092	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	118.6	-176	-56.5	179.4	0	0	0	108.7	L166 L169 R170 L173 E174 V194 L196	L166-I179 HydrophobicContact CD1-CG2 3.98Å; L169-I179 HydrophobicContact CB-CD1 4.41Å; R170-I179 HydrophobicContact CG-CD1 4.1Å; L173-I179 HydrophobicContact CB-CD1 4.44Å; E174-I179 HydrophobicContact CB-CD1 4.12Å; I179-V194 HydrophobicContact CG2-CG1 3.71Å; I179-L196 HydrophobicContact CD1-CD2 4.35Å; I179-L196 HydrophobicContact CG1-CD2 4.14Å; I179-L196 HydrophobicContact CG1-CG 4.15Å; I179-L196 HydrophobicContact CG2-CG 4.48Å
180	F	98	Very high	93.1	Very high	28 Å²	28	61 Å²	61	12%	0.123	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	110.4	179.1	-56.6	-80.4	0	0	0	108.8	H178 V194 I195 V197 V205 T207 V210 L225 I227	H178-F180 HydrophobicContact CB-CD2 4.49Å; H178-F180 HydrophobicContact CB-CE2 3.53Å; H178-F180 HydrophobicContact CB-CZ 3.76Å; F180-V194 WeakPolarHBondContact O-CA 3.46Å; F180-V194 WeakPolarHBondContact O-CG1 3.39Å; F180-I195 PolarHBondContact N-O 3.21Å; F180-I195 PolarHBondContact O-N 3.28Å; F180-V197 HydrophobicContact CD2-CG2 4.37Å; F180-V197 HydrophobicContact CE2-CG2 4.1Å; F180-V205 HydrophobicContact CE2-CG1 3.96Å; F180-V205 HydrophobicContact CZ-CG1 3.67Å; F180-T207 HydrophobicContact CE1-CG2 4.15Å; F180-T207 HydrophobicContact CZ-CG2 4.2Å; F180-V210 HydrophobicContact CD1-CG2 3.53Å; F180-V210 HydrophobicContact CE1-CG2 3.81Å; F180-V210 HydrophobicContact CG-CG2 4.24Å; F180-L225 WeakPolarHBondContact O-CD2 3.33Å; F180-I227 HydrophobicContact CD1-CD1 3.88Å; F180-I227 HydrophobicContact CD2-CD1 3.48Å; F180-I227 VanDerWaalsContact CD2-CD1 3.48Å; F180-I227 HydrophobicContact CE1-CD1 3.63Å; F180-I227 HydrophobicContact CE2-CD1 3.21Å; F180-I227 HydrophobicContact CG-CD1 3.81Å; F180-I227 HydrophobicContact CZ-CD1 3.3Å
181	S	96.9	Very high	93	Very high	2 Å²	2	58.4 Å²	58.4	1%	0.014	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	138.4	-179.3	-176.6	0	0	0	0	111.3	S183 D184 F192	S181-S183 PolarHBondContact O-N 2.87Å; S181-S183 PolarHBondContact OG-N 3.18Å; S181-S183 PolarHBondContact OG-OG 2.95Å; S181-D184 WeakPolarHBondContact CB-OD2 3.43Å; S181-D184 PolarHBondContact N-OD2 3.19Å; S181-D184 WeakPolarHBondContact O-CB 3.47Å; S181-D184 PolarHBondContact O-N 3.18Å; S181-D184 VanDerWaalsContact O-N 3.17Å; S181-F192 WeakPolarHBondContact OG-CD2 3.48Å; S181-F192 WeakPolarHBondContact OG-CE2 3.35Å
182	A	93.5	Very high	93	Very high	0 Å²	0	52 Å²	52	0%	0	28%	0.277	C	S	.	.	G	3₁₀ helix	trans	-63.9	-25.3	172.5	0	0	0	0	0	112.4	D184 H185 N186 W189 F192 V193 I212 H223	A182-D184 PolarHBondContact O-N 2.69Å; A182-H185 PolarHBondContact O-N 3.02Å; A182-N186 PolarHBondContact O-N 3.04Å; A182-W189 HydrophobicContact CB-CE3 4.04Å; A182-W189 HydrophobicContact CB-CZ3 3.58Å; A182-F192 HydrophobicContact CB-CB 4.03Å; A182-V193 PolarHBondContact N-O 3.47Å; A182-I212 HydrophobicContact CB-CD1 4.21Å; A182-I212 HydrophobicContact CB-CG1 4.32Å; A182-I212 HydrophobicContact CB-CG2 4.32Å; A182-H223 WeakPolarHBondContact CB-NE2 3.47Å
183	S	92.2	Very high	93	Very high	11 Å²	11	49.3 Å²	49.3	8%	0.077	27%	0.266	C	S	.	.	G	3₁₀ helix	trans	-65.9	-23.1	176.2	68.9	0	0	0	0	114.2	L166 S181 H185 N186 S187 F192	L166-S183 VanDerWaalsContact CD2-OG 3.29Å; L166-S183 WeakPolarHBondContact CD2-OG 3.44Å; S181-S183 PolarHBondContact O-N 2.87Å; S181-S183 PolarHBondContact OG-N 3.18Å; S181-S183 PolarHBondContact OG-OG 2.95Å; S183-H185 PolarHBondContact O-N 2.93Å; S183-H185 VanDerWaalsContact O-N 3.16Å; S183-N186 WeakPolarHBondContact CA-O 3.49Å; S183-N186 CarbonylContact O-C 3.44Å; S183-N186 PolarHBondContact O-N 2.89Å; S183-S187 PolarHBondContact O-N 2.72Å; S183-F192 VanDerWaalsContact CB-CE1 3.5Å
184	D	88.2	Confident	93	Very high	81 Å²	81	49.3 Å²	49.3	43%	0.433	27%	0.266	S	S	.	.	G	3₁₀ helix	trans	-66.1	-17.4	-179.9	-64.9	-28.5	0	0	0	111.8	R170 S181 A182	R170-D184 IonicContact CZ-OD1 3.86Å; R170-D184 IonicContact NH1-OD1 2.83Å; R170-D184 IonicContact NH2-OD1 3.16Å; R170-D184 PolarHBondContact NH2-OD1 3.41Å; R170-D184 IonicContact NH2-OD2 3.41Å; R170-D184 PolarHBondContact NH2-OD2 2.9Å; S181-D184 WeakPolarHBondContact CB-OD2 3.43Å; S181-D184 PolarHBondContact N-OD2 3.19Å; S181-D184 WeakPolarHBondContact O-CB 3.47Å; S181-D184 PolarHBondContact O-N 3.18Å; S181-D184 VanDerWaalsContact O-N 3.17Å; A182-D184 PolarHBondContact O-N 2.69Å
185	H	81.9	Confident	93	Very high	132 Å²	132	44.8 Å²	44.8	61%	0.611	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-111.2	-16.9	178.1	-57.8	-99.5	0	0	0	112.9	A182 S183 I212	A182-H185 PolarHBondContact O-N 3.02Å; S183-H185 PolarHBondContact O-N 2.93Å; S183-H185 VanDerWaalsContact O-N 3.16Å; H185-I212 HydrophobicContact CB-CD1 3.69Å; H185-I212 WeakPolarHBondContact CD2-CD1 3.26Å; H185-I212 VanDerWaalsContact CG-CD1 3.42Å
186	N	81.3	Confident	93.1	Very high	51 Å²	51	40.2 Å²	40.2	27%	0.273	21%	0.213	S	C	.	.			trans	-150.9	98.4	176.4	-171.1	-8.3	0	0	0	111.3	A182 S183 L188 W189	A182-N186 PolarHBondContact O-N 3.04Å; S183-N186 WeakPolarHBondContact CA-O 3.49Å; S183-N186 CarbonylContact O-C 3.44Å; S183-N186 PolarHBondContact O-N 2.89Å; N186-L188 PolarHBondContact O-N 2.69Å; N186-L188 WeakPolarHBondContact OD1-CB 3.42Å; N186-L188 PolarHBondContact OD1-N 3.22Å; N186-L188 VanDerWaalsContact OD1-N 3.13Å; N186-W189 HydrophobicContact CB-CD2 4.13Å; N186-W189 HydrophobicContact CB-CE3 3.98Å; N186-W189 HydrophobicContact CB-CH2 4.31Å; N186-W189 HydrophobicContact CB-CZ2 4.44Å; N186-W189 HydrophobicContact CB-CZ3 4.05Å
187	S	77.5	Confident	93.1	Very high	96 Å²	96	37.2 Å²	37.2	67%	0.671	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75	-3.3	-179	57.1	0	0	0	0	114.6	S183	S183-S187 PolarHBondContact O-N 2.72Å
188	L	83.4	Confident	93.1	Very high	144 Å²	144	38.4 Å²	38.4	75%	0.754	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87	-4.9	-178.6	-60.6	173.2	0	0	0	113.5	N186	N186-L188 PolarHBondContact O-N 2.69Å; N186-L188 WeakPolarHBondContact OD1-CB 3.42Å; N186-L188 PolarHBondContact OD1-N 3.22Å; N186-L188 VanDerWaalsContact OD1-N 3.13Å
189	W	88.4	Confident	93.1	Very high	26 Å²	26	39.3 Å²	39.3	10%	0.098	20%	0.203	C	C	.	.			trans	-81.1	122.2	177.3	-71.4	-28.6	0	0	0	111.8	A182 N186 Y191 F192 I212 P214 N221 H223	A182-W189 HydrophobicContact CB-CE3 4.04Å; A182-W189 HydrophobicContact CB-CZ3 3.58Å; N186-W189 HydrophobicContact CB-CD2 4.13Å; N186-W189 HydrophobicContact CB-CE3 3.98Å; N186-W189 HydrophobicContact CB-CH2 4.31Å; N186-W189 HydrophobicContact CB-CZ2 4.44Å; N186-W189 HydrophobicContact CB-CZ3 4.05Å; W189-Y191 PolarHBondContact O-N 3.17Å; W189-F192 HydrophobicContact CB-CD1 4.47Å; W189-F192 HydrophobicContact CE3-CB 4.38Å; W189-I212 HydrophobicContact CH2-CG2 3.62Å; W189-I212 HydrophobicContact CZ3-CG2 3.88Å; W189-P214 HydrophobicContact CH2-CG 4.44Å; W189-P214 HydrophobicContact CZ2-CG 4.22Å; W189-N221 HydrophobicContact CG-CB 4.39Å; W189-H223 AromaticContact CD2-CE1 3.99Å; W189-H223 AromaticContact CE3-CE1 3.57Å; W189-H223 AromaticContact CE3-ND1 3.87Å; W189-H223 HydrophobicContact CH2-CB 3.93Å; W189-H223 AromaticContact CH2-CG 3.64Å; W189-H223 AromaticContact CH2-ND1 3.66Å; W189-H223 HydrophobicContact CZ2-CB 4.28Å; W189-H223 AromaticContact CZ2-ND1 3.82Å; W189-H223 AromaticContact CZ3-CD2 3.91Å; W189-H223 AromaticContact CZ3-CE1 3.66Å; W189-H223 AromaticContact CZ3-CG 3.85Å; W189-H223 AromaticContact CZ3-ND1 3.7Å; W189-H223 AromaticContact CZ3-NE2 3.82Å
190	D	90.5	Very high	93	Very high	83 Å²	83	40.7 Å²	40.7	44%	0.444	21%	0.209	S	C	.	.	S	Bend	trans	-60.5	-31.7	176.9	-67.5	-31.1	0	0	0	112.7	Q48 I162	Q48-D190 PolarHBondContact NE2-OD2 3.09Å; I162-D190 WeakPolarHBondContact CG2-O 3.38Å
191	Y	96.2	Very high	92.8	Very high	24 Å²	24	44.5 Å²	44.5	9%	0.094	24%	0.236	C	C	.	.	S	Bend	trans	-151.5	155.8	173.4	67.2	-79.6	0	0	0	110.3	L132 E160 V161 W189 M220 R222 H250	L132-Y191 HydrophobicContact CD1-CD1 4.01Å; L132-Y191 HydrophobicContact CD1-CE1 4.21Å; L132-Y191 HydrophobicContact CD1-CG 4.18Å; L132-Y191 HydrophobicContact CD2-CD1 3.96Å; L132-Y191 HydrophobicContact CD2-CG 4.17Å; L132-Y191 HydrophobicContact CG-CD1 4.42Å; L132-Y191 HydrophobicContact CG-CG 4.37Å; E160-Y191 HydrophobicContact CG-CD2 4.23Å; E160-Y191 HydrophobicContact CG-CE2 4.5Å; V161-Y191 CarbonylContact O-C 3.34Å; V161-Y191 WeakPolarHBondContact O-CA 3.31Å; W189-Y191 PolarHBondContact O-N 3.17Å; Y191-M220 PolarHBondContact OH-O 3.46Å; Y191-R222 PolarHBondContact OH-NE 2.87Å; Y191-R222 PolarHBondContact OH-NH2 3.37Å; Y191-H250 AromaticContact CE2-ND1 3.92Å
192	F	98	Very high	92.7	Very high	2 Å²	2	47 Å²	47	1%	0.009	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	174.4	-171.1	42.9	-92.5	0	0	0	112	V161 L163 L166 S181 A182 S183 W189 V194	V161-F192 HydrophobicContact CB-CD2 4.04Å; V161-F192 HydrophobicContact CB-CE2 3.9Å; V161-F192 WeakPolarHBondContact CB-O 3.4Å; V161-F192 HydrophobicContact CG1-CD2 4.37Å; V161-F192 HydrophobicContact CG1-CE2 3.74Å; V161-F192 HydrophobicContact CG1-CZ 4.31Å; V161-F192 PolarHBondContact N-O 3.4Å; V161-F192 PolarHBondContact O-N 2.81Å; L163-F192 HydrophobicContact CD2-CE1 4.09Å; L163-F192 HydrophobicContact CD2-CZ 4.09Å; L163-F192 HydrophobicContact CG-CE1 4.4Å; L166-F192 HydrophobicContact CB-CE2 4.25Å; L166-F192 HydrophobicContact CB-CZ 4.18Å; L166-F192 HydrophobicContact CD2-CE2 4.01Å; L166-F192 HydrophobicContact CD2-CZ 4.02Å; S181-F192 WeakPolarHBondContact OG-CD2 3.48Å; S181-F192 WeakPolarHBondContact OG-CE2 3.35Å; A182-F192 HydrophobicContact CB-CB 4.03Å; S183-F192 VanDerWaalsContact CB-CE1 3.5Å; W189-F192 HydrophobicContact CB-CD1 4.47Å; W189-F192 HydrophobicContact CE3-CB 4.38Å; F192-V194 HydrophobicContact CD2-CG2 3.95Å; F192-V194 HydrophobicContact CE2-CG2 3.98Å
193	V	98.4	Very high	92.9	Very high	2 Å²	2	47.5 Å²	47.5	1%	0.012	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	153	172	-55.1	0	0	0	0	111.3	L158 Q159 A182 H223 L225 T248 H250	L158-V193 CarbonylContact O-C 3.59Å; L158-V193 WeakPolarHBondContact O-CA 3.46Å; L158-V193 WeakPolarHBondContact O-CB 3.3Å; Q159-V193 HydrophobicContact CB-CG1 4.33Å; Q159-V193 HydrophobicContact CG-CG1 3.92Å; A182-V193 PolarHBondContact N-O 3.47Å; V193-H223 PolarHBondContact N-NE2 2.85Å; V193-L225 HydrophobicContact CG2-CB 3.52Å; V193-L225 HydrophobicContact CG2-CD2 4.03Å; V193-L225 HydrophobicContact CG2-CG 4.43Å; V193-T248 HydrophobicContact CB-CG2 3.97Å; V193-T248 HydrophobicContact CG2-CG2 3.81Å; V193-H250 HydrophobicContact CG1-CB 4.16Å
194	V	98.8	Very high	93.2	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	140.5	178.3	177.7	0	0	0	0	109.3	C157 L158 V161 L166 I179 F180 F192 L196	C157-V194 WeakPolarHBondContact CA-O 3.41Å; L158-V194 HydrophobicContact CB-CB 4.44Å; L158-V194 PolarHBondContact N-O 3.45Å; L158-V194 PolarHBondContact O-N 3.48Å; V161-V194 HydrophobicContact CB-CG2 3.91Å; V161-V194 HydrophobicContact CG1-CG2 3.89Å; V161-V194 HydrophobicContact CG2-CB 4.14Å; V161-V194 HydrophobicContact CG2-CG2 3.71Å; L166-V194 HydrophobicContact CD1-CG2 4.33Å; I179-V194 HydrophobicContact CG2-CG1 3.71Å; F180-V194 WeakPolarHBondContact O-CA 3.46Å; F180-V194 WeakPolarHBondContact O-CG1 3.39Å; F192-V194 HydrophobicContact CD2-CG2 3.95Å; F192-V194 HydrophobicContact CE2-CG2 3.98Å; V194-L196 HydrophobicContact CB-CD1 4.47Å; V194-L196 HydrophobicContact CG1-CD1 3.67Å; V194-L196 HydrophobicContact CG1-CG 4.3Å
195	I	98.9	Very high	93.6	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	126.7	165.6	-61.4	175.6	0	0	0	108.3	V155 V156 F180 V197 L225 I227 I246 T248	V155-I195 HydrophobicContact CG1-CG2 4.07Å; V156-I195 CarbonylContact O-C 3.58Å; V156-I195 WeakPolarHBondContact O-CA 3.38Å; F180-I195 PolarHBondContact N-O 3.21Å; F180-I195 PolarHBondContact O-N 3.28Å; I195-V197 HydrophobicContact CG2-CG2 3.95Å; I195-L225 HydrophobicContact CB-CD2 4.29Å; I195-L225 HydrophobicContact CD1-CD2 4.16Å; I195-L225 HydrophobicContact CD1-CG 3.84Å; I195-L225 HydrophobicContact CG1-CD2 3.77Å; I195-L225 HydrophobicContact CG1-CG 4.04Å; I195-I227 HydrophobicContact CD1-CG2 4.01Å; I195-I227 HydrophobicContact CG2-CG2 4.03Å; I195-I246 HydrophobicContact CD1-CB 4.4Å; I195-I246 HydrophobicContact CD1-CG2 3.92Å; I195-I246 HydrophobicContact CG2-CG2 4.39Å; I195-T248 HydrophobicContact CD1-CG2 3.88Å; I195-T248 HydrophobicContact CG1-CG2 3.43Å; I195-T248 VanDerWaalsContact CG1-CG2 3.43Å
196	L	98.9	Very high	94.4	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	133.7	168.5	-57.4	81.1	0	0	0	108.6	V155 V156 L158 L169 L173 Y177 H178 I179 V194	V155-L196 CarbonylContact C-O 3.59Å; V155-L196 WeakPolarHBondContact CA-O 3.44Å; V156-L196 HydrophobicContact CB-CB 4.15Å; V156-L196 HydrophobicContact CB-CD1 4.23Å; V156-L196 HydrophobicContact CG1-CD1 4.34Å; V156-L196 PolarHBondContact N-O 2.79Å; V156-L196 PolarHBondContact O-N 3.02Å; L158-L196 HydrophobicContact CD1-CD1 3.76Å; L158-L196 HydrophobicContact CG-CD1 4.02Å; L169-L196 HydrophobicContact CD2-CD2 4.45Å; L173-L196 HydrophobicContact CB-CD2 4.35Å; L173-L196 HydrophobicContact CD1-CD2 3.63Å; Y177-L196 HydrophobicContact CD1-CB 3.8Å; Y177-L196 HydrophobicContact CG-CB 4.28Å; H178-L196 CarbonylContact O-C 3.58Å; H178-L196 VanDerWaalsContact O-CA 3.26Å; H178-L196 WeakPolarHBondContact O-CA 3.45Å; I179-L196 HydrophobicContact CD1-CD2 4.35Å; I179-L196 HydrophobicContact CG1-CD2 4.14Å; I179-L196 HydrophobicContact CG1-CG 4.15Å; I179-L196 HydrophobicContact CG2-CG 4.48Å; V194-L196 HydrophobicContact CB-CD1 4.47Å; V194-L196 HydrophobicContact CG1-CD1 3.67Å; V194-L196 HydrophobicContact CG1-CG 4.3Å
197	V	98.8	Very high	95.1	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	122.7	176.5	-173.5	0	0	0	0	108.9	Y177 H178 F180 I195 K199 I203 V205 I227 L229	Y177-V197 CarbonylContact C-O 3.56Å; Y177-V197 VanDerWaalsContact CA-O 3.29Å; Y177-V197 WeakPolarHBondContact CA-O 3.48Å; Y177-V197 VanDerWaalsContact CD1-C 3.48Å; H178-V197 PolarHBondContact N-O 2.98Å; H178-V197 PolarHBondContact O-N 3.33Å; F180-V197 HydrophobicContact CD2-CG2 4.37Å; F180-V197 HydrophobicContact CE2-CG2 4.1Å; I195-V197 HydrophobicContact CG2-CG2 3.95Å; V197-K199 PolarHBondContact O-N 3.27Å; V197-I203 HydrophobicContact CG1-CG2 3.8Å; V197-V205 HydrophobicContact CB-CG2 4.15Å; V197-V205 HydrophobicContact CG1-CG2 3.72Å; V197-I227 HydrophobicContact CG2-CG2 4.48Å; V197-L229 HydrophobicContact CG1-CD1 4.38Å; V197-L229 HydrophobicContact CG1-CD2 3.85Å; V197-L229 HydrophobicContact CG2-CD2 4.02Å
198	K	98.6	Very high	96	Very high	31 Å²	31	51.8 Å²	51.8	14%	0.135	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.1	133.2	-179.9	-170.9	179.5	-175.9	-176.8	0	109.1	E152 H154 Y177 H200	E152-K198 HydrophobicContact CB-CD 4.5Å; E152-K198 VanDerWaalsContact OE1-CE 3.28Å; E152-K198 WeakPolarHBondContact OE1-CE 3.42Å; E152-K198 IonicContact OE1-NZ 2.85Å; E152-K198 PolarHBondContact OE1-NZ 2.96Å; E152-K198 IonicContact OE2-NZ 3.89Å; H154-K198 PolarHBondContact O-N 2.88Å; Y177-K198 VanDerWaalsContact CD1-CA 3.47Å; Y177-K198 HydrophobicContact CD1-CB 4.09Å; Y177-K198 VanDerWaalsContact CD1-N 3.31Å; Y177-K198 HydrophobicContact CE1-CB 3.71Å; Y177-K198 HydrophobicContact CE1-CG 4.33Å; K198-H200 VanDerWaalsContact C-N 3.34Å; K198-H200 PolarHBondContact O-N 3.06Å
199	K	98.1	Very high	96.6	Very high	95 Å²	95	45.7 Å²	45.7	41%	0.413	24%	0.239	S	C	.	.			trans	-69.3	96.2	168.7	-63.4	-176.6	-170.2	171.6	0	107.7	E174 S175 T176 Y177 V197	E174-K199 VanDerWaalsContact O-CE 3.32Å; E174-K199 WeakPolarHBondContact O-CE 3.08Å; E174-K199 PolarHBondContact O-NZ 2.83Å; S175-K199 WeakPolarHBondContact O-CD 3.39Å; S175-K199 PolarHBondContact O-NZ 2.89Å; S175-K199 VanDerWaalsContact O-NZ 3.13Å; T176-K199 WeakPolarHBondContact O-CB 3.42Å; T176-K199 PolarHBondContact O-N 3.03Å; Y177-K199 WeakPolarHBondContact O-CE 3.47Å; V197-K199 PolarHBondContact O-N 3.27Å
200	H	96.6	Very high	97	Very high	47 Å²	47	46 Å²	46	22%	0.218	24%	0.243	C	C	.	.			trans	-127	137.1	-175.2	-168.8	-89.1	0	0	0	109.1	K198 D202 I203 F234	K198-H200 VanDerWaalsContact C-N 3.34Å; K198-H200 PolarHBondContact O-N 3.06Å; H200-D202 IonicContact CE1-OD2 3.63Å; H200-D202 PolarHBondContact CE1-OD2 2.85Å; H200-D202 PolarHBondContact ND1-N 2.59Å; H200-D202 VanDerWaalsContact ND1-N 3.18Å; H200-D202 IonicContact ND1-OD2 3.78Å; H200-D202 PolarHBondContact O-N 3.18Å; H200-D202 VanDerWaalsContact O-N 3.11Å; H200-I203 HydrophobicContact CB-CB 4.13Å; H200-I203 HydrophobicContact CB-CD1 3.84Å; H200-I203 HydrophobicContact CB-CG1 3.89Å; H200-I203 PolarHBondContact O-N 3.33Å; H200-I203 VanDerWaalsContact O-N 3.07Å; H200-F234 AromaticContact CE1-CZ 3.81Å; H200-F234 AromaticContact ND1-CZ 3.75Å
201	P	94.6	Very high	97.3	Very high	107 Å²	107	43.8 Å²	43.8	70%	0.695	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-30.8	-177.9	21.7	-34	0	0	0	113.5
202	D	94.5	Very high	97.4	Very high	54 Å²	54	44.3 Å²	44.3	29%	0.289	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.3	0.9	-177.4	-53.7	-45	0	0	0	114.4	H200 Q233 F234	H200-D202 IonicContact CE1-OD2 3.63Å; H200-D202 PolarHBondContact CE1-OD2 2.85Å; H200-D202 PolarHBondContact ND1-N 2.59Å; H200-D202 VanDerWaalsContact ND1-N 3.18Å; H200-D202 IonicContact ND1-OD2 3.78Å; H200-D202 PolarHBondContact O-N 3.18Å; H200-D202 VanDerWaalsContact O-N 3.11Å; D202-Q233 HydrophobicContact CB-CB 3.79Å; D202-F234 HydrophobicContact CB-CD2 3.81Å; D202-F234 HydrophobicContact CB-CE1 4.43Å; D202-F234 HydrophobicContact CB-CE2 3.61Å; D202-F234 HydrophobicContact CB-CG 4.31Å; D202-F234 HydrophobicContact CB-CZ 3.95Å; D202-F234 WeakPolarHBondContact O-CE2 3.11Å
203	I	97.2	Very high	97.3	Very high	12 Å²	12	48 Å²	48	6%	0.062	26%	0.256	C	S	.	.			trans	-109.8	111.6	173.7	-58	176.1	0	0	0	108.2	H154 V197 H200 V205 L229 L231 F234	H154-I203 HydrophobicContact CB-CD1 3.92Å; V197-I203 HydrophobicContact CG1-CG2 3.8Å; H200-I203 HydrophobicContact CB-CB 4.13Å; H200-I203 HydrophobicContact CB-CD1 3.84Å; H200-I203 HydrophobicContact CB-CG1 3.89Å; H200-I203 PolarHBondContact O-N 3.33Å; H200-I203 VanDerWaalsContact O-N 3.07Å; I203-V205 HydrophobicContact CG2-CG2 4.29Å; I203-L229 HydrophobicContact CG2-CB 4.47Å; I203-L229 HydrophobicContact CG2-CD1 4.45Å; I203-L229 HydrophobicContact CG2-CD2 4.2Å; I203-L231 HydrophobicContact CB-CD2 4.4Å; I203-L231 HydrophobicContact CG1-CD2 3.92Å; I203-L231 HydrophobicContact CG2-CD2 4.14Å; I203-F234 HydrophobicContact CD1-CE2 4.42Å; I203-F234 HydrophobicContact CG1-CE2 3.62Å; I203-F234 HydrophobicContact CG1-CZ 4.11Å
204	K	97.7	Very high	97.2	Very high	117 Å²	117	51.8 Å²	51.8	51%	0.509	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	120.9	169	-63.7	177.4	-177.2	175.1	0	109	L229 N230	K204-L229 CarbonylContact O-C 3.55Å; K204-L229 WeakPolarHBondContact O-CA 3.23Å; K204-N230 HydrophobicContact CB-CB 4.19Å; K204-N230 PolarHBondContact N-O 3.15Å; K204-N230 VanDerWaalsContact N-O 3.07Å; K204-N230 PolarHBondContact O-N 3.08Å
205	V	98.3	Very high	97.1	Very high	33 Å²	33	52.6 Å²	52.6	20%	0.2	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	127.7	177.6	-173.6	0	0	0	0	109.3	F180 V197 I203 T207 I227 L229	F180-V205 HydrophobicContact CE2-CG1 3.96Å; F180-V205 HydrophobicContact CZ-CG1 3.67Å; V197-V205 HydrophobicContact CB-CG2 4.15Å; V197-V205 HydrophobicContact CG1-CG2 3.72Å; I203-V205 HydrophobicContact CG2-CG2 4.29Å; V205-T207 HydrophobicContact CG1-CG2 4.39Å; V205-T207 PolarHBondContact O-N 3.27Å; V205-I227 HydrophobicContact CG1-CD1 3.32Å; V205-I227 HydrophobicContact CG1-CG1 4.06Å; V205-L229 HydrophobicContact CB-CD2 4.39Å; V205-L229 HydrophobicContact CG1-CD2 4.21Å; V205-L229 HydrophobicContact CG2-CD2 3.96Å
206	D	97.5	Very high	97	Very high	76 Å²	76	58.3 Å²	58.3	41%	0.406	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	95.6	168.9	-178.1	-5.6	0	0	0	108.8	D208 S209 D228	D206-D208 PolarHBondContact O-N 3.3Å; D206-D208 PolarHBondContact OD1-N 3.05Å; D206-D208 VanDerWaalsContact OD1-N 3.14Å; D206-S209 WeakPolarHBondContact O-CB 3.41Å; D206-S209 PolarHBondContact O-N 2.88Å; D206-S209 PolarHBondContact O-OG 3.04Å; D206-S209 PolarHBondContact OD1-N 3.42Å; D206-D228 HydrophobicContact CB-CB 4.16Å; D206-D228 PolarHBondContact N-O 3.15Å
207	T	95.7	Very high	96.9	Very high	82 Å²	82	63.5 Å²	63.5	50%	0.503	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	-24.9	-177.6	51.2	0	0	0	0	113.2	F180 V205 S209 V210	F180-T207 HydrophobicContact CE1-CG2 4.15Å; F180-T207 HydrophobicContact CZ-CG2 4.2Å; V205-T207 HydrophobicContact CG1-CG2 4.39Å; V205-T207 PolarHBondContact O-N 3.27Å; T207-S209 PolarHBondContact O-N 2.95Å; T207-V210 VanDerWaalsContact O-CG2 3.3Å; T207-V210 WeakPolarHBondContact O-CG2 3.47Å; T207-V210 PolarHBondContact O-N 3.23Å
208	D	96.3	Very high	96.8	Very high	152 Å²	152	64.5 Å²	64.5	81%	0.813	36%	0.356	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.3	-17.3	179.6	-63	-23.4	0	0	0	111.5	D206 V210	D206-D208 PolarHBondContact O-N 3.3Å; D206-D208 PolarHBondContact OD1-N 3.05Å; D206-D208 VanDerWaalsContact OD1-N 3.14Å; D208-V210 VanDerWaalsContact C-N 3.29Å; D208-V210 PolarHBondContact O-N 2.87Å
209	S	96.6	Very high	96.7	Very high	17 Å²	17	66.4 Å²	66.4	12%	0.119	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	-7.7	176.3	77.1	0	0	0	0	114.7	D206 T207 S211 D228	D206-S209 WeakPolarHBondContact O-CB 3.41Å; D206-S209 PolarHBondContact O-N 2.88Å; D206-S209 PolarHBondContact O-OG 3.04Å; D206-S209 PolarHBondContact OD1-N 3.42Å; T207-S209 PolarHBondContact O-N 2.95Å; S209-S211 PolarHBondContact O-N 2.62Å; S209-D228 WeakPolarHBondContact OG-CB 3.39Å; S209-D228 PolarHBondContact OG-N 3.04Å
210	V	97.6	Very high	96.6	Very high	32 Å²	32	62.2 Å²	62.2	19%	0.194	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.3	122.4	-179.2	175.8	0	0	0	0	109.4	F180 T207 D208 L225 S226 I227	F180-V210 HydrophobicContact CD1-CG2 3.53Å; F180-V210 HydrophobicContact CE1-CG2 3.81Å; F180-V210 HydrophobicContact CG-CG2 4.24Å; T207-V210 VanDerWaalsContact O-CG2 3.3Å; T207-V210 WeakPolarHBondContact O-CG2 3.47Å; T207-V210 PolarHBondContact O-N 3.23Å; D208-V210 VanDerWaalsContact C-N 3.29Å; D208-V210 PolarHBondContact O-N 2.87Å; V210-L225 HydrophobicContact CG1-CD1 4.17Å; V210-S226 WeakPolarHBondContact CA-O 3.16Å; V210-I227 HydrophobicContact CG2-CB 4.4Å; V210-I227 HydrophobicContact CG2-CD1 3.61Å; V210-I227 HydrophobicContact CG2-CG1 3.87Å
211	S	97	Very high	96.5	Very high	37 Å²	37	63.2 Å²	63.2	26%	0.259	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	135	-178.8	-167.6	0	0	0	0	110.7	S209 L225 S226	S209-S211 PolarHBondContact O-N 2.62Å; S211-L225 CarbonylContact O-C 3.57Å; S211-L225 WeakPolarHBondContact O-CA 3.41Å; S211-S226 PolarHBondContact N-O 3.28Å; S211-S226 PolarHBondContact O-N 2.95Å
212	I	96.9	Very high	96.6	Very high	34 Å²	34	58.4 Å²	58.4	17%	0.174	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	118.4	174.9	-64.3	152.6	0	0	0	107.9	A182 H185 W189 H223 L224 L225	A182-I212 HydrophobicContact CB-CD1 4.21Å; A182-I212 HydrophobicContact CB-CG1 4.32Å; A182-I212 HydrophobicContact CB-CG2 4.32Å; H185-I212 HydrophobicContact CB-CD1 3.69Å; H185-I212 WeakPolarHBondContact CD2-CD1 3.26Å; H185-I212 VanDerWaalsContact CG-CD1 3.42Å; W189-I212 HydrophobicContact CH2-CG2 3.62Å; W189-I212 HydrophobicContact CZ3-CG2 3.88Å; I212-H223 HydrophobicContact CG2-CB 4.39Å; I212-L224 CarbonylContact C-O 3.56Å; I212-L224 WeakPolarHBondContact CA-O 3.44Å; I212-L225 HydrophobicContact CD1-CD1 4.3Å; I212-L225 HydrophobicContact CG1-CD1 3.57Å
213	Q	96.4	Very high	96.8	Very high	80 Å²	80	56.1 Å²	56.1	37%	0.374	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	103.8	-177	-61.3	-178.8	-20.1	0	0	109	H223 L224	Q213-H223 CarbonylContact O-C 3.57Å; Q213-H223 VanDerWaalsContact O-CA 3.28Å; Q213-H223 WeakPolarHBondContact O-CA 3.45Å; Q213-H223 WeakPolarHBondContact O-CB 3.43Å; Q213-L224 HydrophobicContact CB-CB 4.34Å; Q213-L224 PolarHBondContact N-O 2.84Å; Q213-L224 PolarHBondContact O-N 2.88Å
214	P	96.4	Very high	96.8	Very high	82 Å²	82	55.6 Å²	55.6	53%	0.532	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.3	139.7	172.7	-21.6	33.2	0	0	0	111.4	W189 P216	W189-P214 HydrophobicContact CH2-CG 4.44Å; W189-P214 HydrophobicContact CZ2-CG 4.22Å; P214-P216 WeakPolarHBondContact O-CD 3.28Å
215	F	97.6	Very high	96.9	Very high	17 Å²	17	50.1 Å²	50.1	8%	0.075	29%	0.288	C	S	.	.			trans	-79.4	115.4	168.3	-64.3	-57.5	0	0	0	108.5	N217 S218 R222 L224 A249 L251 Q264 V268	F215-N217 PolarHBondContact O-N 2.83Å; F215-N217 VanDerWaalsContact O-N 3.14Å; F215-S218 WeakPolarHBondContact O-CB 3.28Å; F215-S218 PolarHBondContact O-N 2.78Å; F215-S218 VanDerWaalsContact O-N 3.1Å; F215-R222 HydrophobicContact CD2-CB 3.7Å; F215-R222 HydrophobicContact CE2-CB 4.4Å; F215-R222 PolarHBondContact N-O 3.33Å; F215-L224 HydrophobicContact CE1-CB 4.38Å; F215-L224 HydrophobicContact CZ-CB 3.94Å; F215-A249 HydrophobicContact CE2-CB 4.18Å; F215-A249 HydrophobicContact CZ-CB 4.37Å; F215-L251 HydrophobicContact CE2-CD2 3.85Å; F215-L251 HydrophobicContact CZ-CD2 4.01Å; F215-Q264 HydrophobicContact CB-CG 3.99Å; F215-Q264 HydrophobicContact CD1-CB 4.13Å; F215-Q264 HydrophobicContact CD1-CG 3.87Å; F215-Q264 HydrophobicContact CD2-CB 4.32Å; F215-Q264 HydrophobicContact CD2-CG 3.88Å; F215-Q264 HydrophobicContact CE1-CB 4.06Å; F215-Q264 HydrophobicContact CE1-CG 4.32Å; F215-Q264 HydrophobicContact CE2-CB 4.27Å; F215-Q264 HydrophobicContact CE2-CG 4.32Å; F215-Q264 HydrophobicContact CG-CB 4.27Å; F215-Q264 HydrophobicContact CG-CG 3.64Å; F215-Q264 HydrophobicContact CZ-CB 4.14Å; F215-V268 HydrophobicContact CE1-CG2 4.1Å; F215-V268 HydrophobicContact CZ-CG2 3.77Å
216	P	96	Very high	96.9	Very high	119 Å²	119	48.7 Å²	48.7	77%	0.773	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-24.9	-166	24.2	-34.5	0	0	0	113.9	P214	P214-P216 WeakPolarHBondContact O-CD 3.28Å
217	N	97	Very high	96.9	Very high	109 Å²	109	45.1 Å²	45.1	58%	0.583	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.1	1.8	-178.7	-64.8	-32.6	0	0	0	113	F215 V219 E260	F215-N217 PolarHBondContact O-N 2.83Å; F215-N217 VanDerWaalsContact O-N 3.14Å; N217-V219 PolarHBondContact O-N 2.93Å; N217-E260 WeakPolarHBondContact CB-OE2 3.07Å
218	S	97	Very high	97	Very high	21 Å²	21	42.2 Å²	42.2	15%	0.147	24%	0.242	C	C	.	.			trans	-62.5	132	175.2	151.6	0	0	0	0	109.6	F215 M220 N221 R222 E252 E260	F215-S218 WeakPolarHBondContact O-CB 3.28Å; F215-S218 PolarHBondContact O-N 2.78Å; F215-S218 VanDerWaalsContact O-N 3.1Å; S218-M220 PolarHBondContact OG-N 3.22Å; S218-M220 VanDerWaalsContact OG-N 3.13Å; S218-N221 PolarHBondContact OG-N 3.44Å; S218-R222 PolarHBondContact OG-N 3.14Å; S218-E252 WeakPolarHBondContact CB-OE2 3.27Å; S218-E252 PolarHBondContact OG-OE2 2.78Å; S218-E260 PolarHBondContact N-OE1 2.91Å
219	V	95.8	Very high	97.1	Very high	72 Å²	72	35 Å²	35	44%	0.436	20%	0.203	S	C	.	.	S	Bend	trans	-97.8	-2.1	170.7	-60.6	0	0	0	0	111.8	M45 N217 E252 Y257	M45-V219 WeakPolarHBondContact CG-O 3.41Å; M45-V219 HydrophobicContact SD-CB 3.69Å; M45-V219 HydrophobicContact SD-CG2 3.46Å; M45-V219 WeakPolarHBondContact SD-CG2 3.33Å; M45-V219 VanDerWaalsContact SD-O 3.39Å; N217-V219 PolarHBondContact O-N 2.93Å; V219-E252 WeakPolarHBondContact CG2-OE1 3.28Å; V219-E252 PolarHBondContact N-OE1 2.84Å; V219-Y257 HydrophobicContact CG2-CD1 4.03Å; V219-Y257 HydrophobicContact CG2-CE1 3.41Å; V219-Y257 VanDerWaalsContact CG2-CE1 3.41Å
220	M	95.7	Very high	97.2	Very high	7 Å²	7	36 Å²	36	3%	0.034	21%	0.207	C	C	.	.	S	Bend	trans	-116.5	26.1	-178.3	-58.9	-179.9	-166.3	0	0	113.1	L42 Y191 S218 R222 E252 Y257	L42-M220 HydrophobicContact CD1-CE 4.24Å; Y191-M220 PolarHBondContact OH-O 3.46Å; S218-M220 PolarHBondContact OG-N 3.22Å; S218-M220 VanDerWaalsContact OG-N 3.13Å; M220-R222 VanDerWaalsContact C-N 3.27Å; M220-R222 HydrophobicContact CB-CG 4.04Å; M220-R222 WeakPolarHBondContact O-CD 3.13Å; M220-R222 PolarHBondContact O-N 3.2Å; M220-R222 PolarHBondContact O-NE 2.77Å; M220-R222 VanDerWaalsContact O-NE 3.11Å; M220-R222 PolarHBondContact SD-NH2 3.35Å; M220-E252 HydrophobicContact CE-CG 4.31Å; M220-E252 VanDerWaalsContact CG-OE1 3.26Å; M220-E252 WeakPolarHBondContact CG-OE1 3.5Å; M220-E252 PolarHBondContact N-OE1 3.13Å; M220-E252 VanDerWaalsContact N-OE1 3.16Å; M220-E252 HydrophobicContact SD-CG 4.27Å; M220-Y257 HydrophobicContact CE-CD2 3.36Å; M220-Y257 HydrophobicContact CE-CE2 3.38Å; M220-Y257 HydrophobicContact CE-CG 4.05Å
221	N	94.5	Very high	97.1	Very high	68 Å²	68	34.5 Å²	34.5	36%	0.364	20%	0.198	S	C	.	.			trans	55.6	31.7	-179.6	-66.1	-36.6	0	0	0	115.8	W189 S218 H223	W189-N221 HydrophobicContact CG-CB 4.39Å; S218-N221 PolarHBondContact OG-N 3.44Å; N221-H223 PolarHBondContact O-ND1 3.33Å
222	R	97.1	Very high	96.9	Very high	5 Å²	5	33.4 Å²	33.4	2%	0.019	19%	0.19	C	C	.	.			trans	-74.3	146	-178.1	-50.2	-45.1	179.4	79.5	-3.3	111.8	Y191 F215 S218 M220 H250 L251 E252 S253	Y191-R222 PolarHBondContact OH-NE 2.87Å; Y191-R222 PolarHBondContact OH-NH2 3.37Å; F215-R222 HydrophobicContact CD2-CB 3.7Å; F215-R222 HydrophobicContact CE2-CB 4.4Å; F215-R222 PolarHBondContact N-O 3.33Å; S218-R222 PolarHBondContact OG-N 3.14Å; M220-R222 VanDerWaalsContact C-N 3.27Å; M220-R222 HydrophobicContact CB-CG 4.04Å; M220-R222 WeakPolarHBondContact O-CD 3.13Å; M220-R222 PolarHBondContact O-N 3.2Å; M220-R222 PolarHBondContact O-NE 2.77Å; M220-R222 VanDerWaalsContact O-NE 3.11Å; M220-R222 PolarHBondContact SD-NH2 3.35Å; R222-H250 WeakPolarHBondContact CB-O 3.4Å; R222-H250 WeakPolarHBondContact CD-O 3.26Å; R222-H250 VanDerWaalsContact CG-O 3.24Å; R222-H250 WeakPolarHBondContact CG-O 3.44Å; R222-H250 PolarHBondContact NH1-CD2 3.22Å; R222-H250 PolarHBondContact NH1-NE2 3.49Å; R222-H250 PolarHBondContact NH1-O 2.94Å; R222-L251 PolarHBondContact NH1-O 3.44Å; R222-E252 VanDerWaalsContact CG-OE2 3.24Å; R222-E252 WeakPolarHBondContact CG-OE2 3.38Å; R222-S253 PolarHBondContact NH1-OG 3.05Å; R222-S253 PolarHBondContact NH2-OG 2.9Å
223	H	97.8	Very high	96.7	Very high	6 Å²	6	36.8 Å²	36.8	3%	0.028	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.6	160.3	-176.1	48.4	-86.3	0	0	0	109.9	A182 W189 V193 I212 Q213 N221 A249	A182-H223 WeakPolarHBondContact CB-NE2 3.47Å; W189-H223 AromaticContact CD2-CE1 3.99Å; W189-H223 AromaticContact CE3-CE1 3.57Å; W189-H223 AromaticContact CE3-ND1 3.87Å; W189-H223 HydrophobicContact CH2-CB 3.93Å; W189-H223 AromaticContact CH2-CG 3.64Å; W189-H223 AromaticContact CH2-ND1 3.66Å; W189-H223 HydrophobicContact CZ2-CB 4.28Å; W189-H223 AromaticContact CZ2-ND1 3.82Å; W189-H223 AromaticContact CZ3-CD2 3.91Å; W189-H223 AromaticContact CZ3-CE1 3.66Å; W189-H223 AromaticContact CZ3-CG 3.85Å; W189-H223 AromaticContact CZ3-ND1 3.7Å; W189-H223 AromaticContact CZ3-NE2 3.82Å; V193-H223 PolarHBondContact N-NE2 2.85Å; I212-H223 HydrophobicContact CG2-CB 4.39Å; Q213-H223 CarbonylContact O-C 3.57Å; Q213-H223 VanDerWaalsContact O-CA 3.28Å; Q213-H223 WeakPolarHBondContact O-CA 3.45Å; Q213-H223 WeakPolarHBondContact O-CB 3.43Å; N221-H223 PolarHBondContact O-ND1 3.33Å; H223-A249 WeakPolarHBondContact O-CB 3.46Å
224	L	98.5	Very high	96.3	Very high	2 Å²	2	34.5 Å²	34.5	1%	0.01	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	124.3	171	-177.4	66.6	0	0	0	108.9	I212 Q213 F215 F247 A249 V268 T271 F293	I212-L224 CarbonylContact C-O 3.56Å; I212-L224 WeakPolarHBondContact CA-O 3.44Å; Q213-L224 HydrophobicContact CB-CB 4.34Å; Q213-L224 PolarHBondContact N-O 2.84Å; Q213-L224 PolarHBondContact O-N 2.88Å; F215-L224 HydrophobicContact CE1-CB 4.38Å; F215-L224 HydrophobicContact CZ-CB 3.94Å; L224-F247 HydrophobicContact CD1-CB 4.04Å; L224-F247 HydrophobicContact CD1-CD1 4.02Å; L224-F247 HydrophobicContact CD1-CG 4.5Å; L224-F247 HydrophobicContact CD2-CD1 3.85Å; L224-F247 HydrophobicContact CD2-CE1 4.18Å; L224-F247 HydrophobicContact CG-CD1 4.04Å; L224-A249 HydrophobicContact CD1-CB 4.04Å; L224-V268 HydrophobicContact CD1-CG1 3.92Å; L224-V268 HydrophobicContact CD1-CG2 3.88Å; L224-V268 HydrophobicContact CD2-CG1 4.34Å; L224-V268 HydrophobicContact CD2-CG2 4.16Å; L224-T271 HydrophobicContact CD2-CG2 4.39Å; L224-F293 HydrophobicContact CD1-CE2 4.35Å
225	L	98.5	Very high	95.8	Very high	1 Å²	1	31 Å²	31	1%	0.005	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	135.2	169.9	171.7	62.4	0	0	0	109	F180 V193 I195 V210 S211 I212 F247 T248	F180-L225 WeakPolarHBondContact O-CD2 3.33Å; V193-L225 HydrophobicContact CG2-CB 3.52Å; V193-L225 HydrophobicContact CG2-CD2 4.03Å; V193-L225 HydrophobicContact CG2-CG 4.43Å; I195-L225 HydrophobicContact CB-CD2 4.29Å; I195-L225 HydrophobicContact CD1-CD2 4.16Å; I195-L225 HydrophobicContact CD1-CG 3.84Å; I195-L225 HydrophobicContact CG1-CD2 3.77Å; I195-L225 HydrophobicContact CG1-CG 4.04Å; V210-L225 HydrophobicContact CG1-CD1 4.17Å; S211-L225 CarbonylContact O-C 3.57Å; S211-L225 WeakPolarHBondContact O-CA 3.41Å; I212-L225 HydrophobicContact CD1-CD1 4.3Å; I212-L225 HydrophobicContact CG1-CD1 3.57Å; L225-F247 WeakPolarHBondContact O-CA 3.33Å; L225-T248 HydrophobicContact CB-CG2 4.03Å; L225-T248 HydrophobicContact CD2-CG2 4.25Å; L225-T248 HydrophobicContact CG-CG2 4.38Å; L225-T248 PolarHBondContact N-O 2.84Å; L225-T248 PolarHBondContact O-N 3.49Å
226	S	98.7	Very high	94.9	Very high	3 Å²	3	35.5 Å²	35.5	2%	0.021	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	153.3	176	72.4	0	0	0	0	114.2	V210 S211 I246	V210-S226 WeakPolarHBondContact CA-O 3.16Å; S211-S226 PolarHBondContact N-O 3.28Å; S211-S226 PolarHBondContact O-N 2.95Å; S226-I246 CarbonylContact C-O 3.51Å; S226-I246 WeakPolarHBondContact CA-O 3.49Å; S226-I246 WeakPolarHBondContact CB-O 3.29Å
227	I	98.6	Very high	94	Very high	1 Å²	1	35.2 Å²	35.2	1%	0.005	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	145.5	174.1	-166.9	168.6	0	0	0	111.3	F180 I195 V197 V205 V210 R245 I246	F180-I227 HydrophobicContact CD1-CD1 3.88Å; F180-I227 HydrophobicContact CD2-CD1 3.48Å; F180-I227 VanDerWaalsContact CD2-CD1 3.48Å; F180-I227 HydrophobicContact CE1-CD1 3.63Å; F180-I227 HydrophobicContact CE2-CD1 3.21Å; F180-I227 HydrophobicContact CG-CD1 3.81Å; F180-I227 HydrophobicContact CZ-CD1 3.3Å; I195-I227 HydrophobicContact CD1-CG2 4.01Å; I195-I227 HydrophobicContact CG2-CG2 4.03Å; V197-I227 HydrophobicContact CG2-CG2 4.48Å; V205-I227 HydrophobicContact CG1-CD1 3.32Å; V205-I227 HydrophobicContact CG1-CG1 4.06Å; V210-I227 HydrophobicContact CG2-CB 4.4Å; V210-I227 HydrophobicContact CG2-CD1 3.61Å; V210-I227 HydrophobicContact CG2-CG1 3.87Å; I227-R245 WeakPolarHBondContact O-CA 3.46Å; I227-I246 HydrophobicContact CG2-CB 4.29Å; I227-I246 PolarHBondContact N-O 3.47Å; I227-I246 PolarHBondContact O-N 2.93Å
228	D	98.3	Very high	92.9	Very high	21 Å²	21	35.9 Å²	35.9	11%	0.112	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	137	174.2	-71.3	-28.8	0	0	0	112.6	D206 S209 R245 Y275	D206-D228 HydrophobicContact CB-CB 4.16Å; D206-D228 PolarHBondContact N-O 3.15Å; S209-D228 WeakPolarHBondContact OG-CB 3.39Å; S209-D228 PolarHBondContact OG-N 3.04Å; D228-R245 VanDerWaalsContact OD1-CB 3.22Å; D228-R245 WeakPolarHBondContact OD1-CB 3.41Å; D228-R245 WeakPolarHBondContact OD1-CG 3.45Å; D228-R245 IonicContact OD1-CZ 2.82Å; D228-R245 IonicContact OD1-NE 3.45Å; D228-R245 PolarHBondContact OD1-NE 2.92Å; D228-R245 IonicContact OD1-NH2 3.6Å; D228-R245 PolarHBondContact OD1-NH2 3.24Å; D228-R245 IonicContact OD2-CZ 3.85Å; D228-R245 IonicContact OD2-NE 2.77Å; D228-R245 IonicContact OD2-NH2 2.73Å; D228-R245 PolarHBondContact OD2-NH2 3.46Å; D228-Y275 WeakPolarHBondContact OD1-CE2 3.43Å; D228-Y275 PolarHBondContact OD1-OH 2.92Å; D228-Y275 VanDerWaalsContact OD1-OH 3.11Å
229	L	98.4	Very high	92.4	Very high	1 Å²	1	39 Å²	39	1%	0.005	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	134.1	174.5	-51	-179	0	0	0	108.9	V155 V197 I203 K204 V205 L231 N243 L244 I246	V155-L229 HydrophobicContact CG2-CD1 3.68Å; V197-L229 HydrophobicContact CG1-CD1 4.38Å; V197-L229 HydrophobicContact CG1-CD2 3.85Å; V197-L229 HydrophobicContact CG2-CD2 4.02Å; I203-L229 HydrophobicContact CG2-CB 4.47Å; I203-L229 HydrophobicContact CG2-CD1 4.45Å; I203-L229 HydrophobicContact CG2-CD2 4.2Å; K204-L229 CarbonylContact O-C 3.55Å; K204-L229 WeakPolarHBondContact O-CA 3.23Å; V205-L229 HydrophobicContact CB-CD2 4.39Å; V205-L229 HydrophobicContact CG1-CD2 4.21Å; V205-L229 HydrophobicContact CG2-CD2 3.96Å; L229-L231 HydrophobicContact CB-CD2 4.1Å; L229-L231 HydrophobicContact CB-CG 4.37Å; L229-N243 CarbonylContact O-C 3.58Å; L229-N243 WeakPolarHBondContact O-CA 3.28Å; L229-L244 PolarHBondContact N-O 3.3Å; L229-L244 PolarHBondContact O-N 3.22Å; L229-I246 HydrophobicContact CD1-CD1 4.35Å; L229-I246 HydrophobicContact CD1-CG1 3.75Å; L229-I246 HydrophobicContact CG-CG1 4.31Å
230	N	96.7	Very high	92	Very high	38 Å²	38	36.1 Å²	36.1	20%	0.203	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	119.6	164.7	-175	-75.4	0	0	0	109.1	K204 S232 N243	K204-N230 HydrophobicContact CB-CB 4.19Å; K204-N230 PolarHBondContact N-O 3.15Å; K204-N230 VanDerWaalsContact N-O 3.07Å; K204-N230 PolarHBondContact O-N 3.08Å; N230-S232 VanDerWaalsContact CG-OG 3.24Å; N230-S232 PolarHBondContact ND2-OG 3.35Å; N230-S232 VanDerWaalsContact ND2-OG 3.08Å; N230-S232 VanDerWaalsContact OD1-CB 3.31Å; N230-S232 WeakPolarHBondContact OD1-CB 3.22Å; N230-S232 PolarHBondContact OD1-N 3.37Å; N230-S232 PolarHBondContact OD1-OG 3.44Å; N230-N243 PolarHBondContact ND2-OD1 2.57Å
231	L	95.9	Very high	91.8	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	21%	0.212	C	C	.	.			trans	-112.5	16.7	-176	-55.4	-178.1	0	0	0	112	I122 I203 L229 Q233 F234 L242 L244 L397	I122-L231 HydrophobicContact CD1-CD1 3.55Å; I122-L231 HydrophobicContact CD1-CD2 4.02Å; I122-L231 HydrophobicContact CD1-CG 4.45Å; I203-L231 HydrophobicContact CB-CD2 4.4Å; I203-L231 HydrophobicContact CG1-CD2 3.92Å; I203-L231 HydrophobicContact CG2-CD2 4.14Å; L229-L231 HydrophobicContact CB-CD2 4.1Å; L229-L231 HydrophobicContact CB-CG 4.37Å; L231-Q233 PolarHBondContact O-N 2.89Å; L231-Q233 VanDerWaalsContact O-N 3.12Å; L231-F234 HydrophobicContact CB-CD2 4.17Å; L231-F234 HydrophobicContact CD2-CD2 4.33Å; L231-F234 HydrophobicContact CD2-CE2 4.21Å; L231-F234 WeakPolarHBondContact O-CB 3.4Å; L231-F234 PolarHBondContact O-N 2.8Å; L231-F234 VanDerWaalsContact O-N 3.07Å; L231-L242 HydrophobicContact CB-CB 4.48Å; L231-L242 HydrophobicContact CB-CD2 4.2Å; L231-L242 HydrophobicContact CB-CG 4.27Å; L231-L242 HydrophobicContact CD1-CD2 4.41Å; L231-L242 PolarHBondContact N-O 2.66Å; L231-L244 HydrophobicContact CD1-CB 3.84Å; L231-L244 HydrophobicContact CD1-CD2 3.61Å; L231-L244 HydrophobicContact CD1-CG 4.39Å; L231-L244 HydrophobicContact CG-CB 4.35Å; L231-L397 HydrophobicContact CB-CD1 4.21Å; L231-L397 HydrophobicContact CD1-CD1 4.11Å; L231-L397 HydrophobicContact CD1-CD2 4.41Å
232	S	93.4	Very high	91.8	Very high	14 Å²	14	35.6 Å²	35.6	10%	0.098	19%	0.194	C	C	.	.	G	3₁₀ helix	trans	-59.8	-29	-173.5	-44.7	0	0	0	0	112.1	N230 F234 L235 L240 E241 L242	N230-S232 VanDerWaalsContact CG-OG 3.24Å; N230-S232 PolarHBondContact ND2-OG 3.35Å; N230-S232 VanDerWaalsContact ND2-OG 3.08Å; N230-S232 VanDerWaalsContact OD1-CB 3.31Å; N230-S232 WeakPolarHBondContact OD1-CB 3.22Å; N230-S232 PolarHBondContact OD1-N 3.37Å; N230-S232 PolarHBondContact OD1-OG 3.44Å; S232-F234 VanDerWaalsContact C-N 3.27Å; S232-F234 PolarHBondContact O-N 2.96Å; S232-L235 WeakPolarHBondContact O-CB 3.39Å; S232-L235 PolarHBondContact O-N 3.11Å; S232-L240 WeakPolarHBondContact CB-O 3.42Å; S232-E241 WeakPolarHBondContact OG-CA 3.3Å; S232-L242 PolarHBondContact OG-N 2.66Å; S232-L242 VanDerWaalsContact OG-N 3.13Å
233	Q	91.7	Very high	91.7	Very high	105 Å²	105	37.6 Å²	37.6	49%	0.491	21%	0.206	S	C	.	.	G	3₁₀ helix	trans	-71.1	-19.7	-179.2	-58.3	-63.1	64.8	0	0	113.7	D202 L231 L235	D202-Q233 HydrophobicContact CB-CB 3.79Å; L231-Q233 PolarHBondContact O-N 2.89Å; L231-Q233 VanDerWaalsContact O-N 3.12Å; Q233-L235 VanDerWaalsContact C-N 3.25Å
234	F	88.3	Confident	91.7	Very high	32 Å²	32	37.3 Å²	37.3	14%	0.14	20%	0.204	C	C	.	.	G	3₁₀ helix	trans	-73.2	-20.8	170.2	-77.1	-86	0	0	0	112.4	P120 H200 D202 I203 L231 S232 L397	P120-F234 HydrophobicContact CB-CB 4.07Å; P120-F234 HydrophobicContact CB-CD1 4.43Å; P120-F234 VanDerWaalsContact CB-O 3.24Å; P120-F234 WeakPolarHBondContact CB-O 3.34Å; H200-F234 AromaticContact CE1-CZ 3.81Å; H200-F234 AromaticContact ND1-CZ 3.75Å; D202-F234 HydrophobicContact CB-CD2 3.81Å; D202-F234 HydrophobicContact CB-CE1 4.43Å; D202-F234 HydrophobicContact CB-CE2 3.61Å; D202-F234 HydrophobicContact CB-CG 4.31Å; D202-F234 HydrophobicContact CB-CZ 3.95Å; D202-F234 WeakPolarHBondContact O-CE2 3.11Å; I203-F234 HydrophobicContact CD1-CE2 4.42Å; I203-F234 HydrophobicContact CG1-CE2 3.62Å; I203-F234 HydrophobicContact CG1-CZ 4.11Å; L231-F234 HydrophobicContact CB-CD2 4.17Å; L231-F234 HydrophobicContact CD2-CD2 4.33Å; L231-F234 HydrophobicContact CD2-CE2 4.21Å; L231-F234 WeakPolarHBondContact O-CB 3.4Å; L231-F234 PolarHBondContact O-N 2.8Å; L231-F234 VanDerWaalsContact O-N 3.07Å; S232-F234 VanDerWaalsContact C-N 3.27Å; S232-F234 PolarHBondContact O-N 2.96Å; F234-L397 HydrophobicContact CB-CD1 3.58Å; F234-L397 HydrophobicContact CD1-CD1 4.43Å; F234-L397 HydrophobicContact CD2-CD1 4.12Å; F234-L397 HydrophobicContact CG-CD1 3.81Å
235	L	86.6	Confident	91.7	Very high	9 Å²	9	39.8 Å²	39.8	5%	0.047	21%	0.213	C	C	.	.	S	Bend	trans	-79.5	136.2	-174.1	-60.9	180	0	0	0	110.3	S232 Q233 K237 L240 L242 L397	S232-L235 WeakPolarHBondContact O-CB 3.39Å; S232-L235 PolarHBondContact O-N 3.11Å; Q233-L235 VanDerWaalsContact C-N 3.25Å; L235-K237 PolarHBondContact O-N 3.35Å; L235-K237 VanDerWaalsContact O-N 3.12Å; L235-L240 HydrophobicContact CB-CB 4.44Å; L235-L240 HydrophobicContact CD1-CB 3.6Å; L235-L242 HydrophobicContact CD1-CB 3.97Å; L235-L397 HydrophobicContact CD2-CB 4.03Å
236	P	78	Confident	91.7	Very high	111 Å²	111	39.7 Å²	39.7	72%	0.721	21%	0.213	S	C	*	.	S	Bend	trans	-66.4	-18.4	-176.8	23.4	-32.4	0	0	0	113.5
237	K	77.6	Confident	91.7	Very high	114 Å²	114	39.6 Å²	39.6	50%	0.496	21%	0.212	S	C	.	.	S	Bend	trans	-106.7	114.6	178.1	-63.1	-178.6	-177.2	173.6	0	109.5	L235 N239 L240	L235-K237 PolarHBondContact O-N 3.35Å; L235-K237 VanDerWaalsContact O-N 3.12Å; K237-N239 PolarHBondContact O-N 3.24Å; K237-L240 HydrophobicContact CB-CD1 3.85Å; K237-L240 HydrophobicContact CB-CG 3.91Å; K237-L240 HydrophobicContact CD-CD1 4.07Å; K237-L240 HydrophobicContact CG-CD1 4.39Å; K237-L240 PolarHBondContact O-N 2.84Å
238	S	74.7	Confident	91.7	Very high	123 Å²	123	39.5 Å²	39.5	86%	0.86	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-13.4	-175.2	59	0	0	0	0	115.5
239	N	84.7	Confident	91.8	Very high	87 Å²	87	38.5 Å²	38.5	47%	0.465	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.1	-3.2	178.2	73.9	-41.9	0	0	0	113.8	K237 N286	K237-N239 PolarHBondContact O-N 3.24Å; N239-N286 WeakPolarHBondContact O-CB 3.45Å
240	L	89.2	Confident	91.8	Very high	10 Å²	10	38.7 Å²	38.7	5%	0.052	21%	0.207	C	C	.	.			trans	-91.4	134.2	177.2	-62.5	-179.2	0	0	0	110	S232 L235 K237 N286 G399	S232-L240 WeakPolarHBondContact CB-O 3.42Å; L235-L240 HydrophobicContact CB-CB 4.44Å; L235-L240 HydrophobicContact CD1-CB 3.6Å; K237-L240 HydrophobicContact CB-CD1 3.85Å; K237-L240 HydrophobicContact CB-CG 3.91Å; K237-L240 HydrophobicContact CD-CD1 4.07Å; K237-L240 HydrophobicContact CG-CD1 4.39Å; K237-L240 PolarHBondContact O-N 2.84Å; L240-N286 HydrophobicContact CD2-CB 4.32Å; L240-G399 VanDerWaalsContact CD1-CA 3.46Å; L240-G399 WeakPolarHBondContact CD1-O 3.4Å
241	E	91	Very high	91.9	Very high	65 Å²	65	36.9 Å²	36.9	30%	0.304	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	141.1	174.2	-62.7	176.4	-158.7	0	0	109.6	S232 N286 R287 G288	S232-E241 WeakPolarHBondContact OG-CA 3.3Å; E241-N286 PolarHBondContact N-O 3.16Å; E241-R287 HydrophobicContact CB-CG 4.35Å; E241-R287 IonicContact OE1-CZ 2.67Å; E241-R287 IonicContact OE1-NE 3.17Å; E241-R287 PolarHBondContact OE1-NE 3.41Å; E241-R287 IonicContact OE1-NH2 3.24Å; E241-R287 PolarHBondContact OE1-NH2 3.06Å; E241-R287 WeakPolarHBondContact OE2-CD 3.21Å; E241-R287 WeakPolarHBondContact OE2-CG 3.4Å; E241-R287 IonicContact OE2-CZ 3.54Å; E241-R287 IonicContact OE2-NE 3.48Å; E241-R287 PolarHBondContact OE2-NE 2.87Å; E241-R287 IonicContact OE2-NH2 3.64Å; E241-G288 WeakPolarHBondContact O-CA 3.4Å; E241-G288 PolarHBondContact O-N 2.81Å
242	L	93.8	Very high	92	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	114.7	168.1	175.8	56.7	0	0	0	110	L231 S232 L235 G288 A290 R364 L397	L231-L242 HydrophobicContact CB-CB 4.48Å; L231-L242 HydrophobicContact CB-CD2 4.2Å; L231-L242 HydrophobicContact CB-CG 4.27Å; L231-L242 HydrophobicContact CD1-CD2 4.41Å; L231-L242 PolarHBondContact N-O 2.66Å; S232-L242 PolarHBondContact OG-N 2.66Å; S232-L242 VanDerWaalsContact OG-N 3.13Å; L235-L242 HydrophobicContact CD1-CB 3.97Å; L242-G288 WeakPolarHBondContact CA-O 3.43Å; L242-A290 HydrophobicContact CD1-CB 4.21Å; L242-R364 HydrophobicContact CD1-CB 4.13Å; L242-R364 HydrophobicContact CD2-CB 4.31Å; L242-L397 HydrophobicContact CD2-CB 4.43Å; L242-L397 HydrophobicContact CD2-CD1 4.39Å; L242-L397 HydrophobicContact CD2-CD2 3.82Å; L242-L397 HydrophobicContact CD2-CG 4.43Å
243	N	95.3	Very high	92.2	Very high	47 Å²	47	36.5 Å²	36.5	25%	0.251	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	125	168.4	-62.7	-50.1	0	0	0	109.4	L229 N230 G288 R289 A290	L229-N243 CarbonylContact O-C 3.58Å; L229-N243 WeakPolarHBondContact O-CA 3.28Å; N230-N243 PolarHBondContact ND2-OD1 2.57Å; N243-G288 PolarHBondContact N-O 3.47Å; N243-R289 WeakPolarHBondContact O-CA 3.35Å; N243-A290 PolarHBondContact O-N 2.93Å
244	L	97.6	Very high	92.2	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	122.2	179.2	173.5	64.3	0	0	0	109.2	I122 L229 L231 I246 A290 I292 I365	I122-L244 HydrophobicContact CD1-CD2 4.01Å; L229-L244 PolarHBondContact N-O 3.3Å; L229-L244 PolarHBondContact O-N 3.22Å; L231-L244 HydrophobicContact CD1-CB 3.84Å; L231-L244 HydrophobicContact CD1-CD2 3.61Å; L231-L244 HydrophobicContact CD1-CG 4.39Å; L231-L244 HydrophobicContact CG-CB 4.35Å; L244-I246 HydrophobicContact CD1-CD1 4.5Å; L244-I246 HydrophobicContact CD2-CD1 3.65Å; L244-I246 HydrophobicContact CG-CD1 3.92Å; L244-A290 CarbonylContact C-O 3.51Å; L244-A290 WeakPolarHBondContact CA-O 3.21Å; L244-A290 HydrophobicContact CD1-CB 3.92Å; L244-I292 HydrophobicContact CD1-CB 4.46Å; L244-I292 HydrophobicContact CD1-CD1 4.14Å; L244-I292 HydrophobicContact CD1-CG1 4Å; L244-I292 HydrophobicContact CD2-CD1 4.15Å; L244-I365 HydrophobicContact CD1-CD1 4.18Å; L244-I365 HydrophobicContact CD2-CD1 4.38Å
245	R	98.6	Very high	92.4	Very high	53 Å²	53	33.4 Å²	33.4	20%	0.2	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	124.1	165.9	-169.8	163.5	-78	-170.7	0.1	110.8	I227 D228 F247 Y275 A290 S291 I292	I227-R245 WeakPolarHBondContact O-CA 3.46Å; D228-R245 VanDerWaalsContact OD1-CB 3.22Å; D228-R245 WeakPolarHBondContact OD1-CB 3.41Å; D228-R245 WeakPolarHBondContact OD1-CG 3.45Å; D228-R245 IonicContact OD1-CZ 2.82Å; D228-R245 IonicContact OD1-NE 3.45Å; D228-R245 PolarHBondContact OD1-NE 2.92Å; D228-R245 IonicContact OD1-NH2 3.6Å; D228-R245 PolarHBondContact OD1-NH2 3.24Å; D228-R245 IonicContact OD2-CZ 3.85Å; D228-R245 IonicContact OD2-NE 2.77Å; D228-R245 IonicContact OD2-NH2 2.73Å; D228-R245 PolarHBondContact OD2-NH2 3.46Å; R245-F247 HydrophobicContact CB-CD2 4.4Å; R245-F247 HydrophobicContact CB-CE2 3.79Å; R245-F247 HydrophobicContact CB-CZ 4.25Å; R245-F247 HydrophobicContact CG-CD2 3.97Å; R245-F247 HydrophobicContact CG-CE1 4.08Å; R245-F247 HydrophobicContact CG-CE2 3.46Å; R245-F247 VanDerWaalsContact CG-CE2 3.46Å; R245-F247 HydrophobicContact CG-CG 4.5Å; R245-F247 HydrophobicContact CG-CZ 3.55Å; R245-Y275 HydrophobicContact CB-CD1 3.93Å; R245-Y275 HydrophobicContact CB-CD2 4.04Å; R245-Y275 HydrophobicContact CB-CE1 3.68Å; R245-Y275 HydrophobicContact CB-CE2 3.73Å; R245-Y275 HydrophobicContact CB-CG 4.11Å; R245-Y275 HydrophobicContact CG-CD2 4.47Å; R245-Y275 HydrophobicContact CG-CE2 4.37Å; R245-Y275 VanDerWaalsContact CZ-CE2 3.5Å; R245-A290 PolarHBondContact N-O 2.83Å; R245-S291 CarbonylContact O-C 3.52Å; R245-S291 VanDerWaalsContact O-CA 3.24Å; R245-S291 WeakPolarHBondContact O-CA 3.49Å; R245-I292 PolarHBondContact O-N 2.75Å
246	I	98.9	Very high	92.8	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	133.8	169.5	-56.6	-64.1	0	0	0	108.1	V155 I195 S226 I227 L229 L244 I292	V155-I246 HydrophobicContact CG1-CD1 4.23Å; V155-I246 HydrophobicContact CG1-CG1 4.03Å; V155-I246 HydrophobicContact CG1-CG2 3.88Å; V155-I246 HydrophobicContact CG2-CD1 4.24Å; V155-I246 HydrophobicContact CG2-CG1 4.24Å; I195-I246 HydrophobicContact CD1-CB 4.4Å; I195-I246 HydrophobicContact CD1-CG2 3.92Å; I195-I246 HydrophobicContact CG2-CG2 4.39Å; S226-I246 CarbonylContact C-O 3.51Å; S226-I246 WeakPolarHBondContact CA-O 3.49Å; S226-I246 WeakPolarHBondContact CB-O 3.29Å; I227-I246 HydrophobicContact CG2-CB 4.29Å; I227-I246 PolarHBondContact N-O 3.47Å; I227-I246 PolarHBondContact O-N 2.93Å; L229-I246 HydrophobicContact CD1-CD1 4.35Å; L229-I246 HydrophobicContact CD1-CG1 3.75Å; L229-I246 HydrophobicContact CG-CG1 4.31Å; L244-I246 HydrophobicContact CD1-CD1 4.5Å; L244-I246 HydrophobicContact CD2-CD1 3.65Å; L244-I246 HydrophobicContact CG-CD1 3.92Å; I246-I292 CarbonylContact C-O 3.58Å; I246-I292 HydrophobicContact CD1-CB 4.18Å; I246-I292 HydrophobicContact CD1-CD1 4.47Å
247	F	98.9	Very high	93.7	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	136.3	172.4	-65	-86.9	0	0	0	109.6	L224 L225 R245 T271 M272 I292 F293 C294	L224-F247 HydrophobicContact CD1-CB 4.04Å; L224-F247 HydrophobicContact CD1-CD1 4.02Å; L224-F247 HydrophobicContact CD1-CG 4.5Å; L224-F247 HydrophobicContact CD2-CD1 3.85Å; L224-F247 HydrophobicContact CD2-CE1 4.18Å; L224-F247 HydrophobicContact CG-CD1 4.04Å; L225-F247 WeakPolarHBondContact O-CA 3.33Å; R245-F247 HydrophobicContact CB-CD2 4.4Å; R245-F247 HydrophobicContact CB-CE2 3.79Å; R245-F247 HydrophobicContact CB-CZ 4.25Å; R245-F247 HydrophobicContact CG-CD2 3.97Å; R245-F247 HydrophobicContact CG-CE1 4.08Å; R245-F247 HydrophobicContact CG-CE2 3.46Å; R245-F247 VanDerWaalsContact CG-CE2 3.46Å; R245-F247 HydrophobicContact CG-CG 4.5Å; R245-F247 HydrophobicContact CG-CZ 3.55Å; F247-T271 HydrophobicContact CE1-CG2 3.66Å; F247-T271 HydrophobicContact CZ-CG2 3.89Å; F247-M272 HydrophobicContact CD2-CG 4.04Å; F247-M272 HydrophobicContact CE2-CG 3.99Å; F247-I292 PolarHBondContact N-O 3.46Å; F247-F293 HydrophobicContact CB-CB 4.01Å; F247-F293 HydrophobicContact CB-CD2 3.85Å; F247-F293 HydrophobicContact CB-CG 4.3Å; F247-F293 WeakPolarHBondContact O-CA 3.47Å; F247-C294 PolarHBondContact O-N 3.22Å
248	T	98.9	Very high	94.6	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	143.3	166.4	-176.8	0	0	0	0	111.7	C157 Q159 V193 I195 L225 C294	C157-T248 HydrophobicContact CB-CG2 4.33Å; Q159-T248 PolarHBondContact NE2-OG1 3Å; V193-T248 HydrophobicContact CB-CG2 3.97Å; V193-T248 HydrophobicContact CG2-CG2 3.81Å; I195-T248 HydrophobicContact CD1-CG2 3.88Å; I195-T248 HydrophobicContact CG1-CG2 3.43Å; I195-T248 VanDerWaalsContact CG1-CG2 3.43Å; L225-T248 HydrophobicContact CB-CG2 4.03Å; L225-T248 HydrophobicContact CD2-CG2 4.25Å; L225-T248 HydrophobicContact CG-CG2 4.38Å; L225-T248 PolarHBondContact N-O 2.84Å; L225-T248 PolarHBondContact O-N 3.49Å; T248-C294 VanDerWaalsContact CA-O 3.22Å; T248-C294 WeakPolarHBondContact CA-O 3.34Å; T248-C294 PolarHBondContact OG1-O 3.23Å
249	A	98.8	Very high	95.7	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	161.1	173.6	0	0	0	0	0	109.8	F215 H223 L224 L251 F293	F215-A249 HydrophobicContact CE2-CB 4.18Å; F215-A249 HydrophobicContact CZ-CB 4.37Å; H223-A249 WeakPolarHBondContact O-CB 3.46Å; L224-A249 HydrophobicContact CD1-CB 4.04Å; A249-L251 HydrophobicContact CB-CD2 3.82Å; A249-F293 HydrophobicContact CB-CE2 3.89Å; A249-F293 HydrophobicContact CB-CZ 4.26Å
250	H	98.8	Very high	96.4	Very high	5 Å²	5	23 Å²	23	2%	0.023	14%	0.136	C	C	.	.			trans	-113.1	97.7	163.4	-174.9	180	0	0	0	106.9	Q159 E160 Y191 V193 R222 S253 D296 N298	Q159-H250 HydrophobicContact CB-CB 4.05Å; Q159-H250 HydrophobicContact CG-CB 4.02Å; E160-H250 IonicContact OE1-CE1 3.4Å; E160-H250 PolarHBondContact OE1-CE1 3.42Å; Y191-H250 AromaticContact CE2-ND1 3.92Å; V193-H250 HydrophobicContact CG1-CB 4.16Å; R222-H250 WeakPolarHBondContact CB-O 3.4Å; R222-H250 WeakPolarHBondContact CD-O 3.26Å; R222-H250 VanDerWaalsContact CG-O 3.24Å; R222-H250 WeakPolarHBondContact CG-O 3.44Å; R222-H250 PolarHBondContact NH1-CD2 3.22Å; R222-H250 PolarHBondContact NH1-NE2 3.49Å; R222-H250 PolarHBondContact NH1-O 2.94Å; H250-S253 PolarHBondContact NE2-OG 2.9Å; H250-D296 CarbonylContact C-O 3.57Å; H250-D296 VanDerWaalsContact CA-O 3.31Å; H250-D296 WeakPolarHBondContact CA-O 3.3Å; H250-D296 IonicContact CD2-OD2 3.53Å; H250-D296 IonicContact CE1-OD2 3.65Å; H250-D296 IonicContact NE2-OD2 2.83Å; H250-D296 PolarHBondContact NE2-OD2 3.09Å; H250-N298 PolarHBondContact CD2-ND2 3.4Å; H250-N298 VanDerWaalsContact CD2-ND2 3.29Å; H250-N298 PolarHBondContact NE2-ND2 2.79Å
251	L	98.8	Very high	96.8	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	13%	0.134	C	C	.	.			trans	-74.4	152.3	-175.3	-53.3	-171.7	0	0	0	111.5	F215 R222 A249 S253 R261 Q264 L265 F293 D296 L297 N298	F215-L251 HydrophobicContact CE2-CD2 3.85Å; F215-L251 HydrophobicContact CZ-CD2 4.01Å; R222-L251 PolarHBondContact NH1-O 3.44Å; A249-L251 HydrophobicContact CB-CD2 3.82Å; L251-S253 PolarHBondContact O-N 2.79Å; L251-R261 HydrophobicContact CB-CG 4.05Å; L251-R261 HydrophobicContact CD1-CG 4.4Å; L251-Q264 HydrophobicContact CD2-CB 3.92Å; L251-L265 HydrophobicContact CD1-CB 3.95Å; L251-L265 HydrophobicContact CD1-CD1 4.19Å; L251-F293 HydrophobicContact CD2-CZ 4.42Å; L251-D296 PolarHBondContact N-O 3.11Å; L251-L297 WeakPolarHBondContact CB-O 3.2Å; L251-L297 HydrophobicContact CD1-CB 4.01Å; L251-L297 HydrophobicContact CD1-CD2 4.22Å; L251-L297 HydrophobicContact CG-CB 4.3Å; L251-L297 HydrophobicContact CG-CD2 4.08Å; L251-N298 PolarHBondContact O-ND2 3.07Å
252	E	98.5	Very high	97.2	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	12%	0.124	C	C	.	.			trans	-41.3	124.4	-170.9	-145.9	71	-169.5	0	0	112.2	S218 V219 M220 R222 Y257 E260 R261 Q264 N298	S218-E252 WeakPolarHBondContact CB-OE2 3.27Å; S218-E252 PolarHBondContact OG-OE2 2.78Å; V219-E252 WeakPolarHBondContact CG2-OE1 3.28Å; V219-E252 PolarHBondContact N-OE1 2.84Å; M220-E252 HydrophobicContact CE-CG 4.31Å; M220-E252 VanDerWaalsContact CG-OE1 3.26Å; M220-E252 WeakPolarHBondContact CG-OE1 3.5Å; M220-E252 PolarHBondContact N-OE1 3.13Å; M220-E252 VanDerWaalsContact N-OE1 3.16Å; M220-E252 HydrophobicContact SD-CG 4.27Å; R222-E252 VanDerWaalsContact CG-OE2 3.24Å; R222-E252 WeakPolarHBondContact CG-OE2 3.38Å; E252-Y257 VanDerWaalsContact CG-CB 3.48Å; E252-Y257 HydrophobicContact CG-CD1 4.12Å; E252-Y257 HydrophobicContact CG-CG 3.83Å; E252-E260 HydrophobicContact CB-CB 4.47Å; E252-E260 HydrophobicContact CB-CG 4.13Å; E252-E260 HydrophobicContact CG-CB 4.32Å; E252-E260 HydrophobicContact CG-CG 3.98Å; E252-R261 HydrophobicContact CB-CB 4.14Å; E252-R261 WeakPolarHBondContact O-CD 3.27Å; E252-R261 PolarHBondContact O-NH1 3Å; E252-Q264 PolarHBondContact OE2-NE2 2.73Å; E252-N298 WeakPolarHBondContact O-CB 3.44Å
253	S	97.5	Very high	97.4	Very high	6 Å²	6	24 Å²	24	4%	0.042	15%	0.147	C	C	.	.			trans	-77.7	176.5	-177	-58.7	0	0	0	0	111.9	R222 H250 L251 Y257 N298	R222-S253 PolarHBondContact NH1-OG 3.05Å; R222-S253 PolarHBondContact NH2-OG 2.9Å; H250-S253 PolarHBondContact NE2-OG 2.9Å; L251-S253 PolarHBondContact O-N 2.79Å; S253-Y257 WeakPolarHBondContact O-CB 3.44Å; S253-Y257 VanDerWaalsContact O-CD2 3.31Å; S253-Y257 WeakPolarHBondContact O-CD2 3.47Å; S253-N298 PolarHBondContact OG-ND2 3.42Å
254	C	92.4	Very high	97.6	Very high	12 Å²	12	21.9 Å²	21.9	8%	0.081	14%	0.135	C	C	.	.	S	Bend	trans	65.7	155.1	176.8	-83.4	0	0	0	0	115.6	D39 E256 Y257 R261	D39-C254 VanDerWaalsContact CG-SG 3.53Å; D39-C254 PolarHBondContact OD2-SG 3.04Å; C254-E256 HydrophobicContact CB-CG 4.23Å; C254-E256 WeakPolarHBondContact CB-OE2 3.25Å; C254-Y257 HydrophobicContact CB-CD2 3.92Å; C254-Y257 HydrophobicContact CB-CE2 4.38Å; C254-R261 PolarHBondContact O-NH1 3.38Å; C254-R261 PolarHBondContact O-NH2 3.28Å
255	A	92.5	Very high	97.6	Very high	60 Å²	60	21.9 Å²	21.9	50%	0.496	14%	0.135	S	C	.	.	S	Bend	trans	-73.3	-34.6	-173.8	0	0	0	0	0	112.4	Y257 S258	A255-Y257 PolarHBondContact O-N 2.95Å; A255-S258 WeakPolarHBondContact O-CB 3.32Å; A255-S258 PolarHBondContact O-N 2.71Å
256	E	94.2	Very high	97.6	Very high	67 Å²	67	24.2 Å²	24.2	31%	0.313	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-27.5	179.9	52.4	-97.4	-115.9	0	0	113.6	L42 Y61 C254 S258	L42-E256 WeakPolarHBondContact CD2-OE1 3.37Å; Y61-E256 PolarHBondContact OH-OE1 3.29Å; C254-E256 HydrophobicContact CB-CG 4.23Å; C254-E256 WeakPolarHBondContact CB-OE2 3.25Å; E256-S258 VanDerWaalsContact C-N 3.26Å; E256-S258 PolarHBondContact O-N 3.3Å
257	Y	96.5	Very high	97.6	Very high	40 Å²	40	26.7 Å²	26.7	16%	0.157	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.3	17.5	179.4	-61.3	-79.4	0	0	0	113.9	L42 V219 M220 E252 S253 C254 A255 G259 E260 R261	L42-Y257 HydrophobicContact CD1-CE2 3.54Å; L42-Y257 VanDerWaalsContact CD1-OH 3.24Å; L42-Y257 WeakPolarHBondContact CD1-OH 3.49Å; L42-Y257 HydrophobicContact CD2-CE2 4.32Å; V219-Y257 HydrophobicContact CG2-CD1 4.03Å; V219-Y257 HydrophobicContact CG2-CE1 3.41Å; V219-Y257 VanDerWaalsContact CG2-CE1 3.41Å; M220-Y257 HydrophobicContact CE-CD2 3.36Å; M220-Y257 HydrophobicContact CE-CE2 3.38Å; M220-Y257 HydrophobicContact CE-CG 4.05Å; E252-Y257 VanDerWaalsContact CG-CB 3.48Å; E252-Y257 HydrophobicContact CG-CD1 4.12Å; E252-Y257 HydrophobicContact CG-CG 3.83Å; S253-Y257 WeakPolarHBondContact O-CB 3.44Å; S253-Y257 VanDerWaalsContact O-CD2 3.31Å; S253-Y257 WeakPolarHBondContact O-CD2 3.47Å; C254-Y257 HydrophobicContact CB-CD2 3.92Å; C254-Y257 HydrophobicContact CB-CE2 4.38Å; A255-Y257 PolarHBondContact O-N 2.95Å; Y257-G259 PolarHBondContact O-N 3.24Å; Y257-G259 VanDerWaalsContact O-N 3.16Å; Y257-E260 PolarHBondContact O-N 3.03Å; Y257-E260 VanDerWaalsContact O-N 3.08Å; Y257-R261 PolarHBondContact O-N 2.84Å
258	S	97.5	Very high	97.6	Very high	40 Å²	40	26.7 Å²	26.7	28%	0.28	16%	0.164	S	C	.	.	H	α-helix	trans	-47.3	-43.2	175.5	-179.9	0	0	0	0	113.5	A255 E256 E260 R261 V262 E303	A255-S258 WeakPolarHBondContact O-CB 3.32Å; A255-S258 PolarHBondContact O-N 2.71Å; E256-S258 VanDerWaalsContact C-N 3.26Å; E256-S258 PolarHBondContact O-N 3.3Å; S258-E260 PolarHBondContact O-N 3.24Å; S258-R261 PolarHBondContact O-N 2.84Å; S258-V262 WeakPolarHBondContact O-CB 3.36Å; S258-V262 WeakPolarHBondContact O-CG2 3.2Å; S258-V262 PolarHBondContact O-N 3.11Å; S258-E303 VanDerWaalsContact CA-OE1 3.27Å; S258-E303 WeakPolarHBondContact CA-OE1 3.27Å; S258-E303 WeakPolarHBondContact CB-OE1 3.26Å; S258-E303 PolarHBondContact OG-OE1 3.2Å
259	G	97.8	Very high	97.5	Very high	52 Å²	52	26.9 Å²	26.9	54%	0.536	17%	0.165	S	C	.	.	H	α-helix	trans	-63	-41.8	-179.8	0	0	0	0	0	113.6	Y257 T263	Y257-G259 PolarHBondContact O-N 3.24Å; Y257-G259 VanDerWaalsContact O-N 3.16Å; G259-T263 PolarHBondContact O-N 3.44Å; G259-T263 PolarHBondContact O-OG1 3.24Å
260	E	98.4	Very high	97.5	Very high	27 Å²	27	30.7 Å²	30.7	13%	0.126	19%	0.185	C	C	.	.	H	α-helix	trans	-71.9	-47.5	177	174.5	55.6	-163.6	0	0	110.6	N217 S218 E252 Y257 S258 V262 T263 Q264	N217-E260 WeakPolarHBondContact CB-OE2 3.07Å; S218-E260 PolarHBondContact N-OE1 2.91Å; E252-E260 HydrophobicContact CB-CB 4.47Å; E252-E260 HydrophobicContact CB-CG 4.13Å; E252-E260 HydrophobicContact CG-CB 4.32Å; E252-E260 HydrophobicContact CG-CG 3.98Å; Y257-E260 PolarHBondContact O-N 3.03Å; Y257-E260 VanDerWaalsContact O-N 3.08Å; S258-E260 PolarHBondContact O-N 3.24Å; E260-V262 VanDerWaalsContact C-N 3.27Å; E260-V262 PolarHBondContact O-N 3.1Å; E260-T263 CarbonylContact O-C 3.55Å; E260-T263 WeakPolarHBondContact O-CA 3.35Å; E260-T263 WeakPolarHBondContact O-CB 3.34Å; E260-T263 PolarHBondContact O-N 2.97Å; E260-Q264 HydrophobicContact CG-CG 4.22Å; E260-Q264 VanDerWaalsContact CG-NE2 3.31Å; E260-Q264 WeakPolarHBondContact O-CG 2.96Å; E260-Q264 PolarHBondContact O-N 2.91Å; E260-Q264 WeakPolarHBondContact OE1-CG 3.42Å; E260-Q264 PolarHBondContact OE1-NE2 2.87Å
261	R	98.4	Very high	97.5	Very high	1 Å²	1	31.9 Å²	31.9	0%	0.004	19%	0.193	C	C	.	.	H	α-helix	trans	-55.3	-40.9	176.8	176.4	171.1	54.3	-102.2	5.7	112.9	L251 E252 C254 Y257 S258 Q264 L265 L297 N298 L299 E303	L251-R261 HydrophobicContact CB-CG 4.05Å; L251-R261 HydrophobicContact CD1-CG 4.4Å; E252-R261 HydrophobicContact CB-CB 4.14Å; E252-R261 WeakPolarHBondContact O-CD 3.27Å; E252-R261 PolarHBondContact O-NH1 3Å; C254-R261 PolarHBondContact O-NH1 3.38Å; C254-R261 PolarHBondContact O-NH2 3.28Å; Y257-R261 PolarHBondContact O-N 2.84Å; S258-R261 PolarHBondContact O-N 2.84Å; R261-Q264 PolarHBondContact O-N 2.93Å; R261-L265 WeakPolarHBondContact O-CB 3.34Å; R261-L265 PolarHBondContact O-N 2.97Å; R261-L297 WeakPolarHBondContact CD-O 3.39Å; R261-N298 VanDerWaalsContact CD-C 3.5Å; R261-N298 WeakPolarHBondContact CD-O 3.49Å; R261-N298 PolarHBondContact NE-O 2.88Å; R261-N298 VanDerWaalsContact NE-O 3.13Å; R261-L299 HydrophobicContact CG-CD2 3.88Å; R261-E303 IonicContact CZ-OE1 3.88Å; R261-E303 VanDerWaalsContact CZ-OE1 3.28Å; R261-E303 IonicContact CZ-OE2 3.95Å; R261-E303 IonicContact NE-OE1 2.98Å; R261-E303 PolarHBondContact NE-OE1 3.24Å; R261-E303 IonicContact NE-OE2 2.67Å; R261-E303 PolarHBondContact NE-OE2 3.31Å; R261-E303 IonicContact NH2-OE1 3.7Å; R261-E303 PolarHBondContact NH2-OE1 3.35Å; R261-E303 IonicContact NH2-OE2 2.79Å; R261-E303 PolarHBondContact NH2-OE2 2.73Å
262	V	98.5	Very high	97.4	Very high	16 Å²	16	31.9 Å²	31.9	10%	0.097	19%	0.193	C	C	.	.	H	α-helix	trans	-64.4	-40.5	174.6	167.3	0	0	0	0	111.5	S258 E260 L265 K266 E303 V306 L307	S258-V262 WeakPolarHBondContact O-CB 3.36Å; S258-V262 WeakPolarHBondContact O-CG2 3.2Å; S258-V262 PolarHBondContact O-N 3.11Å; E260-V262 VanDerWaalsContact C-N 3.27Å; E260-V262 PolarHBondContact O-N 3.1Å; V262-L265 PolarHBondContact O-N 3.1Å; V262-K266 WeakPolarHBondContact O-CB 3.37Å; V262-K266 PolarHBondContact O-N 2.91Å; V262-E303 HydrophobicContact CG2-CB 3.81Å; V262-E303 HydrophobicContact CG2-CG 4.19Å; V262-V306 HydrophobicContact CG1-CG1 4.14Å; V262-L307 HydrophobicContact CG1-CD1 4.25Å; V262-L307 HydrophobicContact CG1-CD2 3.57Å; V262-L307 HydrophobicContact CG1-CG 3.82Å
263	T	98.5	Very high	97.3	Very high	78 Å²	78	33.1 Å²	33.1	48%	0.479	20%	0.202	S	C	.	.	H	α-helix	trans	-65.1	-45.3	177.2	-59	0	0	0	0	111.2	G259 E260 K266 S267	G259-T263 PolarHBondContact O-N 3.44Å; G259-T263 PolarHBondContact O-OG1 3.24Å; E260-T263 CarbonylContact O-C 3.55Å; E260-T263 WeakPolarHBondContact O-CA 3.35Å; E260-T263 WeakPolarHBondContact O-CB 3.34Å; E260-T263 PolarHBondContact O-N 2.97Å; T263-K266 PolarHBondContact O-N 2.88Å; T263-S267 PolarHBondContact O-N 3.39Å
264	Q	98.8	Very high	97.3	Very high	2 Å²	2	36.8 Å²	36.8	1%	0.009	23%	0.228	C	C	.	.	H	α-helix	trans	-60.8	-49.4	175.3	-63.4	172.5	-8.2	0	0	110.9	F215 L251 E252 E260 R261 K266 S267 V268	F215-Q264 HydrophobicContact CB-CG 3.99Å; F215-Q264 HydrophobicContact CD1-CB 4.13Å; F215-Q264 HydrophobicContact CD1-CG 3.87Å; F215-Q264 HydrophobicContact CD2-CB 4.32Å; F215-Q264 HydrophobicContact CD2-CG 3.88Å; F215-Q264 HydrophobicContact CE1-CB 4.06Å; F215-Q264 HydrophobicContact CE1-CG 4.32Å; F215-Q264 HydrophobicContact CE2-CB 4.27Å; F215-Q264 HydrophobicContact CE2-CG 4.32Å; F215-Q264 HydrophobicContact CG-CB 4.27Å; F215-Q264 HydrophobicContact CG-CG 3.64Å; F215-Q264 HydrophobicContact CZ-CB 4.14Å; L251-Q264 HydrophobicContact CD2-CB 3.92Å; E252-Q264 PolarHBondContact OE2-NE2 2.73Å; E260-Q264 HydrophobicContact CG-CG 4.22Å; E260-Q264 VanDerWaalsContact CG-NE2 3.31Å; E260-Q264 WeakPolarHBondContact O-CG 2.96Å; E260-Q264 PolarHBondContact O-N 2.91Å; E260-Q264 WeakPolarHBondContact OE1-CG 3.42Å; E260-Q264 PolarHBondContact OE1-NE2 2.87Å; R261-Q264 PolarHBondContact O-N 2.93Å; Q264-K266 VanDerWaalsContact C-N 3.34Å; Q264-K266 PolarHBondContact O-N 3.48Å; Q264-S267 WeakPolarHBondContact O-CB 3.48Å; Q264-S267 PolarHBondContact O-N 2.97Å; Q264-S267 VanDerWaalsContact O-N 3.09Å; Q264-V268 WeakPolarHBondContact O-CG2 3.31Å; Q264-V268 PolarHBondContact O-N 3.22Å
265	L	98.7	Very high	97.4	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-56.2	-47.8	178.7	178.9	63.3	0	0	0	111.8	L251 R261 V262 S267 V268 W269 F293 L299 V304 L307 Y359	L251-L265 HydrophobicContact CD1-CB 3.95Å; L251-L265 HydrophobicContact CD1-CD1 4.19Å; R261-L265 WeakPolarHBondContact O-CB 3.34Å; R261-L265 PolarHBondContact O-N 2.97Å; V262-L265 PolarHBondContact O-N 3.1Å; L265-S267 VanDerWaalsContact C-N 3.32Å; L265-S267 PolarHBondContact O-N 3.03Å; L265-V268 PolarHBondContact O-N 3.49Å; L265-W269 HydrophobicContact CD1-CD2 4.19Å; L265-W269 HydrophobicContact CD1-CH2 4.42Å; L265-W269 HydrophobicContact CD1-CZ2 3.77Å; L265-W269 HydrophobicContact CD2-CH2 3.6Å; L265-W269 HydrophobicContact CD2-CZ2 3.74Å; L265-W269 HydrophobicContact CD2-CZ3 4.08Å; L265-W269 HydrophobicContact CG-CD2 4.1Å; L265-W269 HydrophobicContact CG-CE3 4.22Å; L265-W269 HydrophobicContact CG-CH2 3.99Å; L265-W269 HydrophobicContact CG-CZ2 3.85Å; L265-W269 HydrophobicContact CG-CZ3 4.18Å; L265-W269 PolarHBondContact O-N 3.33Å; L265-F293 HydrophobicContact CD1-CE1 4.07Å; L265-L299 HydrophobicContact CD1-CD1 4.14Å; L265-L299 HydrophobicContact CD2-CD1 3.7Å; L265-L299 HydrophobicContact CD2-CD2 3.7Å; L265-L299 HydrophobicContact CD2-CG 4.35Å; L265-V304 HydrophobicContact CD2-CG2 4.49Å; L265-L307 HydrophobicContact CB-CD1 4.31Å; L265-L307 HydrophobicContact CD2-CD1 3.79Å; L265-L307 HydrophobicContact CG-CD1 4.02Å; L265-Y359 HydrophobicContact CD1-CE2 4.05Å
266	K	98.3	Very high	97.5	Very high	102 Å²	102	34.5 Å²	34.5	44%	0.443	21%	0.206	S	C	.	.	H	α-helix	trans	-58.2	-46.2	176.1	-177.4	-177.9	179.7	-64.8	0	111.2	V262 T263 Q264 V268 W269 D270 L307	V262-K266 WeakPolarHBondContact O-CB 3.37Å; V262-K266 PolarHBondContact O-N 2.91Å; T263-K266 PolarHBondContact O-N 2.88Å; Q264-K266 VanDerWaalsContact C-N 3.34Å; Q264-K266 PolarHBondContact O-N 3.48Å; K266-V268 VanDerWaalsContact C-N 3.29Å; K266-V268 PolarHBondContact O-N 3.47Å; K266-W269 PolarHBondContact O-N 3.35Å; K266-D270 IonicContact NZ-OD2 3.26Å; K266-D270 PolarHBondContact NZ-OD2 3.16Å; K266-D270 WeakPolarHBondContact O-CB 3.36Å; K266-D270 VanDerWaalsContact O-CG 3.28Å; K266-D270 PolarHBondContact O-N 2.97Å; K266-L307 HydrophobicContact CB-CD1 4.17Å; K266-L307 HydrophobicContact CB-CD2 3.91Å; K266-L307 HydrophobicContact CD-CD2 4.18Å; K266-L307 HydrophobicContact CG-CD2 4.31Å
267	S	98.4	Very high	97.4	Very high	52 Å²	52	36 Å²	36	36%	0.364	22%	0.216	S	C	.	.	H	α-helix	trans	-58.6	-40.6	178	-171.7	0	0	0	0	112	T263 Q264 L265 T271	T263-S267 PolarHBondContact O-N 3.39Å; Q264-S267 WeakPolarHBondContact O-CB 3.48Å; Q264-S267 PolarHBondContact O-N 2.97Å; Q264-S267 VanDerWaalsContact O-N 3.09Å; L265-S267 VanDerWaalsContact C-N 3.32Å; L265-S267 PolarHBondContact O-N 3.03Å; S267-T271 PolarHBondContact O-N 3.4Å; S267-T271 PolarHBondContact O-OG1 2.97Å
268	V	98.8	Very high	96.8	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-67.8	-44	178.2	-177.5	0	0	0	0	111.2	F215 L224 Q264 L265 K266 D270 T271 M272 F293	F215-V268 HydrophobicContact CE1-CG2 4.1Å; F215-V268 HydrophobicContact CZ-CG2 3.77Å; L224-V268 HydrophobicContact CD1-CG1 3.92Å; L224-V268 HydrophobicContact CD1-CG2 3.88Å; L224-V268 HydrophobicContact CD2-CG1 4.34Å; L224-V268 HydrophobicContact CD2-CG2 4.16Å; Q264-V268 WeakPolarHBondContact O-CG2 3.31Å; Q264-V268 PolarHBondContact O-N 3.22Å; L265-V268 PolarHBondContact O-N 3.49Å; K266-V268 VanDerWaalsContact C-N 3.29Å; K266-V268 PolarHBondContact O-N 3.47Å; V268-D270 PolarHBondContact O-N 3.48Å; V268-T271 WeakPolarHBondContact O-CB 3.41Å; V268-T271 PolarHBondContact O-N 3.45Å; V268-M272 HydrophobicContact CG1-CG 4.46Å; V268-M272 WeakPolarHBondContact O-CG 3.42Å; V268-M272 PolarHBondContact O-N 2.86Å; V268-F293 HydrophobicContact CB-CD1 4.25Å; V268-F293 HydrophobicContact CB-CE1 3.94Å; V268-F293 HydrophobicContact CB-CZ 4.18Å; V268-F293 HydrophobicContact CG1-CB 4.34Å; V268-F293 HydrophobicContact CG1-CD1 3.43Å; V268-F293 VanDerWaalsContact CG1-CD1 3.43Å; V268-F293 HydrophobicContact CG1-CD2 3.82Å; V268-F293 HydrophobicContact CG1-CE1 3.54Å; V268-F293 HydrophobicContact CG1-CE2 3.91Å; V268-F293 HydrophobicContact CG1-CG 3.6Å; V268-F293 HydrophobicContact CG1-CZ 3.76Å; V268-F293 HydrophobicContact CG2-CE1 4.35Å; V268-F293 HydrophobicContact CG2-CZ 4.1Å
269	W	98.5	Very high	95.4	Very high	4 Å²	4	38.5 Å²	38.5	2%	0.015	25%	0.248	C	C	.	.	H	α-helix	trans	-63.7	-38.7	176.5	-72.9	-21.3	0	0	0	113.4	L265 K266 T271 M272 S273 V304 L307 L310 P311 I314 Y359	L265-W269 HydrophobicContact CD1-CD2 4.19Å; L265-W269 HydrophobicContact CD1-CH2 4.42Å; L265-W269 HydrophobicContact CD1-CZ2 3.77Å; L265-W269 HydrophobicContact CD2-CH2 3.6Å; L265-W269 HydrophobicContact CD2-CZ2 3.74Å; L265-W269 HydrophobicContact CD2-CZ3 4.08Å; L265-W269 HydrophobicContact CG-CD2 4.1Å; L265-W269 HydrophobicContact CG-CE3 4.22Å; L265-W269 HydrophobicContact CG-CH2 3.99Å; L265-W269 HydrophobicContact CG-CZ2 3.85Å; L265-W269 HydrophobicContact CG-CZ3 4.18Å; L265-W269 PolarHBondContact O-N 3.33Å; K266-W269 PolarHBondContact O-N 3.35Å; W269-T271 VanDerWaalsContact C-N 3.31Å; W269-T271 PolarHBondContact O-N 3.27Å; W269-M272 PolarHBondContact O-N 2.64Å; W269-S273 WeakPolarHBondContact O-CB 3.09Å; W269-S273 PolarHBondContact O-N 3.19Å; W269-S273 PolarHBondContact O-OG 2.94Å; W269-V304 HydrophobicContact CH2-CG1 4.13Å; W269-V304 HydrophobicContact CH2-CG2 4.41Å; W269-L307 HydrophobicContact CE3-CD1 3.87Å; W269-L307 HydrophobicContact CH2-CD1 4.12Å; W269-L307 HydrophobicContact CZ3-CB 3.97Å; W269-L307 HydrophobicContact CZ3-CD1 3.36Å; W269-L307 HydrophobicContact CZ3-CG 4.3Å; W269-L310 HydrophobicContact CH2-CD2 3.85Å; W269-L310 HydrophobicContact CZ2-CD2 3.48Å; W269-L310 VanDerWaalsContact CZ2-CD2 3.48Å; W269-P311 HydrophobicContact CB-CG 4.05Å; W269-P311 HydrophobicContact CD2-CG 3.91Å; W269-P311 VanDerWaalsContact CE3-CD 3.43Å; W269-P311 HydrophobicContact CE3-CG 3.58Å; W269-P311 HydrophobicContact CG-CG 4.15Å; W269-P311 HydrophobicContact CZ3-CG 4.25Å; W269-I314 HydrophobicContact CB-CD1 3.86Å; W269-I314 HydrophobicContact CG-CD1 3.8Å; W269-Y359 HydrophobicContact CZ2-CE1 4.39Å; W269-Y359 HydrophobicContact CZ2-CE2 4.07Å; W269-Y359 AromaticContact CZ2-CZ 3.95Å; W269-Y359 AromaticContact NE1-CD2 3.53Å; W269-Y359 AromaticContact NE1-CE2 3.7Å; W269-Y359 AromaticContact NE1-CG 3.94Å
270	D	98	Very high	93.6	Very high	80 Å²	80	41 Å²	41	43%	0.428	25%	0.249	S	C	.	.	H	α-helix	trans	-61.7	-42	173.8	-70.6	-20.4	0	0	0	109.9	K266 V268 S273 S274	K266-D270 IonicContact NZ-OD2 3.26Å; K266-D270 PolarHBondContact NZ-OD2 3.16Å; K266-D270 WeakPolarHBondContact O-CB 3.36Å; K266-D270 VanDerWaalsContact O-CG 3.28Å; K266-D270 PolarHBondContact O-N 2.97Å; V268-D270 PolarHBondContact O-N 3.48Å; D270-S273 PolarHBondContact O-N 2.93Å; D270-S274 VanDerWaalsContact O-CB 3.3Å; D270-S274 WeakPolarHBondContact O-CB 3.24Å; D270-S274 PolarHBondContact O-N 3.44Å
271	T	97.9	Very high	91.4	Very high	31 Å²	31	44.1 Å²	44.1	19%	0.19	27%	0.274	C	S	.	.	H	α-helix	trans	-65.5	-43	175.3	-62.1	0	0	0	0	112.9	L224 F247 S267 V268 W269 S273 S274 Y275	L224-T271 HydrophobicContact CD2-CG2 4.39Å; F247-T271 HydrophobicContact CE1-CG2 3.66Å; F247-T271 HydrophobicContact CZ-CG2 3.89Å; S267-T271 PolarHBondContact O-N 3.4Å; S267-T271 PolarHBondContact O-OG1 2.97Å; V268-T271 WeakPolarHBondContact O-CB 3.41Å; V268-T271 PolarHBondContact O-N 3.45Å; W269-T271 VanDerWaalsContact C-N 3.31Å; W269-T271 PolarHBondContact O-N 3.27Å; T271-S273 VanDerWaalsContact C-N 3.35Å; T271-S273 PolarHBondContact O-N 3.36Å; T271-S274 PolarHBondContact O-N 3.49Å; T271-Y275 PolarHBondContact O-N 3.33Å
272	M	97.9	Very high	89.1	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-57.9	-49.1	174.4	-72.2	176	73.6	0	0	110.9	F247 V268 W269 Y275 V276 S291 F293 L361	F247-M272 HydrophobicContact CD2-CG 4.04Å; F247-M272 HydrophobicContact CE2-CG 3.99Å; V268-M272 HydrophobicContact CG1-CG 4.46Å; V268-M272 WeakPolarHBondContact O-CG 3.42Å; V268-M272 PolarHBondContact O-N 2.86Å; W269-M272 PolarHBondContact O-N 2.64Å; M272-Y275 PolarHBondContact O-N 2.81Å; M272-V276 PolarHBondContact O-N 3.21Å; M272-S291 WeakPolarHBondContact CE-OG 3.34Å; M272-F293 HydrophobicContact CE-CB 3.92Å; M272-F293 HydrophobicContact CG-CB 4.32Å; M272-F293 HydrophobicContact SD-CB 3.38Å; M272-F293 WeakPolarHBondContact SD-CB 3.45Å; M272-F293 HydrophobicContact SD-CD1 4.17Å; M272-F293 HydrophobicContact SD-CG 4.18Å; M272-L361 HydrophobicContact CB-CD2 4.32Å; M272-L361 HydrophobicContact CE-CB 4.11Å
273	S	96.7	Very high	86.7	Confident	26 Å²	26	58.1 Å²	58.1	18%	0.182	35%	0.35	C	S	.	.	H	α-helix	trans	-63.9	-43.6	-179.1	-56	0	0	0	0	111.5	W269 D270 T271 Y275 V276 N277	W269-S273 WeakPolarHBondContact O-CB 3.09Å; W269-S273 PolarHBondContact O-N 3.19Å; W269-S273 PolarHBondContact O-OG 2.94Å; D270-S273 PolarHBondContact O-N 2.93Å; T271-S273 VanDerWaalsContact C-N 3.35Å; T271-S273 PolarHBondContact O-N 3.36Å; S273-Y275 VanDerWaalsContact C-N 3.34Å; S273-Y275 PolarHBondContact O-N 2.87Å; S273-V276 PolarHBondContact O-N 3.47Å; S273-N277 WeakPolarHBondContact O-CB 3.36Å; S273-N277 VanDerWaalsContact O-CG 3.23Å; S273-N277 PolarHBondContact O-N 2.96Å; S273-N277 PolarHBondContact O-ND2 3.49Å
274	S	95.8	Very high	85	Confident	83 Å²	83	57.2 Å²	57.2	58%	0.58	35%	0.347	S	S	*	.	H	α-helix	trans	-59.5	-44	175.3	-176.8	0	0	0	0	111.7	D270 T271 C278	D270-S274 VanDerWaalsContact O-CB 3.3Å; D270-S274 WeakPolarHBondContact O-CB 3.24Å; D270-S274 PolarHBondContact O-N 3.44Å; T271-S274 PolarHBondContact O-N 3.49Å; S274-C278 WeakPolarHBondContact O-CB 3.5Å; S274-C278 PolarHBondContact O-N 3.18Å
275	Y	95.5	Very high	83.8	Confident	11 Å²	11	61.9 Å²	61.9	4%	0.043	38%	0.38	C	S	.	.	H	α-helix	trans	-60.9	-51.6	177.1	173.5	-91.3	0	0	0	112.1	D228 R245 T271 M272 S273 C278 R289 A290	D228-Y275 WeakPolarHBondContact OD1-CE2 3.43Å; D228-Y275 PolarHBondContact OD1-OH 2.92Å; D228-Y275 VanDerWaalsContact OD1-OH 3.11Å; R245-Y275 HydrophobicContact CB-CD1 3.93Å; R245-Y275 HydrophobicContact CB-CD2 4.04Å; R245-Y275 HydrophobicContact CB-CE1 3.68Å; R245-Y275 HydrophobicContact CB-CE2 3.73Å; R245-Y275 HydrophobicContact CB-CG 4.11Å; R245-Y275 HydrophobicContact CG-CD2 4.47Å; R245-Y275 HydrophobicContact CG-CE2 4.37Å; R245-Y275 VanDerWaalsContact CZ-CE2 3.5Å; T271-Y275 PolarHBondContact O-N 3.33Å; M272-Y275 PolarHBondContact O-N 2.81Å; S273-Y275 VanDerWaalsContact C-N 3.34Å; S273-Y275 PolarHBondContact O-N 2.87Å; Y275-C278 PolarHBondContact O-N 3.12Å; Y275-R289 HydrophobicContact CE1-CB 4.23Å; Y275-R289 PolarHBondContact O-NE 3.46Å; Y275-R289 PolarHBondContact O-NH2 2.84Å; Y275-A290 WeakPolarHBondContact CE1-O 3.18Å
276	V	94.6	Very high	83	Confident	12 Å²	12	64.5 Å²	64.5	7%	0.073	39%	0.394	C	S	.	.	H	α-helix	trans	-65.7	-42.4	-174.6	170.9	0	0	0	0	111.2	M272 S273 C278 L361	M272-V276 PolarHBondContact O-N 3.21Å; S273-V276 PolarHBondContact O-N 3.47Å; V276-C278 VanDerWaalsContact C-N 3.3Å; V276-C278 PolarHBondContact O-N 3.27Å; V276-L361 HydrophobicContact CB-CD2 4.1Å; V276-L361 HydrophobicContact CB-CG 4.26Å; V276-L361 HydrophobicContact CG1-CG 4.33Å; V276-L361 HydrophobicContact CG2-CB 4.47Å; V276-L361 HydrophobicContact CG2-CD2 3.99Å; V276-L361 HydrophobicContact CG2-CG 3.96Å
277	N	91.3	Very high	82.4	Confident	99 Å²	99	67.1 Å²	67.1	53%	0.529	40%	0.401	S	S	.	.	H	α-helix	trans	-80.9	-10.6	-177.4	-60.6	-33.1	0	0	0	113.2	S273 G279 D280	S273-N277 WeakPolarHBondContact O-CB 3.36Å; S273-N277 VanDerWaalsContact O-CG 3.23Å; S273-N277 PolarHBondContact O-N 2.96Å; S273-N277 PolarHBondContact O-ND2 3.49Å; N277-G279 PolarHBondContact O-N 3.48Å; N277-D280 PolarHBondContact O-N 3.29Å
278	C	84.1	Confident	82	Confident	71 Å²	71	64.7 Å²	64.7	48%	0.48	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	120.3	177.6	179.6	0	0	0	0	109.5	S274 Y275 V276 R289	S274-C278 WeakPolarHBondContact O-CB 3.5Å; S274-C278 PolarHBondContact O-N 3.18Å; Y275-C278 PolarHBondContact O-N 3.12Å; V276-C278 VanDerWaalsContact C-N 3.3Å; V276-C278 PolarHBondContact O-N 3.27Å; C278-R289 WeakPolarHBondContact O-CD 3.39Å; C278-R289 PolarHBondContact O-NH1 3.39Å
279	G	68.3	Low	81.7	Confident	61 Å²	61	67.6 Å²	67.6	63%	0.629	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.5	6.3	177.3	0	0	0	0	0	115.6	N277 S281	N277-G279 PolarHBondContact O-N 3.48Å; G279-S281 PolarHBondContact O-N 3.21Å
280	D	59.9	Low	81.6	Confident	104 Å²	104	67.4 Å²	67.4	56%	0.556	40%	0.395	S	S	*	.			trans	-71.3	39.1	169.8	-78	-20.1	0	0	0	113	N277 K282	N277-D280 PolarHBondContact O-N 3.29Å; D280-K282 PolarHBondContact O-N 3.29Å; D280-K282 VanDerWaalsContact O-N 3.13Å
281	S	53.1	Low	81.7	Confident	93 Å²	93	63.6 Å²	63.6	65%	0.65	37%	0.374	S	S	*	.			trans	-60.5	121.4	153.4	56.1	0	0	0	0	105.3	G279 A283	G279-S281 PolarHBondContact O-N 3.21Å; S281-A283 PolarHBondContact O-N 3.08Å
282	K	50.5	Low	81.7	Confident	222 Å²	222	62.1 Å²	62.1	97%	0.965	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.3	10.7	-171.6	-65.6	179.9	174.9	179.6	0	116.2	D280	D280-K282 PolarHBondContact O-N 3.29Å; D280-K282 VanDerWaalsContact O-N 3.13Å
283	A	47.4	Very low	81.8	Confident	90 Å²	90	62.1 Å²	62.1	74%	0.744	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.8	-7.9	-163.8	0	0	0	0	0	115.5	S281	S281-A283 PolarHBondContact O-N 3.08Å
284	S	61.9	Low	81.9	Confident	59 Å²	59	60.9 Å²	60.9	41%	0.413	36%	0.356	S	S	.	.			trans	-141.9	90.7	175.7	-161.1	0	0	0	0	113.2	N286 R287	S284-N286 PolarHBondContact O-N 2.89Å; S284-R287 PolarHBondContact O-N 2.94Å; S284-R287 VanDerWaalsContact O-N 3.14Å
285	S	74.6	Confident	82	Confident	100 Å²	100	56.9 Å²	56.9	70%	0.699	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-13.9	173.9	53.8	0	0	0	0	114.1	R364	S285-R364 PolarHBondContact O-NH2 3.45Å
286	N	82.2	Confident	82.2	Confident	55 Å²	55	56.5 Å²	56.5	29%	0.294	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85	-14.8	-179.3	-66.1	-19.7	0	0	0	113.6	N239 L240 E241 S284	N239-N286 WeakPolarHBondContact O-CB 3.45Å; L240-N286 HydrophobicContact CD2-CB 4.32Å; E241-N286 PolarHBondContact N-O 3.16Å; S284-N286 PolarHBondContact O-N 2.89Å
287	R	85	Confident	82.4	Confident	156 Å²	156	55.9 Å²	55.9	59%	0.589	32%	0.324	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.2	108.4	-178.6	-68.4	-166.2	165	177.8	-0	111.9	E241 S284	E241-R287 HydrophobicContact CB-CG 4.35Å; E241-R287 IonicContact OE1-CZ 2.67Å; E241-R287 IonicContact OE1-NE 3.17Å; E241-R287 PolarHBondContact OE1-NE 3.41Å; E241-R287 IonicContact OE1-NH2 3.24Å; E241-R287 PolarHBondContact OE1-NH2 3.06Å; E241-R287 WeakPolarHBondContact OE2-CD 3.21Å; E241-R287 WeakPolarHBondContact OE2-CG 3.4Å; E241-R287 IonicContact OE2-CZ 3.54Å; E241-R287 IonicContact OE2-NE 3.48Å; E241-R287 PolarHBondContact OE2-NE 2.87Å; E241-R287 IonicContact OE2-NH2 3.64Å; S284-R287 PolarHBondContact O-N 2.94Å; S284-R287 VanDerWaalsContact O-N 3.14Å
288	G	89.5	Confident	82.7	Confident	1 Å²	1	51.6 Å²	51.6	1%	0.01	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	134.5	170.1	0	0	0	0	0	112	E241 L242 N243 S363	E241-G288 WeakPolarHBondContact O-CA 3.4Å; E241-G288 PolarHBondContact O-N 2.81Å; L242-G288 WeakPolarHBondContact CA-O 3.43Å; N243-G288 PolarHBondContact N-O 3.47Å; G288-S363 WeakPolarHBondContact CA-OG 3.33Å
289	R	93.7	Very high	83.4	Confident	61 Å²	61	48.2 Å²	48.2	23%	0.23	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	139.7	164.3	-63.6	-176.2	78.1	155.8	1.6	109.7	N243 Y275 C278 G362 S363	N243-R289 WeakPolarHBondContact O-CA 3.35Å; Y275-R289 HydrophobicContact CE1-CB 4.23Å; Y275-R289 PolarHBondContact O-NE 3.46Å; Y275-R289 PolarHBondContact O-NH2 2.84Å; C278-R289 WeakPolarHBondContact O-CD 3.39Å; C278-R289 PolarHBondContact O-NH1 3.39Å; R289-G362 WeakPolarHBondContact O-CA 3.47Å; R289-S363 PolarHBondContact O-N 3.32Å; R289-S363 VanDerWaalsContact O-N 3.1Å
290	A	96.5	Very high	84.6	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	159.8	174	0	0	0	0	0	111.2	L242 N243 L244 R245 Y275 L361 I365	L242-A290 HydrophobicContact CD1-CB 4.21Å; N243-A290 PolarHBondContact O-N 2.93Å; L244-A290 CarbonylContact C-O 3.51Å; L244-A290 WeakPolarHBondContact CA-O 3.21Å; L244-A290 HydrophobicContact CD1-CB 3.92Å; R245-A290 PolarHBondContact N-O 2.83Å; Y275-A290 WeakPolarHBondContact CE1-O 3.18Å; A290-L361 CarbonylContact C-O 3.53Å; A290-L361 VanDerWaalsContact CA-O 3.26Å; A290-L361 WeakPolarHBondContact CA-O 3.32Å; A290-I365 HydrophobicContact CB-CB 4.33Å; A290-I365 HydrophobicContact CB-CG2 3.55Å
291	S	98.4	Very high	86.1	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	141.8	171.8	57.1	0	0	0	0	110.8	R245 M272 V360 L361	R245-S291 CarbonylContact O-C 3.52Å; R245-S291 VanDerWaalsContact O-CA 3.24Å; R245-S291 WeakPolarHBondContact O-CA 3.49Å; M272-S291 WeakPolarHBondContact CE-OG 3.34Å; S291-V360 WeakPolarHBondContact O-CA 3.49Å; S291-L361 PolarHBondContact N-O 3.48Å; S291-L361 PolarHBondContact O-N 3.27Å
292	I	98.9	Very high	88.1	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	128.6	168	-69.8	168.6	0	0	0	107.6	V124 L244 R245 I246 F247 M358 Y359 V360 I365 F395	V124-I292 HydrophobicContact CG1-CG2 4.45Å; V124-I292 HydrophobicContact CG2-CD1 3.95Å; L244-I292 HydrophobicContact CD1-CB 4.46Å; L244-I292 HydrophobicContact CD1-CD1 4.14Å; L244-I292 HydrophobicContact CD1-CG1 4Å; L244-I292 HydrophobicContact CD2-CD1 4.15Å; R245-I292 PolarHBondContact O-N 2.75Å; I246-I292 CarbonylContact C-O 3.58Å; I246-I292 HydrophobicContact CD1-CB 4.18Å; I246-I292 HydrophobicContact CD1-CD1 4.47Å; F247-I292 PolarHBondContact N-O 3.46Å; I292-M358 HydrophobicContact CG2-CG 3.92Å; I292-M358 HydrophobicContact CG2-SD 4.29Å; I292-Y359 CarbonylContact C-O 3.59Å; I292-Y359 WeakPolarHBondContact CA-O 3.47Å; I292-V360 HydrophobicContact CG1-CB 4.31Å; I292-V360 HydrophobicContact CG1-CG2 3.98Å; I292-I365 HydrophobicContact CD1-CD1 3.74Å; I292-I365 HydrophobicContact CG1-CD1 4.32Å; I292-F395 HydrophobicContact CD1-CD1 4.21Å; I292-F395 HydrophobicContact CD1-CD2 3.84Å; I292-F395 HydrophobicContact CD1-CE1 3.92Å; I292-F395 HydrophobicContact CD1-CE2 3.55Å; I292-F395 HydrophobicContact CD1-CG 4.16Å; I292-F395 HydrophobicContact CD1-CZ 3.56Å; I292-F395 HydrophobicContact CG1-CE1 4.22Å; I292-F395 HydrophobicContact CG1-CE2 4.48Å; I292-F395 HydrophobicContact CG1-CZ 4.02Å; I292-F395 HydrophobicContact CG2-CZ 4.43Å
293	F	98.9	Very high	90.3	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	123.1	169.7	170.3	-140.3	0	0	0	109.3	L224 F247 A249 L251 L265 V268 M272 L297 M358 Y359	L224-F293 HydrophobicContact CD1-CE2 4.35Å; F247-F293 HydrophobicContact CB-CB 4.01Å; F247-F293 HydrophobicContact CB-CD2 3.85Å; F247-F293 HydrophobicContact CB-CG 4.3Å; F247-F293 WeakPolarHBondContact O-CA 3.47Å; A249-F293 HydrophobicContact CB-CE2 3.89Å; A249-F293 HydrophobicContact CB-CZ 4.26Å; L251-F293 HydrophobicContact CD2-CZ 4.42Å; L265-F293 HydrophobicContact CD1-CE1 4.07Å; V268-F293 HydrophobicContact CB-CD1 4.25Å; V268-F293 HydrophobicContact CB-CE1 3.94Å; V268-F293 HydrophobicContact CB-CZ 4.18Å; V268-F293 HydrophobicContact CG1-CB 4.34Å; V268-F293 HydrophobicContact CG1-CD1 3.43Å; V268-F293 VanDerWaalsContact CG1-CD1 3.43Å; V268-F293 HydrophobicContact CG1-CD2 3.82Å; V268-F293 HydrophobicContact CG1-CE1 3.54Å; V268-F293 HydrophobicContact CG1-CE2 3.91Å; V268-F293 HydrophobicContact CG1-CG 3.6Å; V268-F293 HydrophobicContact CG1-CZ 3.76Å; V268-F293 HydrophobicContact CG2-CE1 4.35Å; V268-F293 HydrophobicContact CG2-CZ 4.1Å; M272-F293 HydrophobicContact CE-CB 3.92Å; M272-F293 HydrophobicContact CG-CB 4.32Å; M272-F293 HydrophobicContact SD-CB 3.38Å; M272-F293 WeakPolarHBondContact SD-CB 3.45Å; M272-F293 HydrophobicContact SD-CD1 4.17Å; M272-F293 HydrophobicContact SD-CG 4.18Å; F293-L297 HydrophobicContact CE1-CD1 3.89Å; F293-L297 HydrophobicContact CE1-CD2 3.88Å; F293-L297 HydrophobicContact CE2-CD2 3.85Å; F293-L297 HydrophobicContact CZ-CD1 4.18Å; F293-L297 HydrophobicContact CZ-CD2 3.3Å; F293-L297 HydrophobicContact CZ-CG 4.41Å; F293-M358 CarbonylContact O-C 3.54Å; F293-M358 VanDerWaalsContact O-CA 3.32Å; F293-M358 WeakPolarHBondContact O-CA 3.21Å; F293-Y359 AromaticContact CD1-CD2 3.72Å; F293-Y359 HydrophobicContact CD1-CD2 3.72Å; F293-Y359 HydrophobicContact CD1-CE2 4.39Å; F293-Y359 HydrophobicContact CE1-CD2 4.23Å; F293-Y359 HydrophobicContact CE1-CE2 4.46Å; F293-Y359 PolarHBondContact N-O 3.12Å; F293-Y359 PolarHBondContact O-N 3.49Å
294	C	98.9	Very high	92.6	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	157.4	175.4	60.5	0	0	0	0	111.8	F247 T248 R357 M358	F247-C294 PolarHBondContact O-N 3.22Å; T248-C294 VanDerWaalsContact CA-O 3.22Å; T248-C294 WeakPolarHBondContact CA-O 3.34Å; T248-C294 PolarHBondContact OG1-O 3.23Å; C294-R357 VanDerWaalsContact CA-O 3.26Å; C294-R357 WeakPolarHBondContact CA-O 3.46Å; C294-M358 HydrophobicContact CB-CB 3.97Å; C294-M358 HydrophobicContact CB-CE 3.64Å; C294-M358 HydrophobicContact CB-CG 3.87Å
295	G	98.9	Very high	94.1	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	160.1	178	179.3	0	0	0	0	0	111.9	S126 L297 D356 R357	S126-G295 VanDerWaalsContact OG-CA 3.23Å; S126-G295 WeakPolarHBondContact OG-CA 3.43Å; S126-G295 PolarHBondContact OG-N 3.16Å; G295-L297 WeakPolarHBondContact O-CG 3.49Å; G295-L297 PolarHBondContact O-N 3.26Å; G295-D356 VanDerWaalsContact O-CA 3.27Å; G295-D356 WeakPolarHBondContact O-CA 3.24Å; G295-R357 PolarHBondContact N-O 3.37Å; G295-R357 PolarHBondContact O-N 2.85Å; G295-R357 VanDerWaalsContact O-N 3.13Å
296	D	98.9	Very high	95	Very high	2 Å²	2	33.5 Å²	33.5	1%	0.011	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	101.5	161.2	-179	-3.4	0	0	0	109.2	N128 Q159 H250 L251 N298 Y355 H388	N128-D296 HydrophobicContact CB-CB 4.03Å; N128-D296 PolarHBondContact ND2-OD2 2.79Å; Q159-D296 HydrophobicContact CG-CB 4.41Å; H250-D296 CarbonylContact C-O 3.57Å; H250-D296 VanDerWaalsContact CA-O 3.31Å; H250-D296 WeakPolarHBondContact CA-O 3.3Å; H250-D296 IonicContact CD2-OD2 3.53Å; H250-D296 IonicContact CE1-OD2 3.65Å; H250-D296 IonicContact NE2-OD2 2.83Å; H250-D296 PolarHBondContact NE2-OD2 3.09Å; L251-D296 PolarHBondContact N-O 3.11Å; D296-N298 PolarHBondContact OD1-N 2.96Å; D296-N298 PolarHBondContact OD1-ND2 2.94Å; D296-Y355 WeakPolarHBondContact OD1-CB 3.4Å; D296-H388 IonicContact OD2-CE1 3.54Å; D296-H388 PolarHBondContact OD2-CE1 3.08Å; D296-H388 IonicContact OD2-NE2 3.46Å
297	L	98.8	Very high	95.6	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	18%	0.175	C	C	.	.			trans	-91.6	-4.9	-177.5	-49.4	-164.5	0	0	0	111.9	L251 R261 F293 G295 L299 Y355 R357 Y359	L251-L297 WeakPolarHBondContact CB-O 3.2Å; L251-L297 HydrophobicContact CD1-CB 4.01Å; L251-L297 HydrophobicContact CD1-CD2 4.22Å; L251-L297 HydrophobicContact CG-CB 4.3Å; L251-L297 HydrophobicContact CG-CD2 4.08Å; R261-L297 WeakPolarHBondContact CD-O 3.39Å; F293-L297 HydrophobicContact CE1-CD1 3.89Å; F293-L297 HydrophobicContact CE1-CD2 3.88Å; F293-L297 HydrophobicContact CE2-CD2 3.85Å; F293-L297 HydrophobicContact CZ-CD1 4.18Å; F293-L297 HydrophobicContact CZ-CD2 3.3Å; F293-L297 HydrophobicContact CZ-CG 4.41Å; G295-L297 WeakPolarHBondContact O-CG 3.49Å; G295-L297 PolarHBondContact O-N 3.26Å; L297-L299 HydrophobicContact CB-CB 4.43Å; L297-L299 HydrophobicContact CB-CD1 3.73Å; L297-L299 HydrophobicContact CB-CG 3.72Å; L297-L299 HydrophobicContact CD1-CD1 3.88Å; L297-L299 HydrophobicContact CG-CD1 4.49Å; L297-L299 WeakPolarHBondContact O-CG 3.39Å; L297-L299 PolarHBondContact O-N 3.16Å; L297-Y355 WeakPolarHBondContact CA-O 3.13Å; L297-Y355 WeakPolarHBondContact CB-O 3.2Å; L297-Y355 PolarHBondContact N-O 2.68Å; L297-R357 HydrophobicContact CD1-CB 3.8Å; L297-R357 HydrophobicContact CD1-CG 4.41Å; L297-R357 HydrophobicContact CG-CB 4.25Å; L297-Y359 HydrophobicContact CD1-CD2 4.04Å; L297-Y359 HydrophobicContact CD1-CE2 3.34Å
298	N	98.5	Very high	96.1	Very high	8 Å²	8	29.6 Å²	29.6	4%	0.043	19%	0.185	C	C	.	.			trans	51.5	17.1	-176.5	-82.6	-75.1	0	0	0	115.3	H250 L251 E252 S253 R261 D296 R300 Y355	H250-N298 PolarHBondContact CD2-ND2 3.4Å; H250-N298 VanDerWaalsContact CD2-ND2 3.29Å; H250-N298 PolarHBondContact NE2-ND2 2.79Å; L251-N298 PolarHBondContact O-ND2 3.07Å; E252-N298 WeakPolarHBondContact O-CB 3.44Å; S253-N298 PolarHBondContact OG-ND2 3.42Å; R261-N298 VanDerWaalsContact CD-C 3.5Å; R261-N298 WeakPolarHBondContact CD-O 3.49Å; R261-N298 PolarHBondContact NE-O 2.88Å; R261-N298 VanDerWaalsContact NE-O 3.13Å; D296-N298 PolarHBondContact OD1-N 2.96Å; D296-N298 PolarHBondContact OD1-ND2 2.94Å; N298-R300 PolarHBondContact O-NH1 3.33Å; N298-Y355 VanDerWaalsContact C-CD1 3.49Å
299	L	97.7	Very high	96.4	Very high	1 Å²	1	30.6 Å²	30.6	1%	0.005	20%	0.195	C	C	.	.			trans	-77.1	141.2	-167.2	-73	172.3	0	0	0	113	R261 L265 L297 E303 V304 R357 Y359	R261-L299 HydrophobicContact CG-CD2 3.88Å; L265-L299 HydrophobicContact CD1-CD1 4.14Å; L265-L299 HydrophobicContact CD2-CD1 3.7Å; L265-L299 HydrophobicContact CD2-CD2 3.7Å; L265-L299 HydrophobicContact CD2-CG 4.35Å; L297-L299 HydrophobicContact CB-CB 4.43Å; L297-L299 HydrophobicContact CB-CD1 3.73Å; L297-L299 HydrophobicContact CB-CG 3.72Å; L297-L299 HydrophobicContact CD1-CD1 3.88Å; L297-L299 HydrophobicContact CG-CD1 4.49Å; L297-L299 WeakPolarHBondContact O-CG 3.39Å; L297-L299 PolarHBondContact O-N 3.16Å; L299-E303 WeakPolarHBondContact CA-OE2 3.33Å; L299-E303 HydrophobicContact CD2-CB 4.2Å; L299-V304 HydrophobicContact CD1-CG2 4.38Å; L299-R357 VanDerWaalsContact CB-CZ 3.47Å; L299-R357 PolarHBondContact O-NH2 3.31Å; L299-Y359 WeakPolarHBondContact CD1-OH 3.44Å
300	R	94.7	Very high	96.5	Very high	49 Å²	49	30.6 Å²	30.6	19%	0.185	20%	0.2	C	C	.	.			trans	-95.2	145.6	158.3	-75.5	67.2	176.9	169.5	3.9	108.3	N298 S302 E303 Y355	N298-R300 PolarHBondContact O-NH1 3.33Å; R300-S302 PolarHBondContact O-N 2.85Å; R300-S302 VanDerWaalsContact O-N 3.14Å; R300-E303 HydrophobicContact CB-CG 4.15Å; R300-E303 PolarHBondContact N-OE2 3.12Å; R300-E303 VanDerWaalsContact O-CB 3.31Å; R300-E303 WeakPolarHBondContact O-CB 3.31Å; R300-E303 PolarHBondContact O-N 3.17Å; R300-Y355 VanDerWaalsContact NH1-CE1 3.33Å; R300-Y355 PolarHBondContact NH2-OH 2.94Å
301	D	91.7	Very high	96.5	Very high	64 Å²	64	32.7 Å²	32.7	34%	0.342	21%	0.213	S	C	.	.	H	α-helix	trans	-58.6	-33.2	-177.7	-69	-24.7	0	0	0	112.5	E303 V304 R328 R354 R357	D301-E303 PolarHBondContact O-N 2.8Å; D301-V304 PolarHBondContact O-N 2.97Å; D301-R328 IonicContact OD2-CZ 3.5Å; D301-R328 IonicContact OD2-NH2 3.69Å; D301-R328 PolarHBondContact OD2-NH2 3.23Å; D301-R354 IonicContact OD1-NH2 2.82Å; D301-R354 PolarHBondContact OD1-NH2 2.95Å; D301-R357 IonicContact OD1-CZ 3.89Å; D301-R357 IonicContact OD1-NH1 3.33Å; D301-R357 IonicContact OD1-NH2 3.69Å; D301-R357 PolarHBondContact OD1-NH2 3.42Å
302	S	94	Very high	96.4	Very high	81 Å²	81	43.6 Å²	43.6	57%	0.566	26%	0.256	S	S	*	.	H	α-helix	trans	-61.6	-23.8	175.2	57.4	0	0	0	0	114.2	R300 C305 V306	R300-S302 PolarHBondContact O-N 2.85Å; R300-S302 VanDerWaalsContact O-N 3.14Å; S302-C305 WeakPolarHBondContact O-CB 3.47Å; S302-C305 PolarHBondContact O-N 3.09Å; S302-V306 WeakPolarHBondContact O-CG2 3.38Å; S302-V306 PolarHBondContact O-N 3.33Å; S302-V306 VanDerWaalsContact O-N 3.17Å
303	E	97	Very high	96.2	Very high	6 Å²	6	44.9 Å²	44.9	3%	0.028	27%	0.269	C	S	.	.	H	α-helix	trans	-76.2	-31.5	-178.5	-63.7	179.3	135.1	0	0	111.9	S258 R261 V262 L299 R300 D301 C305 V306	S258-E303 VanDerWaalsContact CA-OE1 3.27Å; S258-E303 WeakPolarHBondContact CA-OE1 3.27Å; S258-E303 WeakPolarHBondContact CB-OE1 3.26Å; S258-E303 PolarHBondContact OG-OE1 3.2Å; R261-E303 IonicContact CZ-OE1 3.88Å; R261-E303 VanDerWaalsContact CZ-OE1 3.28Å; R261-E303 IonicContact CZ-OE2 3.95Å; R261-E303 IonicContact NE-OE1 2.98Å; R261-E303 PolarHBondContact NE-OE1 3.24Å; R261-E303 IonicContact NE-OE2 2.67Å; R261-E303 PolarHBondContact NE-OE2 3.31Å; R261-E303 IonicContact NH2-OE1 3.7Å; R261-E303 PolarHBondContact NH2-OE1 3.35Å; R261-E303 IonicContact NH2-OE2 2.79Å; R261-E303 PolarHBondContact NH2-OE2 2.73Å; V262-E303 HydrophobicContact CG2-CB 3.81Å; V262-E303 HydrophobicContact CG2-CG 4.19Å; L299-E303 WeakPolarHBondContact CA-OE2 3.33Å; L299-E303 HydrophobicContact CD2-CB 4.2Å; R300-E303 HydrophobicContact CB-CG 4.15Å; R300-E303 PolarHBondContact N-OE2 3.12Å; R300-E303 VanDerWaalsContact O-CB 3.31Å; R300-E303 WeakPolarHBondContact O-CB 3.31Å; R300-E303 PolarHBondContact O-N 3.17Å; D301-E303 PolarHBondContact O-N 2.8Å; E303-C305 VanDerWaalsContact C-N 3.28Å; E303-C305 PolarHBondContact O-N 3.22Å; E303-V306 WeakPolarHBondContact O-CB 3.06Å; E303-V306 PolarHBondContact O-N 2.98Å
304	V	95.4	Very high	96.2	Very high	18 Å²	18	45.2 Å²	45.2	11%	0.109	27%	0.271	C	S	.	.	H	α-helix	trans	-63.7	-39.3	168.8	174.6	0	0	0	0	109.9	L265 W269 L299 D301 V306 L307 G309 L310	L265-V304 HydrophobicContact CD2-CG2 4.49Å; W269-V304 HydrophobicContact CH2-CG1 4.13Å; W269-V304 HydrophobicContact CH2-CG2 4.41Å; L299-V304 HydrophobicContact CD1-CG2 4.38Å; D301-V304 PolarHBondContact O-N 2.97Å; V304-V306 VanDerWaalsContact C-N 3.29Å; V304-V306 PolarHBondContact O-N 2.94Å; V304-L307 PolarHBondContact O-N 3.36Å; V304-L307 VanDerWaalsContact O-N 3.16Å; V304-G309 PolarHBondContact O-N 2.95Å; V304-L310 HydrophobicContact CG1-CD2 4.33Å
305	C	93.3	Very high	96.2	Very high	95 Å²	95	49.1 Å²	49.1	64%	0.642	29%	0.289	S	S	*	.	H	α-helix	trans	-64.8	-31.1	175.8	-56.3	0	0	0	0	113	S302 E303 L307 G308	S302-C305 WeakPolarHBondContact O-CB 3.47Å; S302-C305 PolarHBondContact O-N 3.09Å; E303-C305 VanDerWaalsContact C-N 3.28Å; E303-C305 PolarHBondContact O-N 3.22Å; C305-L307 PolarHBondContact O-N 2.91Å; C305-G308 PolarHBondContact O-N 2.67Å
306	V	94.4	Very high	96.2	Very high	106 Å²	106	49.4 Å²	49.4	64%	0.642	29%	0.29	S	S	*	.	H	α-helix	trans	-61.6	-32	175.4	171.7	0	0	0	0	111.5	V262 S302 E303 V304 G308	V262-V306 HydrophobicContact CG1-CG1 4.14Å; S302-V306 WeakPolarHBondContact O-CG2 3.38Å; S302-V306 PolarHBondContact O-N 3.33Å; S302-V306 VanDerWaalsContact O-N 3.17Å; E303-V306 WeakPolarHBondContact O-CB 3.06Å; E303-V306 PolarHBondContact O-N 2.98Å; V304-V306 VanDerWaalsContact C-N 3.29Å; V304-V306 PolarHBondContact O-N 2.94Å; V306-G308 VanDerWaalsContact C-N 3.27Å; V306-G308 PolarHBondContact O-N 3.15Å
307	L	95.3	Very high	96.1	Very high	53 Å²	53	49.3 Å²	49.3	28%	0.277	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.8	3.6	176.4	-65.8	176	0	0	0	113.9	V262 L265 K266 W269 V304 C305	V262-L307 HydrophobicContact CG1-CD1 4.25Å; V262-L307 HydrophobicContact CG1-CD2 3.57Å; V262-L307 HydrophobicContact CG1-CG 3.82Å; L265-L307 HydrophobicContact CB-CD1 4.31Å; L265-L307 HydrophobicContact CD2-CD1 3.79Å; L265-L307 HydrophobicContact CG-CD1 4.02Å; K266-L307 HydrophobicContact CB-CD1 4.17Å; K266-L307 HydrophobicContact CB-CD2 3.91Å; K266-L307 HydrophobicContact CD-CD2 4.18Å; K266-L307 HydrophobicContact CG-CD2 4.31Å; W269-L307 HydrophobicContact CE3-CD1 3.87Å; W269-L307 HydrophobicContact CH2-CD1 4.12Å; W269-L307 HydrophobicContact CZ3-CB 3.97Å; W269-L307 HydrophobicContact CZ3-CD1 3.36Å; W269-L307 HydrophobicContact CZ3-CG 4.3Å; V304-L307 PolarHBondContact O-N 3.36Å; V304-L307 VanDerWaalsContact O-N 3.16Å; C305-L307 PolarHBondContact O-N 2.91Å
308	G	95	Very high	96.1	Very high	76 Å²	76	49.8 Å²	49.8	78%	0.784	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.1	12	-176.2	0	0	0	0	0	114.2	C305 V306	C305-G308 PolarHBondContact O-N 2.67Å; V306-G308 VanDerWaalsContact C-N 3.27Å; V306-G308 PolarHBondContact O-N 3.15Å
309	G	95.3	Very high	96.1	Very high	23 Å²	23	52.5 Å²	52.5	24%	0.237	31%	0.306	C	S	.	.	S	Bend	trans	100.3	-167.7	-174.8	0	0	0	0	0	112.6	V304	V304-G309 PolarHBondContact O-N 2.95Å
310	L	96.5	Very high	96	Very high	61 Å²	61	57.1 Å²	57.1	32%	0.319	33%	0.328	S	S	.	.	S	Bend	trans	-72.1	136.6	174.2	-65.2	175.6	0	0	0	109.8	W269 V304 D316 Y359	W269-L310 HydrophobicContact CH2-CD2 3.85Å; W269-L310 HydrophobicContact CZ2-CD2 3.48Å; W269-L310 VanDerWaalsContact CZ2-CD2 3.48Å; V304-L310 HydrophobicContact CG1-CD2 4.33Å; L310-D316 HydrophobicContact CD1-CB 4Å; L310-Y359 HydrophobicContact CD2-CD1 4.06Å; L310-Y359 HydrophobicContact CD2-CE1 3.7Å
311	P	96.6	Very high	96.1	Very high	43 Å²	43	55.9 Å²	55.9	28%	0.279	33%	0.326	S	S	.	.	P	Polyproline II helix	trans	-57.5	155.1	170.3	-25.7	36	0	0	0	112	W269 G313 I314	W269-P311 HydrophobicContact CB-CG 4.05Å; W269-P311 HydrophobicContact CD2-CG 3.91Å; W269-P311 VanDerWaalsContact CE3-CD 3.43Å; W269-P311 HydrophobicContact CE3-CG 3.58Å; W269-P311 HydrophobicContact CG-CG 4.15Å; W269-P311 HydrophobicContact CZ3-CG 4.25Å; P311-G313 PolarHBondContact O-N 3.15Å; P311-I314 HydrophobicContact CB-CD1 3.89Å; P311-I314 HydrophobicContact CB-CG1 4.12Å; P311-I314 HydrophobicContact CG-CD1 3.92Å; P311-I314 PolarHBondContact O-N 3.33Å
312	Y	95.3	Very high	96.2	Very high	230 Å²	230	55.5 Å²	55.5	90%	0.902	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.2	129	-179	178.9	-96.2	0	0	0	112	I314	Y312-I314 PolarHBondContact O-N 3.29Å
313	G	96.1	Very high	96.3	Very high	27 Å²	27	54.4 Å²	54.4	28%	0.278	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.5	-9.1	179.5	0	0	0	0	0	115.4	P311 H315 L361	P311-G313 PolarHBondContact O-N 3.15Å; G313-H315 PolarHBondContact O-CD2 3.36Å; G313-L361 WeakPolarHBondContact O-CD1 3.17Å
314	I	98	Very high	96.1	Very high	7 Å²	7	58.4 Å²	58.4	4%	0.036	34%	0.344	C	S	.	.			trans	-81.8	121.9	172	-57.3	-167.4	0	0	0	108.3	W269 P311 Y312 Y359 V360 L361	W269-I314 HydrophobicContact CB-CD1 3.86Å; W269-I314 HydrophobicContact CG-CD1 3.8Å; P311-I314 HydrophobicContact CB-CD1 3.89Å; P311-I314 HydrophobicContact CB-CG1 4.12Å; P311-I314 HydrophobicContact CG-CD1 3.92Å; P311-I314 PolarHBondContact O-N 3.33Å; Y312-I314 PolarHBondContact O-N 3.29Å; I314-Y359 HydrophobicContact CG2-CD1 4.37Å; I314-Y359 HydrophobicContact CG2-CG 4.3Å; I314-V360 WeakPolarHBondContact CA-O 3.33Å; I314-L361 HydrophobicContact CD1-CD2 4.44Å; I314-L361 HydrophobicContact CG1-CB 4.11Å; I314-L361 HydrophobicContact CG1-CD1 4.1Å; I314-L361 HydrophobicContact CG1-CD2 4.05Å; I314-L361 HydrophobicContact CG1-CG 4.3Å
315	H	98.2	Very high	95.9	Very high	82 Å²	82	63 Å²	63	38%	0.38	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	137.5	176.7	-63.2	-97	0	0	0	110.6	G313 E320 Y359 V360	G313-H315 PolarHBondContact O-CD2 3.36Å; H315-E320 IonicContact CE1-OE2 3.22Å; H315-E320 IonicContact CG-OE2 3.28Å; H315-E320 IonicContact ND1-OE2 2.66Å; H315-E320 PolarHBondContact ND1-OE2 3.46Å; H315-Y359 CarbonylContact O-C 3.48Å; H315-Y359 WeakPolarHBondContact O-CA 3.37Å; H315-V360 HydrophobicContact CB-CG1 3.96Å; H315-V360 PolarHBondContact N-O 2.89Å; H315-V360 PolarHBondContact O-N 2.9Å
316	D	98.5	Very high	95.8	Very high	5 Å²	5	63.7 Å²	63.7	3%	0.027	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	119.9	164.6	-177.7	-43.7	0	0	0	108.4	L310 W318 N319 E320 R354 Y359	L310-D316 HydrophobicContact CD1-CB 4Å; D316-W318 VanDerWaalsContact C-N 3.31Å; D316-W318 PolarHBondContact O-N 3.45Å; D316-W318 PolarHBondContact OD1-N 3.13Å; D316-N319 HydrophobicContact CB-CB 4Å; D316-N319 WeakPolarHBondContact O-CB 3.31Å; D316-N319 PolarHBondContact O-N 3.11Å; D316-N319 VanDerWaalsContact O-N 3.1Å; D316-N319 PolarHBondContact OD1-N 3.02Å; D316-E320 PolarHBondContact O-N 3.36Å; D316-R354 IonicContact OD1-NH1 3.81Å; D316-R354 PolarHBondContact OD1-NH1 3.39Å; D316-R354 IonicContact OD2-CZ 3.94Å; D316-R354 IonicContact OD2-NH1 3.22Å; D316-R354 PolarHBondContact OD2-NH1 2.74Å; D316-R354 IonicContact OD2-NH2 3.75Å; D316-R354 PolarHBondContact OD2-NH2 3.18Å; D316-Y359 HydrophobicContact CB-CD1 3.93Å; D316-Y359 HydrophobicContact CB-CE1 3.83Å
317	V	98.7	Very high	95.8	Very high	0 Å²	0	59.8 Å²	59.8	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-65	-34.1	-172	176.4	0	0	0	0	112	C321 M358 V360 P367 F370 F395	V317-C321 VanDerWaalsContact O-CB 3.24Å; V317-C321 WeakPolarHBondContact O-CB 3.44Å; V317-C321 PolarHBondContact O-N 2.99Å; V317-C321 PolarHBondContact O-SG 2.94Å; V317-M358 HydrophobicContact CB-CB 4.12Å; V317-M358 HydrophobicContact CB-CG 4.21Å; V317-M358 WeakPolarHBondContact CB-O 3.26Å; V317-M358 HydrophobicContact CG1-SD 4.46Å; V317-M358 HydrophobicContact CG2-CB 4.12Å; V317-M358 HydrophobicContact CG2-CG 3.75Å; V317-M358 WeakPolarHBondContact CG2-O 3.35Å; V317-M358 HydrophobicContact CG2-SD 4.31Å; V317-M358 PolarHBondContact N-O 3.02Å; V317-V360 HydrophobicContact CG2-CB 4.28Å; V317-V360 HydrophobicContact CG2-CG1 3.96Å; V317-P367 HydrophobicContact CB-CB 4.38Å; V317-P367 HydrophobicContact CG1-CB 3.75Å; V317-P367 HydrophobicContact CG2-CB 4.21Å; V317-F370 HydrophobicContact CB-CD2 4.22Å; V317-F370 HydrophobicContact CG1-CB 4.3Å; V317-F370 HydrophobicContact CG1-CD2 3.69Å; V317-F370 HydrophobicContact CG1-CG 4.42Å; V317-F395 HydrophobicContact CG1-CE1 4.45Å; V317-F395 HydrophobicContact CG1-CZ 4.3Å; V317-F395 HydrophobicContact CG2-CE1 3.73Å; V317-F395 HydrophobicContact CG2-CZ 3.79Å
318	W	98.5	Very high	95.9	Very high	10 Å²	10	61.4 Å²	61.4	4%	0.038	34%	0.344	C	S	.	.	H	α-helix	trans	-68.4	-38.9	174.9	172.4	80.9	0	0	0	111	D316 C323 R324 R328 F370	D316-W318 VanDerWaalsContact C-N 3.31Å; D316-W318 PolarHBondContact O-N 3.45Å; D316-W318 PolarHBondContact OD1-N 3.13Å; W318-C323 HydrophobicContact CH2-CB 3.74Å; W318-C323 VanDerWaalsContact CZ2-CA 3.49Å; W318-C323 HydrophobicContact CZ2-CB 3.99Å; W318-C323 WeakPolarHBondContact CZ2-O 3.39Å; W318-C323 HydrophobicContact CZ3-CB 4.11Å; W318-C323 PolarHBondContact O-N 2.89Å; W318-R324 PolarHBondContact NE1-O 2.92Å; W318-R328 HydrophobicContact CH2-CB 4.47Å; W318-R328 HydrophobicContact CH2-CG 3.97Å; W318-R328 HydrophobicContact CZ2-CB 3.7Å; W318-R328 HydrophobicContact CZ2-CG 3.68Å; W318-F370 HydrophobicContact CB-CD1 3.96Å; W318-F370 HydrophobicContact CB-CD2 4.48Å; W318-F370 HydrophobicContact CB-CE1 3.88Å; W318-F370 HydrophobicContact CB-CE2 4.38Å; W318-F370 HydrophobicContact CB-CG 4.25Å; W318-F370 HydrophobicContact CB-CZ 4.07Å; W318-F370 AromaticContact CD1-CD1 3.67Å; W318-F370 AromaticContact CD1-CE1 3.74Å; W318-F370 HydrophobicContact CG-CD1 4.22Å; W318-F370 HydrophobicContact CG-CE1 4.16Å
319	N	97.1	Very high	96	Very high	66 Å²	66	59.8 Å²	59.8	35%	0.353	32%	0.317	S	S	.	.	H	α-helix	trans	-63.9	-49.1	175.4	-71.2	-14.8	0	0	0	111.3	D316 C321 G322 C323	D316-N319 HydrophobicContact CB-CB 4Å; D316-N319 WeakPolarHBondContact O-CB 3.31Å; D316-N319 PolarHBondContact O-N 3.11Å; D316-N319 VanDerWaalsContact O-N 3.1Å; D316-N319 PolarHBondContact OD1-N 3.02Å; N319-C321 VanDerWaalsContact C-N 3.27Å; N319-C321 PolarHBondContact O-N 3.23Å; N319-G322 PolarHBondContact O-N 2.69Å; N319-G322 VanDerWaalsContact O-N 3.12Å; N319-C323 VanDerWaalsContact CA-SG 3.51Å; N319-C323 PolarHBondContact O-SG 3.26Å
320	E	97.2	Very high	96.1	Very high	97 Å²	97	58.7 Å²	58.7	45%	0.453	31%	0.306	S	S	.	.	H	α-helix	trans	-65.3	-31.5	-176.9	-161.4	66.2	-148.2	0	0	112	H315 D316 G322 P367	H315-E320 IonicContact CE1-OE2 3.22Å; H315-E320 IonicContact CG-OE2 3.28Å; H315-E320 IonicContact ND1-OE2 2.66Å; H315-E320 PolarHBondContact ND1-OE2 3.46Å; D316-E320 PolarHBondContact O-N 3.36Å; E320-G322 PolarHBondContact O-N 2.83Å; E320-P367 HydrophobicContact CB-CG 3.79Å; E320-P367 HydrophobicContact CG-CG 3.5Å; E320-P367 VanDerWaalsContact CG-CG 3.5Å
321	C	96.4	Very high	96.2	Very high	24 Å²	24	56.2 Å²	56.2	16%	0.162	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.1	24.2	175	-65	0	0	0	0	113.6	V317 N319 D369 F370	V317-C321 VanDerWaalsContact O-CB 3.24Å; V317-C321 WeakPolarHBondContact O-CB 3.44Å; V317-C321 PolarHBondContact O-N 2.99Å; V317-C321 PolarHBondContact O-SG 2.94Å; N319-C321 VanDerWaalsContact C-N 3.27Å; N319-C321 PolarHBondContact O-N 3.23Å; C321-D369 VanDerWaalsContact SG-C 3.53Å; C321-D369 PolarHBondContact SG-N 3Å; C321-F370 HydrophobicContact CB-CB 3.79Å
322	G	93.7	Very high	96.2	Very high	56 Å²	56	54.7 Å²	54.7	58%	0.577	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	94.5	14	167.1	0	0	0	0	0	116.4	N319 E320 R324	N319-G322 PolarHBondContact O-N 2.69Å; N319-G322 VanDerWaalsContact O-N 3.12Å; E320-G322 PolarHBondContact O-N 2.83Å; G322-R324 PolarHBondContact O-N 2.74Å; G322-R324 VanDerWaalsContact O-N 3.11Å
323	C	95.7	Very high	96.2	Very high	58 Å²	58	43.8 Å²	43.8	39%	0.392	24%	0.239	S	C	.	.			trans	54.2	34.8	172.1	-58.2	0	0	0	0	114.6	W318 N319 T325	W318-C323 HydrophobicContact CH2-CB 3.74Å; W318-C323 VanDerWaalsContact CZ2-CA 3.49Å; W318-C323 HydrophobicContact CZ2-CB 3.99Å; W318-C323 WeakPolarHBondContact CZ2-O 3.39Å; W318-C323 HydrophobicContact CZ3-CB 4.11Å; W318-C323 PolarHBondContact O-N 2.89Å; N319-C323 VanDerWaalsContact CA-SG 3.51Å; N319-C323 PolarHBondContact O-SG 3.26Å; C323-T325 PolarHBondContact O-N 3.1Å; C323-T325 VanDerWaalsContact O-N 3.13Å
324	R	92.6	Very high	96	Very high	90 Å²	90	46.3 Å²	46.3	34%	0.34	25%	0.246	S	C	.	.			trans	-57.2	117.4	-175.1	-74.9	-172.7	-67.9	-170.9	-9.6	112	W318 G322 E326 I327 R328 D369 F370	W318-R324 PolarHBondContact NE1-O 2.92Å; G322-R324 PolarHBondContact O-N 2.74Å; G322-R324 VanDerWaalsContact O-N 3.11Å; R324-E326 VanDerWaalsContact C-N 3.34Å; R324-E326 WeakPolarHBondContact CD-OE1 3.19Å; R324-E326 PolarHBondContact O-N 2.99Å; R324-I327 HydrophobicContact CB-CD1 3.85Å; R324-I327 HydrophobicContact CB-CG1 3.6Å; R324-I327 WeakPolarHBondContact O-CG1 3.24Å; R324-I327 PolarHBondContact O-N 3.16Å; R324-R328 PolarHBondContact O-N 3.38Å; R324-D369 IonicContact CZ-OD1 3.83Å; R324-D369 IonicContact NH2-OD1 3.81Å; R324-D369 PolarHBondContact NH2-OD1 3.19Å; R324-F370 PolarHBondContact NH2-O 2.85Å
325	T	92.7	Very high	95.8	Very high	113 Å²	113	54.5 Å²	54.5	69%	0.693	28%	0.276	S	S	*	.	G	3₁₀ helix	trans	-65.7	-35.1	-171.4	58.3	0	0	0	0	113.3	C323 I327 R328	C323-T325 PolarHBondContact O-N 3.1Å; C323-T325 VanDerWaalsContact O-N 3.13Å; T325-I327 PolarHBondContact O-N 3.14Å; T325-R328 WeakPolarHBondContact O-CB 3.41Å; T325-R328 PolarHBondContact O-N 2.93Å
326	E	90.9	Very high	95.7	Very high	110 Å²	110	50.7 Å²	50.7	51%	0.514	26%	0.258	S	S	.	.	G	3₁₀ helix	trans	-66.5	-19.8	-177.7	64.6	-83.7	-165.3	0	0	113.7	R324	R324-E326 VanDerWaalsContact C-N 3.34Å; R324-E326 WeakPolarHBondContact CD-OE1 3.19Å; R324-E326 PolarHBondContact O-N 2.99Å
327	I	94.5	Very high	95.4	Very high	24 Å²	24	53.2 Å²	53.2	12%	0.123	27%	0.27	C	S	.	.	G	3₁₀ helix	trans	-119.2	14.3	178.1	58.4	171.4	0	0	0	112.8	R324 T325 F370 L372	R324-I327 HydrophobicContact CB-CD1 3.85Å; R324-I327 HydrophobicContact CB-CG1 3.6Å; R324-I327 WeakPolarHBondContact O-CG1 3.24Å; R324-I327 PolarHBondContact O-N 3.16Å; T325-I327 PolarHBondContact O-N 3.14Å; I327-F370 HydrophobicContact CD1-CD1 3.94Å; I327-F370 WeakPolarHBondContact CD1-O 3.35Å; I327-L372 HydrophobicContact CB-CD1 4.09Å; I327-L372 HydrophobicContact CB-CG 3.88Å; I327-L372 HydrophobicContact CG2-CD1 4.08Å; I327-L372 HydrophobicContact CG2-CG 3.9Å
328	R	96.2	Very high	95.3	Very high	87 Å²	87	53.5 Å²	53.5	33%	0.328	27%	0.272	S	S	.	.			trans	-66	-49.8	-178.5	-178.4	-169.7	-178.4	114	-1.1	112.1	D301 W318 R324 T325 R354	D301-R328 IonicContact OD2-CZ 3.5Å; D301-R328 IonicContact OD2-NH2 3.69Å; D301-R328 PolarHBondContact OD2-NH2 3.23Å; W318-R328 HydrophobicContact CH2-CB 4.47Å; W318-R328 HydrophobicContact CH2-CG 3.97Å; W318-R328 HydrophobicContact CZ2-CB 3.7Å; W318-R328 HydrophobicContact CZ2-CG 3.68Å; R324-R328 PolarHBondContact O-N 3.38Å; T325-R328 WeakPolarHBondContact O-CB 3.41Å; T325-R328 PolarHBondContact O-N 2.93Å; R328-R354 VanDerWaalsContact O-CB 3.26Å; R328-R354 WeakPolarHBondContact O-CB 3.35Å; R328-R354 VanDerWaalsContact O-CD 3.22Å; R328-R354 WeakPolarHBondContact O-CD 3.36Å; R328-R354 WeakPolarHBondContact O-CG 3.43Å
329	N	96.8	Very high	95.1	Very high	42 Å²	42	53 Å²	53	23%	0.225	27%	0.27	C	S	.	.			trans	-90.4	123.9	-170.4	-63.6	-27.8	0	0	0	109.9	D332 T352	N329-D332 HydrophobicContact CB-CB 4.39Å; N329-T352 VanDerWaalsContact ND2-CB 3.34Å; N329-T352 WeakPolarHBondContact ND2-CB 3.42Å; N329-T352 PolarHBondContact ND2-OG1 3.44Å
330	T	98.4	Very high	94.9	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	27%	0.273	C	S	.	.	S	Bend	trans	-100	-24	-177.7	64.5	0	0	0	0	111.1	F353 Y355 D356 L372 W389 I391	T330-F353 PolarHBondContact N-O 3.11Å; T330-Y355 PolarHBondContact OG1-N 3.21Å; T330-D356 WeakPolarHBondContact CB-OD2 3.36Å; T330-D356 HydrophobicContact CG2-CB 3.96Å; T330-D356 WeakPolarHBondContact OG1-CB 3.19Å; T330-D356 PolarHBondContact OG1-N 3.07Å; T330-D356 PolarHBondContact OG1-OD2 3.16Å; T330-L372 HydrophobicContact CG2-CD2 4.21Å; T330-W389 PolarHBondContact O-N 2.93Å; T330-I391 HydrophobicContact CG2-CG2 3.49Å; T330-I391 VanDerWaalsContact CG2-CG2 3.49Å
331	W	98.2	Very high	94.5	Very high	10 Å²	10	56.3 Å²	56.3	4%	0.038	27%	0.273	C	S	.	.	B	Isolated β-bridge	trans	-116	107	167.2	-167	91.5	0	0	0	109.2	P333 A339 Q342 F343 M351 F353 Y355 D387 H388	W331-P333 HydrophobicContact CE3-CG 4.19Å; W331-P333 HydrophobicContact CH2-CB 4.11Å; W331-P333 HydrophobicContact CH2-CG 3.97Å; W331-P333 HydrophobicContact CZ3-CB 4.15Å; W331-P333 VanDerWaalsContact CZ3-CD 3.42Å; W331-P333 HydrophobicContact CZ3-CG 3.55Å; W331-A339 HydrophobicContact CD2-CB 4.21Å; W331-A339 HydrophobicContact CH2-CB 4.38Å; W331-A339 HydrophobicContact CZ2-CB 3.65Å; W331-Q342 VanDerWaalsContact CZ2-OE1 3.28Å; W331-F343 AromaticContact CH2-CE2 3.52Å; W331-F343 HydrophobicContact CH2-CE2 3.52Å; W331-F343 AromaticContact CH2-CZ 3.73Å; W331-F343 HydrophobicContact CH2-CZ 3.73Å; W331-F343 HydrophobicContact CZ2-CE2 4.48Å; W331-F343 HydrophobicContact CZ3-CE2 4.13Å; W331-F343 HydrophobicContact CZ3-CZ 4.15Å; W331-M351 WeakPolarHBondContact CZ3-O 3.28Å; W331-F353 AromaticContact CE3-CD2 3.84Å; W331-F353 HydrophobicContact CE3-CD2 3.84Å; W331-F353 HydrophobicContact CE3-CE2 4.5Å; W331-F353 HydrophobicContact CZ3-CD2 4.09Å; W331-F353 HydrophobicContact CZ3-CE2 4.3Å; W331-F353 PolarHBondContact N-O 3.42Å; W331-F353 PolarHBondContact O-N 3.11Å; W331-Y355 HydrophobicContact CB-CD2 3.59Å; W331-Y355 HydrophobicContact CB-CE2 4.04Å; W331-Y355 HydrophobicContact CB-CG 4.44Å; W331-Y355 HydrophobicContact CD2-CE2 4.13Å; W331-Y355 HydrophobicContact CE3-CE2 4.29Å; W331-Y355 AromaticContact CG-CD2 3.94Å; W331-Y355 HydrophobicContact CG-CD2 3.94Å; W331-Y355 HydrophobicContact CG-CE2 4.02Å; W331-D387 PolarHBondContact NE1-OD2 3.15Å; W331-H388 AromaticContact CD1-CD2 3.56Å; W331-H388 AromaticContact CD1-CE1 3.75Å; W331-H388 AromaticContact CD1-CG 3.95Å; W331-H388 AromaticContact CD1-NE2 3.37Å
332	D	96.4	Very high	93.9	Very high	11 Å²	11	59.7 Å²	59.7	6%	0.059	29%	0.286	C	S	.	.			trans	-133.8	96.6	-171.5	-178.2	-12.9	0	0	0	110.7	N329 L334 R335 N336 T352	N329-D332 HydrophobicContact CB-CB 4.39Å; D332-L334 PolarHBondContact O-N 3.44Å; D332-L334 WeakPolarHBondContact OD1-CA 3.11Å; D332-L334 WeakPolarHBondContact OD1-CB 3.03Å; D332-L334 PolarHBondContact OD1-N 3.12Å; D332-R335 PolarHBondContact O-N 2.89Å; D332-R335 PolarHBondContact OD1-N 3.13Å; D332-R335 VanDerWaalsContact OD2-CD 3.29Å; D332-R335 WeakPolarHBondContact OD2-CD 3.12Å; D332-R335 WeakPolarHBondContact OD2-CG 3.38Å; D332-R335 IonicContact OD2-NE 2.72Å; D332-N336 WeakPolarHBondContact O-CA 3.48Å; D332-N336 WeakPolarHBondContact O-CB 3.28Å; D332-N336 PolarHBondContact O-N 3.35Å; D332-T352 HydrophobicContact CB-CG2 4.3Å; D332-T352 VanDerWaalsContact OD1-CG2 3.24Å; D332-T352 WeakPolarHBondContact OD1-CG2 3.45Å
333	P	95.3	Very high	93.6	Very high	0 Å²	0	59.6 Å²	59.6	0%	0	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-4.5	-179.4	33.7	-40	0	0	0	113.6	W331 A339 R340 F343 P347 M351	W331-P333 HydrophobicContact CE3-CG 4.19Å; W331-P333 HydrophobicContact CH2-CB 4.11Å; W331-P333 HydrophobicContact CH2-CG 3.97Å; W331-P333 HydrophobicContact CZ3-CB 4.15Å; W331-P333 VanDerWaalsContact CZ3-CD 3.42Å; W331-P333 HydrophobicContact CZ3-CG 3.55Å; P333-A339 HydrophobicContact CB-CB 3.88Å; P333-R340 WeakPolarHBondContact O-CB 3.3Å; P333-F343 HydrophobicContact CB-CD2 3.91Å; P333-F343 HydrophobicContact CB-CE2 3.49Å; P333-F343 VanDerWaalsContact CB-CE2 3.49Å; P333-F343 HydrophobicContact CG-CD2 4.36Å; P333-F343 HydrophobicContact CG-CE2 3.59Å; P333-F343 HydrophobicContact CG-CZ 4.22Å; P333-P347 HydrophobicContact CB-CB 4.15Å; P333-P347 HydrophobicContact CB-CG 3.72Å; P333-P347 HydrophobicContact CG-CB 3.78Å; P333-P347 HydrophobicContact CG-CG 3.95Å; P333-M351 VanDerWaalsContact CD-O 3.28Å; P333-M351 WeakPolarHBondContact CD-O 3.45Å; P333-M351 VanDerWaalsContact CG-O 3.28Å; P333-M351 WeakPolarHBondContact CG-O 3.35Å
334	L	93.2	Very high	93	Very high	80 Å²	80	66.6 Å²	66.6	42%	0.419	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-35.9	169.2	-60.7	179.5	0	0	0	111.4	D332 P347 A349 T352	D332-L334 PolarHBondContact O-N 3.44Å; D332-L334 WeakPolarHBondContact OD1-CA 3.11Å; D332-L334 WeakPolarHBondContact OD1-CB 3.03Å; D332-L334 PolarHBondContact OD1-N 3.12Å; L334-P347 HydrophobicContact CD2-CB 4.11Å; L334-P347 HydrophobicContact CD2-CG 4.47Å; L334-P347 VanDerWaalsContact CD2-O 3.22Å; L334-P347 WeakPolarHBondContact CD2-O 3.2Å; L334-A349 HydrophobicContact CD1-CB 4.2Å; L334-T352 HydrophobicContact CD1-CG2 4.17Å; L334-T352 HydrophobicContact CG-CG2 4.18Å
335	R	93.4	Very high	92.6	Very high	180 Å²	180	64.3 Å²	64.3	68%	0.679	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.4	-26.2	-175.2	-62.1	-177.1	178.2	-175.5	-1.6	113.5	D332 W389	D332-R335 PolarHBondContact O-N 2.89Å; D332-R335 PolarHBondContact OD1-N 3.13Å; D332-R335 VanDerWaalsContact OD2-CD 3.29Å; D332-R335 WeakPolarHBondContact OD2-CD 3.12Å; D332-R335 WeakPolarHBondContact OD2-CG 3.38Å; D332-R335 IonicContact OD2-NE 2.72Å; R335-W389 HydrophobicContact CB-CZ2 4.29Å
336	N	95.8	Very high	92.3	Very high	1 Å²	1	65.4 Å²	65.4	1%	0.005	29%	0.293	C	S	.	.			trans	-100.9	107.7	177.2	-168.9	-39.4	0	0	0	110.1	D332 N338 A339 R340 L384 S386 D387 W389	D332-N336 WeakPolarHBondContact O-CA 3.48Å; D332-N336 WeakPolarHBondContact O-CB 3.28Å; D332-N336 PolarHBondContact O-N 3.35Å; N336-N338 VanDerWaalsContact C-N 3.25Å; N336-N338 PolarHBondContact O-N 2.83Å; N336-N338 WeakPolarHBondContact OD1-CA 3.04Å; N336-N338 VanDerWaalsContact OD1-CB 3.28Å; N336-N338 WeakPolarHBondContact OD1-CB 3.2Å; N336-N338 PolarHBondContact OD1-N 2.82Å; N336-A339 HydrophobicContact CB-CB 4.07Å; N336-A339 PolarHBondContact O-N 3.01Å; N336-A339 PolarHBondContact OD1-N 2.69Å; N336-R340 PolarHBondContact O-N 3.45Å; N336-L384 HydrophobicContact CB-CD1 4.01Å; N336-L384 VanDerWaalsContact CG-CD1 3.41Å; N336-L384 VanDerWaalsContact OD1-CD1 3.3Å; N336-L384 WeakPolarHBondContact OD1-CD1 3.46Å; N336-S386 PolarHBondContact ND2-O 2.91Å; N336-D387 WeakPolarHBondContact ND2-CA 3.32Å; N336-D387 PolarHBondContact ND2-O 3.1Å; N336-D387 VanDerWaalsContact ND2-O 3.09Å; N336-W389 HydrophobicContact CB-CH2 3.91Å; N336-W389 HydrophobicContact CB-CZ2 3.73Å
337	Q	92.7	Very high	92.1	Very high	58 Å²	58	60.6 Å²	60.6	27%	0.271	27%	0.271	S	S	.	.	H	α-helix	trans	-68.3	-20.3	179.7	53.1	163.9	69.1	0	0	114.2	R341 S382 L384	Q337-R341 WeakPolarHBondContact O-CG 3.47Å; Q337-S382 PolarHBondContact NE2-O 3.39Å; Q337-S382 PolarHBondContact OE1-O 3.16Å; Q337-L384 HydrophobicContact CG-CD1 4.18Å
338	N	95.3	Very high	91.9	Very high	7 Å²	7	67.7 Å²	67.7	4%	0.037	30%	0.296	C	S	.	.	H	α-helix	trans	-71.3	-46.3	173.3	-61.3	4.9	0	0	0	109.1	N336 R340 R341 C383 L384 S386 D387	N336-N338 VanDerWaalsContact C-N 3.25Å; N336-N338 PolarHBondContact O-N 2.83Å; N336-N338 WeakPolarHBondContact OD1-CA 3.04Å; N336-N338 VanDerWaalsContact OD1-CB 3.28Å; N336-N338 WeakPolarHBondContact OD1-CB 3.2Å; N336-N338 PolarHBondContact OD1-N 2.82Å; N338-R340 VanDerWaalsContact C-N 3.32Å; N338-R340 PolarHBondContact O-N 3.29Å; N338-R341 WeakPolarHBondContact O-CB 3.49Å; N338-R341 PolarHBondContact O-N 3.26Å; N338-C383 WeakPolarHBondContact OD1-CB 3.48Å; N338-L384 PolarHBondContact ND2-O 3.33Å; N338-L384 PolarHBondContact OD1-N 3.48Å; N338-S386 PolarHBondContact ND2-O 2.91Å; N338-D387 HydrophobicContact CB-CB 3.84Å
339	A	94.4	Very high	91.3	Very high	0 Å²	0	66.9 Å²	66.9	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-61	-40.4	173.9	0	0	0	0	0	111.8	W331 P333 N336 R341 Q342 D387	W331-A339 HydrophobicContact CD2-CB 4.21Å; W331-A339 HydrophobicContact CH2-CB 4.38Å; W331-A339 HydrophobicContact CZ2-CB 3.65Å; P333-A339 HydrophobicContact CB-CB 3.88Å; N336-A339 HydrophobicContact CB-CB 4.07Å; N336-A339 PolarHBondContact O-N 3.01Å; N336-A339 PolarHBondContact OD1-N 2.69Å; A339-R341 PolarHBondContact O-N 3.27Å; A339-R341 VanDerWaalsContact O-N 3.11Å; A339-Q342 WeakPolarHBondContact O-CB 3.46Å; A339-Q342 WeakPolarHBondContact O-CG 3.11Å; A339-Q342 PolarHBondContact O-N 3.16Å; A339-Q342 VanDerWaalsContact O-N 3.1Å; A339-D387 HydrophobicContact CB-CB 3.92Å
340	R	92.6	Very high	90.8	Very high	111 Å²	111	71 Å²	71	42%	0.419	33%	0.326	S	S	.	.	H	α-helix	trans	-56.6	-28.9	178.8	-169.1	169	171.9	178	-5.1	113.9	P333 N336 N338 Q342 F343 P347	P333-R340 WeakPolarHBondContact O-CB 3.3Å; N336-R340 PolarHBondContact O-N 3.45Å; N338-R340 VanDerWaalsContact C-N 3.32Å; N338-R340 PolarHBondContact O-N 3.29Å; R340-Q342 PolarHBondContact O-N 3.49Å; R340-Q342 VanDerWaalsContact O-N 3.1Å; R340-F343 PolarHBondContact O-N 3.36Å; R340-P347 HydrophobicContact CG-CG 4.22Å
341	R	89.1	Confident	90.3	Very high	121 Å²	121	73.4 Å²	73.4	46%	0.457	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-17.2	179.7	-68.5	170.1	-176.1	-176.6	-1.8	113.4	Q337 N338 A339 F343	Q337-R341 WeakPolarHBondContact O-CG 3.47Å; N338-R341 WeakPolarHBondContact O-CB 3.49Å; N338-R341 PolarHBondContact O-N 3.26Å; A339-R341 PolarHBondContact O-N 3.27Å; A339-R341 VanDerWaalsContact O-N 3.11Å; R341-F343 PolarHBondContact O-N 2.98Å
342	Q	84.9	Confident	90.2	Very high	94 Å²	94	74 Å²	74	44%	0.439	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-6.4	175.1	-58.4	-174.7	8	0	0	113.1	W331 A339 R340 D387	W331-Q342 VanDerWaalsContact CZ2-OE1 3.28Å; A339-Q342 WeakPolarHBondContact O-CB 3.46Å; A339-Q342 WeakPolarHBondContact O-CG 3.11Å; A339-Q342 PolarHBondContact O-N 3.16Å; A339-Q342 VanDerWaalsContact O-N 3.1Å; R340-Q342 PolarHBondContact O-N 3.49Å; R340-Q342 VanDerWaalsContact O-N 3.1Å; Q342-D387 PolarHBondContact NE2-OD2 3.08Å
343	F	87.5	Confident	90.2	Very high	55 Å²	55	76 Å²	76	24%	0.241	35%	0.351	C	S	.	.			trans	-116.7	132.2	-177.5	-59.8	-80.3	0	0	0	112.4	W331 P333 R340 R341 G345 P347 M351	W331-F343 AromaticContact CH2-CE2 3.52Å; W331-F343 HydrophobicContact CH2-CE2 3.52Å; W331-F343 AromaticContact CH2-CZ 3.73Å; W331-F343 HydrophobicContact CH2-CZ 3.73Å; W331-F343 HydrophobicContact CZ2-CE2 4.48Å; W331-F343 HydrophobicContact CZ3-CE2 4.13Å; W331-F343 HydrophobicContact CZ3-CZ 4.15Å; P333-F343 HydrophobicContact CB-CD2 3.91Å; P333-F343 HydrophobicContact CB-CE2 3.49Å; P333-F343 VanDerWaalsContact CB-CE2 3.49Å; P333-F343 HydrophobicContact CG-CD2 4.36Å; P333-F343 HydrophobicContact CG-CE2 3.59Å; P333-F343 HydrophobicContact CG-CZ 4.22Å; R340-F343 PolarHBondContact O-N 3.36Å; R341-F343 PolarHBondContact O-N 2.98Å; F343-G345 PolarHBondContact O-N 3.14Å; F343-P347 HydrophobicContact CB-CG 4.26Å; F343-P347 HydrophobicContact CD2-CB 4.13Å; F343-P347 HydrophobicContact CD2-CG 3.62Å; F343-P347 HydrophobicContact CE2-CB 4.28Å; F343-P347 HydrophobicContact CE2-CG 4.15Å; F343-P347 HydrophobicContact CG-CB 4.31Å; F343-P347 HydrophobicContact CG-CG 3.95Å; F343-M351 HydrophobicContact CD1-CE 4.01Å; F343-M351 HydrophobicContact CD1-SD 4.5Å; F343-M351 HydrophobicContact CE1-CE 3.24Å; F343-M351 HydrophobicContact CE1-SD 4.04Å; F343-M351 HydrophobicContact CZ-CB 4.48Å; F343-M351 HydrophobicContact CZ-CE 3.99Å
344	R	81.9	Confident	90.3	Very high	205 Å²	205	76.8 Å²	76.8	77%	0.774	35%	0.354	S	S	*	.	S	Bend	trans	-77.5	60.7	164	-65.2	-177.1	175.1	-173.1	-1.3	110.1	E34	E34-R344 IonicContact OE1-CZ 2.69Å; E34-R344 IonicContact OE1-NE 3.47Å; E34-R344 PolarHBondContact OE1-NE 3.44Å; E34-R344 IonicContact OE1-NH2 3.17Å; E34-R344 PolarHBondContact OE1-NH2 3.08Å; E34-R344 VanDerWaalsContact OE1-NH2 3.16Å; E34-R344 IonicContact OE2-CZ 3.55Å; E34-R344 IonicContact OE2-NE 2.81Å; E34-R344 IonicContact OE2-NH2 3.75Å; E34-R344 PolarHBondContact OE2-NH2 3.37Å
345	G	85.1	Confident	90.6	Very high	41 Å²	41	74 Å²	74	42%	0.423	34%	0.338	S	S	.	.	S	Bend	trans	153.4	-166.3	179.8	0	0	0	0	0	114.8	F343 P347	F343-G345 PolarHBondContact O-N 3.14Å; G345-P347 WeakPolarHBondContact O-CD 3.3Å
346	I	85.7	Confident	90.8	Very high	137 Å²	137	65.4 Å²	65.4	70%	0.703	31%	0.305	S	S	*	.	P	Polyproline II helix	trans	-82.9	117.7	171.8	-58.9	173.3	0	0	0	107.5
347	P	87.9	Confident	91	Very high	8 Å²	8	65.5 Å²	65.5	5%	0.052	31%	0.306	C	S	.	.	P	Polyproline II helix	trans	-58.7	152.8	175.2	-17	28.1	0	0	0	110.7	P333 L334 R340 F343 G345	P333-P347 HydrophobicContact CB-CB 4.15Å; P333-P347 HydrophobicContact CB-CG 3.72Å; P333-P347 HydrophobicContact CG-CB 3.78Å; P333-P347 HydrophobicContact CG-CG 3.95Å; L334-P347 HydrophobicContact CD2-CB 4.11Å; L334-P347 HydrophobicContact CD2-CG 4.47Å; L334-P347 VanDerWaalsContact CD2-O 3.22Å; L334-P347 WeakPolarHBondContact CD2-O 3.2Å; R340-P347 HydrophobicContact CG-CG 4.22Å; F343-P347 HydrophobicContact CB-CG 4.26Å; F343-P347 HydrophobicContact CD2-CB 4.13Å; F343-P347 HydrophobicContact CD2-CG 3.62Å; F343-P347 HydrophobicContact CE2-CB 4.28Å; F343-P347 HydrophobicContact CE2-CG 4.15Å; F343-P347 HydrophobicContact CG-CB 4.31Å; F343-P347 HydrophobicContact CG-CG 3.95Å; G345-P347 WeakPolarHBondContact O-CD 3.3Å
348	R	88.9	Confident	91.3	Very high	174 Å²	174	62.8 Å²	62.8	66%	0.657	29%	0.293	S	S	*	.	P	Polyproline II helix	trans	-86.9	151.9	172.8	-70	-173.6	-98.1	-170.8	-10.8	109.7	H350 M351	R348-H350 VanDerWaalsContact CB-CE1 3.41Å; R348-H350 WeakPolarHBondContact CB-CE1 3.45Å; R348-H350 WeakPolarHBondContact CB-ND1 3.29Å; R348-H350 PolarHBondContact O-N 3.26Å; R348-H350 VanDerWaalsContact O-N 3.09Å; R348-M351 HydrophobicContact CB-CG 4.14Å; R348-M351 HydrophobicContact CB-SD 4.15Å; R348-M351 WeakPolarHBondContact O-CA 3.43Å; R348-M351 VanDerWaalsContact O-CB 3.26Å; R348-M351 WeakPolarHBondContact O-CB 3.42Å; R348-M351 WeakPolarHBondContact O-CG 3.37Å; R348-M351 PolarHBondContact O-N 3.05Å
349	A	83.9	Confident	91.4	Very high	70 Å²	70	62.5 Å²	62.5	58%	0.579	29%	0.291	S	S	*	.	G	3₁₀ helix	trans	-55.3	-31.6	-178	0	0	0	0	0	114.3	L334 M351 T352	L334-A349 HydrophobicContact CD1-CB 4.2Å; A349-M351 PolarHBondContact O-N 3.39Å; A349-T352 WeakPolarHBondContact O-CG2 3.46Å; A349-T352 PolarHBondContact O-N 2.96Å; A349-T352 PolarHBondContact O-OG1 3.4Å
350	H	85.7	Confident	91.6	Very high	127 Å²	127	62.7 Å²	62.7	59%	0.588	29%	0.293	S	S	*	.	G	3₁₀ helix	trans	-73.4	-4.1	175.9	72.4	-94.5	0	0	0	114.3	R348 T352	R348-H350 VanDerWaalsContact CB-CE1 3.41Å; R348-H350 WeakPolarHBondContact CB-CE1 3.45Å; R348-H350 WeakPolarHBondContact CB-ND1 3.29Å; R348-H350 PolarHBondContact O-N 3.26Å; R348-H350 VanDerWaalsContact O-N 3.09Å; H350-T352 VanDerWaalsContact C-N 3.25Å
351	M	89.6	Confident	91.9	Very high	52 Å²	52	58.1 Å²	58.1	26%	0.256	28%	0.276	S	S	.	.	G	3₁₀ helix	trans	-96	26.1	177	-49.7	-178.3	83	0	0	111.2	W331 P333 F343 R348 A349	W331-M351 WeakPolarHBondContact CZ3-O 3.28Å; P333-M351 VanDerWaalsContact CD-O 3.28Å; P333-M351 WeakPolarHBondContact CD-O 3.45Å; P333-M351 VanDerWaalsContact CG-O 3.28Å; P333-M351 WeakPolarHBondContact CG-O 3.35Å; F343-M351 HydrophobicContact CD1-CE 4.01Å; F343-M351 HydrophobicContact CD1-SD 4.5Å; F343-M351 HydrophobicContact CE1-CE 3.24Å; F343-M351 HydrophobicContact CE1-SD 4.04Å; F343-M351 HydrophobicContact CZ-CB 4.48Å; F343-M351 HydrophobicContact CZ-CE 3.99Å; R348-M351 HydrophobicContact CB-CG 4.14Å; R348-M351 HydrophobicContact CB-SD 4.15Å; R348-M351 WeakPolarHBondContact O-CA 3.43Å; R348-M351 VanDerWaalsContact O-CB 3.26Å; R348-M351 WeakPolarHBondContact O-CB 3.42Å; R348-M351 WeakPolarHBondContact O-CG 3.37Å; R348-M351 PolarHBondContact O-N 3.05Å; A349-M351 PolarHBondContact O-N 3.39Å
352	T	94.3	Very high	92.1	Very high	22 Å²	22	54.1 Å²	54.1	14%	0.135	27%	0.273	C	S	.	.			trans	-110.4	139.7	172.9	59.5	0	0	0	0	107.5	N329 D332 L334 A349 H350	N329-T352 VanDerWaalsContact ND2-CB 3.34Å; N329-T352 WeakPolarHBondContact ND2-CB 3.42Å; N329-T352 PolarHBondContact ND2-OG1 3.44Å; D332-T352 HydrophobicContact CB-CG2 4.3Å; D332-T352 VanDerWaalsContact OD1-CG2 3.24Å; D332-T352 WeakPolarHBondContact OD1-CG2 3.45Å; L334-T352 HydrophobicContact CD1-CG2 4.17Å; L334-T352 HydrophobicContact CG-CG2 4.18Å; A349-T352 WeakPolarHBondContact O-CG2 3.46Å; A349-T352 PolarHBondContact O-N 2.96Å; A349-T352 PolarHBondContact O-OG1 3.4Å; H350-T352 VanDerWaalsContact C-N 3.25Å
353	F	96.8	Very high	92.4	Very high	52 Å²	52	52.2 Å²	52.2	23%	0.228	27%	0.27	C	S	.	.	B	Isolated β-bridge	trans	-136.9	148.7	-169.4	-58.5	-78.6	0	0	0	112.5	T330 W331 Y355	T330-F353 PolarHBondContact N-O 3.11Å; W331-F353 AromaticContact CE3-CD2 3.84Å; W331-F353 HydrophobicContact CE3-CD2 3.84Å; W331-F353 HydrophobicContact CE3-CE2 4.5Å; W331-F353 HydrophobicContact CZ3-CD2 4.09Å; W331-F353 HydrophobicContact CZ3-CE2 4.3Å; W331-F353 PolarHBondContact N-O 3.42Å; W331-F353 PolarHBondContact O-N 3.11Å; F353-Y355 HydrophobicContact CB-CD1 3.49Å; F353-Y355 VanDerWaalsContact CB-CD1 3.49Å; F353-Y355 HydrophobicContact CB-CD2 4.03Å; F353-Y355 HydrophobicContact CB-CE1 3.3Å; F353-Y355 HydrophobicContact CB-CE2 3.86Å; F353-Y355 HydrophobicContact CB-CG 3.86Å; F353-Y355 AromaticContact CD1-CE1 3.9Å; F353-Y355 HydrophobicContact CD1-CE1 3.9Å; F353-Y355 AromaticContact CD2-CE1 3.96Å; F353-Y355 HydrophobicContact CD2-CE1 3.96Å; F353-Y355 AromaticContact CD2-CE2 3.92Å; F353-Y355 HydrophobicContact CD2-CE2 3.92Å; F353-Y355 AromaticContact CD2-CZ 3.41Å; F353-Y355 VanDerWaalsContact CD2-CZ 3.41Å; F353-Y355 WeakPolarHBondContact CD2-OH 3.48Å; F353-Y355 WeakPolarHBondContact CE2-OH 3.33Å; F353-Y355 HydrophobicContact CG-CD1 4.17Å; F353-Y355 AromaticContact CG-CE1 3.45Å; F353-Y355 HydrophobicContact CG-CE1 3.45Å; F353-Y355 VanDerWaalsContact CG-CE1 3.45Å; F353-Y355 HydrophobicContact CG-CE2 4.12Å; F353-Y355 AromaticContact CG-CZ 3.43Å; F353-Y355 VanDerWaalsContact CG-CZ 3.43Å; F353-Y355 PolarHBondContact O-N 3.09Å
354	R	97.9	Very high	92.6	Very high	18 Å²	18	50.8 Å²	50.8	7%	0.068	26%	0.263	C	S	.	.			trans	-98.1	70.5	168.2	-172.1	173	67.1	94.4	0.9	109	D301 D316 R328 R357	D301-R354 IonicContact OD1-NH2 2.82Å; D301-R354 PolarHBondContact OD1-NH2 2.95Å; D316-R354 IonicContact OD1-NH1 3.81Å; D316-R354 PolarHBondContact OD1-NH1 3.39Å; D316-R354 IonicContact OD2-CZ 3.94Å; D316-R354 IonicContact OD2-NH1 3.22Å; D316-R354 PolarHBondContact OD2-NH1 2.74Å; D316-R354 IonicContact OD2-NH2 3.75Å; D316-R354 PolarHBondContact OD2-NH2 3.18Å; R328-R354 VanDerWaalsContact O-CB 3.26Å; R328-R354 WeakPolarHBondContact O-CB 3.35Å; R328-R354 VanDerWaalsContact O-CD 3.22Å; R328-R354 WeakPolarHBondContact O-CD 3.36Å; R328-R354 WeakPolarHBondContact O-CG 3.43Å; R354-R357 HydrophobicContact CG-CG 4.28Å; R354-R357 VanDerWaalsContact NH2-CZ 3.32Å; R354-R357 VanDerWaalsContact NH2-NH1 3.16Å; R354-R357 PolarHBondContact O-NE 2.85Å; R354-R357 PolarHBondContact O-NH2 3.36Å
355	Y	98.7	Very high	93.3	Very high	20 Å²	20	41.9 Å²	41.9	8%	0.078	23%	0.23	C	C	.	.			trans	-75.2	-45.7	179.6	-69.5	-28.7	0	0	0	111.1	D296 L297 N298 R300 T330 W331 F353	D296-Y355 WeakPolarHBondContact OD1-CB 3.4Å; L297-Y355 WeakPolarHBondContact CA-O 3.13Å; L297-Y355 WeakPolarHBondContact CB-O 3.2Å; L297-Y355 PolarHBondContact N-O 2.68Å; N298-Y355 VanDerWaalsContact C-CD1 3.49Å; R300-Y355 VanDerWaalsContact NH1-CE1 3.33Å; R300-Y355 PolarHBondContact NH2-OH 2.94Å; T330-Y355 PolarHBondContact OG1-N 3.21Å; W331-Y355 HydrophobicContact CB-CD2 3.59Å; W331-Y355 HydrophobicContact CB-CE2 4.04Å; W331-Y355 HydrophobicContact CB-CG 4.44Å; W331-Y355 HydrophobicContact CD2-CE2 4.13Å; W331-Y355 HydrophobicContact CE3-CE2 4.29Å; W331-Y355 AromaticContact CG-CD2 3.94Å; W331-Y355 HydrophobicContact CG-CD2 3.94Å; W331-Y355 HydrophobicContact CG-CE2 4.02Å; F353-Y355 HydrophobicContact CB-CD1 3.49Å; F353-Y355 VanDerWaalsContact CB-CD1 3.49Å; F353-Y355 HydrophobicContact CB-CD2 4.03Å; F353-Y355 HydrophobicContact CB-CE1 3.3Å; F353-Y355 HydrophobicContact CB-CE2 3.86Å; F353-Y355 HydrophobicContact CB-CG 3.86Å; F353-Y355 AromaticContact CD1-CE1 3.9Å; F353-Y355 HydrophobicContact CD1-CE1 3.9Å; F353-Y355 AromaticContact CD2-CE1 3.96Å; F353-Y355 HydrophobicContact CD2-CE1 3.96Å; F353-Y355 AromaticContact CD2-CE2 3.92Å; F353-Y355 HydrophobicContact CD2-CE2 3.92Å; F353-Y355 AromaticContact CD2-CZ 3.41Å; F353-Y355 VanDerWaalsContact CD2-CZ 3.41Å; F353-Y355 WeakPolarHBondContact CD2-OH 3.48Å; F353-Y355 WeakPolarHBondContact CE2-OH 3.33Å; F353-Y355 HydrophobicContact CG-CD1 4.17Å; F353-Y355 AromaticContact CG-CE1 3.45Å; F353-Y355 HydrophobicContact CG-CE1 3.45Å; F353-Y355 VanDerWaalsContact CG-CE1 3.45Å; F353-Y355 HydrophobicContact CG-CE2 4.12Å; F353-Y355 AromaticContact CG-CZ 3.43Å; F353-Y355 VanDerWaalsContact CG-CZ 3.43Å; F353-Y355 PolarHBondContact O-N 3.09Å
356	D	98.9	Very high	93.7	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	124.2	177.9	-46.1	-103	0	0	0	109.1	G295 T330 H388 I391	G295-D356 VanDerWaalsContact O-CA 3.27Å; G295-D356 WeakPolarHBondContact O-CA 3.24Å; T330-D356 WeakPolarHBondContact CB-OD2 3.36Å; T330-D356 HydrophobicContact CG2-CB 3.96Å; T330-D356 WeakPolarHBondContact OG1-CB 3.19Å; T330-D356 PolarHBondContact OG1-N 3.07Å; T330-D356 PolarHBondContact OG1-OD2 3.16Å; D356-H388 IonicContact OD1-ND1 3.38Å; D356-H388 PolarHBondContact OD1-ND1 3.28Å; D356-H388 IonicContact OD2-CE1 2.77Å; D356-H388 IonicContact OD2-CG 3.54Å; D356-H388 IonicContact OD2-ND1 2.74Å; D356-H388 PolarHBondContact OD2-ND1 2.73Å; D356-I391 HydrophobicContact CB-CD1 4.02Å; D356-I391 HydrophobicContact CB-CG1 4.34Å; D356-I391 HydrophobicContact CB-CG2 4.14Å
357	R	98.8	Very high	94.3	Very high	4 Å²	4	39.6 Å²	39.6	2%	0.015	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	162.6	-179.7	-53.2	-174.7	-171	-163.2	-5.3	110.7	C294 G295 L297 L299 D301 R354 Y359 I391	C294-R357 VanDerWaalsContact CA-O 3.26Å; C294-R357 WeakPolarHBondContact CA-O 3.46Å; G295-R357 PolarHBondContact N-O 3.37Å; G295-R357 PolarHBondContact O-N 2.85Å; G295-R357 VanDerWaalsContact O-N 3.13Å; L297-R357 HydrophobicContact CD1-CB 3.8Å; L297-R357 HydrophobicContact CD1-CG 4.41Å; L297-R357 HydrophobicContact CG-CB 4.25Å; L299-R357 VanDerWaalsContact CB-CZ 3.47Å; L299-R357 PolarHBondContact O-NH2 3.31Å; D301-R357 IonicContact OD1-CZ 3.89Å; D301-R357 IonicContact OD1-NH1 3.33Å; D301-R357 IonicContact OD1-NH2 3.69Å; D301-R357 PolarHBondContact OD1-NH2 3.42Å; R354-R357 HydrophobicContact CG-CG 4.28Å; R354-R357 VanDerWaalsContact NH2-CZ 3.32Å; R354-R357 VanDerWaalsContact NH2-NH1 3.16Å; R354-R357 PolarHBondContact O-NE 2.85Å; R354-R357 PolarHBondContact O-NH2 3.36Å; R357-Y359 HydrophobicContact CB-CE2 4.49Å; R357-Y359 VanDerWaalsContact CD-OH 3.32Å; R357-Y359 WeakPolarHBondContact CD-OH 3.33Å; R357-I391 VanDerWaalsContact C-CD1 3.46Å
358	M	98.9	Very high	94.7	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	126.3	176.7	-175.3	173.4	-68.8	0	0	109	V124 I292 F293 C294 V317 F370 I391 F395	V124-M358 HydrophobicContact CB-CE 4.06Å; V124-M358 HydrophobicContact CB-SD 4.47Å; V124-M358 HydrophobicContact CG1-CE 3.84Å; V124-M358 WeakPolarHBondContact O-CE 3.26Å; I292-M358 HydrophobicContact CG2-CG 3.92Å; I292-M358 HydrophobicContact CG2-SD 4.29Å; F293-M358 CarbonylContact O-C 3.54Å; F293-M358 VanDerWaalsContact O-CA 3.32Å; F293-M358 WeakPolarHBondContact O-CA 3.21Å; C294-M358 HydrophobicContact CB-CB 3.97Å; C294-M358 HydrophobicContact CB-CE 3.64Å; C294-M358 HydrophobicContact CB-CG 3.87Å; V317-M358 HydrophobicContact CB-CB 4.12Å; V317-M358 HydrophobicContact CB-CG 4.21Å; V317-M358 WeakPolarHBondContact CB-O 3.26Å; V317-M358 HydrophobicContact CG1-SD 4.46Å; V317-M358 HydrophobicContact CG2-CB 4.12Å; V317-M358 HydrophobicContact CG2-CG 3.75Å; V317-M358 WeakPolarHBondContact CG2-O 3.35Å; V317-M358 HydrophobicContact CG2-SD 4.31Å; V317-M358 PolarHBondContact N-O 3.02Å; M358-F370 HydrophobicContact CB-CE2 4.38Å; M358-I391 HydrophobicContact CB-CD1 4.14Å; M358-F395 HydrophobicContact CG-CZ 4.13Å; M358-F395 HydrophobicContact SD-CE2 3.64Å; M358-F395 HydrophobicContact SD-CZ 3.44Å; M358-F395 WeakPolarHBondContact SD-CZ 3.32Å
359	Y	98.8	Very high	95.1	Very high	1 Å²	1	36.2 Å²	36.2	0%	0.004	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	145.3	176.3	-57.7	-63.7	0	0	0	110	L265 W269 I292 F293 L297 L299 L310 I314 H315 D316 R357	L265-Y359 HydrophobicContact CD1-CE2 4.05Å; W269-Y359 HydrophobicContact CZ2-CE1 4.39Å; W269-Y359 HydrophobicContact CZ2-CE2 4.07Å; W269-Y359 AromaticContact CZ2-CZ 3.95Å; W269-Y359 AromaticContact NE1-CD2 3.53Å; W269-Y359 AromaticContact NE1-CE2 3.7Å; W269-Y359 AromaticContact NE1-CG 3.94Å; I292-Y359 CarbonylContact C-O 3.59Å; I292-Y359 WeakPolarHBondContact CA-O 3.47Å; F293-Y359 AromaticContact CD1-CD2 3.72Å; F293-Y359 HydrophobicContact CD1-CD2 3.72Å; F293-Y359 HydrophobicContact CD1-CE2 4.39Å; F293-Y359 HydrophobicContact CE1-CD2 4.23Å; F293-Y359 HydrophobicContact CE1-CE2 4.46Å; F293-Y359 PolarHBondContact N-O 3.12Å; F293-Y359 PolarHBondContact O-N 3.49Å; L297-Y359 HydrophobicContact CD1-CD2 4.04Å; L297-Y359 HydrophobicContact CD1-CE2 3.34Å; L299-Y359 WeakPolarHBondContact CD1-OH 3.44Å; L310-Y359 HydrophobicContact CD2-CD1 4.06Å; L310-Y359 HydrophobicContact CD2-CE1 3.7Å; I314-Y359 HydrophobicContact CG2-CD1 4.37Å; I314-Y359 HydrophobicContact CG2-CG 4.3Å; H315-Y359 CarbonylContact O-C 3.48Å; H315-Y359 WeakPolarHBondContact O-CA 3.37Å; D316-Y359 HydrophobicContact CB-CD1 3.93Å; D316-Y359 HydrophobicContact CB-CE1 3.83Å; R357-Y359 HydrophobicContact CB-CE2 4.49Å; R357-Y359 VanDerWaalsContact CD-OH 3.32Å; R357-Y359 WeakPolarHBondContact CD-OH 3.33Å
360	V	98.6	Very high	95.7	Very high	5 Å²	5	33.1 Å²	33.1	3%	0.03	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	142.2	177	63	0	0	0	0	110.4	S291 I292 I314 H315 V317 I365 P367 F395	S291-V360 WeakPolarHBondContact O-CA 3.49Å; I292-V360 HydrophobicContact CG1-CB 4.31Å; I292-V360 HydrophobicContact CG1-CG2 3.98Å; I314-V360 WeakPolarHBondContact CA-O 3.33Å; H315-V360 HydrophobicContact CB-CG1 3.96Å; H315-V360 PolarHBondContact N-O 2.89Å; H315-V360 PolarHBondContact O-N 2.9Å; V317-V360 HydrophobicContact CG2-CB 4.28Å; V317-V360 HydrophobicContact CG2-CG1 3.96Å; V360-I365 HydrophobicContact CG2-CG2 3.72Å; V360-P367 HydrophobicContact CG1-CG 4.19Å; V360-F395 HydrophobicContact CB-CE1 3.9Å; V360-F395 HydrophobicContact CG1-CE1 4.17Å; V360-F395 HydrophobicContact CG2-CD1 4.35Å; V360-F395 HydrophobicContact CG2-CE1 4Å
361	L	97.6	Very high	96.3	Very high	14 Å²	14	27.5 Å²	27.5	7%	0.073	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143	140.1	175.8	173.7	66.2	0	0	0	109.7	M272 V276 A290 S291 G313 I314	M272-L361 HydrophobicContact CB-CD2 4.32Å; M272-L361 HydrophobicContact CE-CB 4.11Å; V276-L361 HydrophobicContact CB-CD2 4.1Å; V276-L361 HydrophobicContact CB-CG 4.26Å; V276-L361 HydrophobicContact CG1-CG 4.33Å; V276-L361 HydrophobicContact CG2-CB 4.47Å; V276-L361 HydrophobicContact CG2-CD2 3.99Å; V276-L361 HydrophobicContact CG2-CG 3.96Å; A290-L361 CarbonylContact C-O 3.53Å; A290-L361 VanDerWaalsContact CA-O 3.26Å; A290-L361 WeakPolarHBondContact CA-O 3.32Å; S291-L361 PolarHBondContact N-O 3.48Å; S291-L361 PolarHBondContact O-N 3.27Å; G313-L361 WeakPolarHBondContact O-CD1 3.17Å; I314-L361 HydrophobicContact CD1-CD2 4.44Å; I314-L361 HydrophobicContact CG1-CB 4.11Å; I314-L361 HydrophobicContact CG1-CD1 4.1Å; I314-L361 HydrophobicContact CG1-CD2 4.05Å; I314-L361 HydrophobicContact CG1-CG 4.3Å
362	G	94.7	Very high	96.7	Very high	37 Å²	37	26.1 Å²	26.1	38%	0.381	15%	0.145	S	C	.	.	E	Extended strand (participates in β ladder)	trans	124.1	-161	168.5	0	0	0	0	0	113	R289	R289-G362 WeakPolarHBondContact O-CA 3.47Å
363	S	90.8	Very high	96.9	Very high	54 Å²	54	27.2 Å²	27.2	38%	0.378	15%	0.147	S	C	.	.	S	Bend	trans	-108.1	163.3	-174.9	58.3	0	0	0	0	111.6	G288 R289 I365	G288-S363 WeakPolarHBondContact CA-OG 3.33Å; R289-S363 PolarHBondContact O-N 3.32Å; R289-S363 VanDerWaalsContact O-N 3.1Å; S363-I365 PolarHBondContact O-N 3.27Å; S363-I365 VanDerWaalsContact O-N 3.1Å
364	R	91.7	Very high	96.9	Very high	26 Å²	26	24.8 Å²	24.8	10%	0.098	14%	0.137	C	C	.	.	S	Bend	trans	62.8	15.8	173.4	-53.9	-172.5	-179.3	-71.1	-3.5	115.2	L242 S285 L397 T398 G399	L242-R364 HydrophobicContact CD1-CB 4.13Å; L242-R364 HydrophobicContact CD2-CB 4.31Å; S285-R364 PolarHBondContact O-NH2 3.45Å; R364-L397 CarbonylContact O-C 3.5Å; R364-L397 VanDerWaalsContact O-CA 3.31Å; R364-L397 WeakPolarHBondContact O-CA 3.28Å; R364-T398 WeakPolarHBondContact CA-O 3.42Å; R364-T398 WeakPolarHBondContact CA-OG1 3.33Å; R364-T398 WeakPolarHBondContact CB-O 3.48Å; R364-T398 WeakPolarHBondContact CG-O 3.38Å; R364-T398 PolarHBondContact O-N 3.3Å; R364-G399 PolarHBondContact NH1-O 2.84Å
365	I	95.2	Very high	96.9	Very high	18 Å²	18	28.4 Å²	28.4	9%	0.092	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	131.3	177	-166.6	163.8	0	0	0	109.1	I122 L244 A290 I292 V360 S363 F395 L397	I122-I365 HydrophobicContact CG2-CD1 4.36Å; L244-I365 HydrophobicContact CD1-CD1 4.18Å; L244-I365 HydrophobicContact CD2-CD1 4.38Å; A290-I365 HydrophobicContact CB-CB 4.33Å; A290-I365 HydrophobicContact CB-CG2 3.55Å; I292-I365 HydrophobicContact CD1-CD1 3.74Å; I292-I365 HydrophobicContact CG1-CD1 4.32Å; V360-I365 HydrophobicContact CG2-CG2 3.72Å; S363-I365 PolarHBondContact O-N 3.27Å; S363-I365 VanDerWaalsContact O-N 3.1Å; I365-F395 HydrophobicContact CD1-CB 3.9Å; I365-F395 HydrophobicContact CD1-CD1 4.06Å; I365-F395 HydrophobicContact CD1-CG 4.03Å; I365-F395 HydrophobicContact CG1-CB 3.62Å; I365-F395 HydrophobicContact CG1-CD1 3.88Å; I365-F395 HydrophobicContact CG1-CG 4.04Å; I365-L397 HydrophobicContact CB-CD2 4.4Å; I365-L397 HydrophobicContact CD1-CD2 4.07Å; I365-L397 HydrophobicContact CG1-CD2 3.96Å
366	K	95.6	Very high	96.7	Very high	117 Å²	117	32.8 Å²	32.8	51%	0.509	18%	0.177	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	126.3	178.2	-176.9	179.2	177.1	-178.2	0	110.1	V368 F395 L396	K366-V368 PolarHBondContact O-N 3.05Å; K366-F395 CarbonylContact O-C 3.46Å; K366-F395 WeakPolarHBondContact O-CA 3.41Å; K366-L396 PolarHBondContact N-O 2.92Å; K366-L396 PolarHBondContact O-N 2.97Å
367	P	97.3	Very high	96.6	Very high	12 Å²	12	38.9 Å²	38.9	8%	0.078	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	132.2	170.2	30.5	-34.7	0	0	0	109.7	V317 E320 V360 F395	V317-P367 HydrophobicContact CB-CB 4.38Å; V317-P367 HydrophobicContact CG1-CB 3.75Å; V317-P367 HydrophobicContact CG2-CB 4.21Å; E320-P367 HydrophobicContact CB-CG 3.79Å; E320-P367 HydrophobicContact CG-CG 3.5Å; E320-P367 VanDerWaalsContact CG-CG 3.5Å; V360-P367 HydrophobicContact CG1-CG 4.19Å; P367-F395 HydrophobicContact CB-CD1 3.99Å; P367-F395 HydrophobicContact CB-CE1 3.96Å
368	V	96.3	Very high	96.5	Very high	69 Å²	69	39 Å²	39	42%	0.418	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	-20.1	-177.4	-67.1	0	0	0	0	113.5	I121 K366 R394 L396	I121-V368 HydrophobicContact CD1-CG2 3.86Å; K366-V368 PolarHBondContact O-N 3.05Å; V368-R394 HydrophobicContact CG2-CB 4.12Å; V368-R394 WeakPolarHBondContact CG2-O 3.27Å; V368-R394 PolarHBondContact N-O 3.25Å; V368-L396 HydrophobicContact CG1-CB 3.62Å; V368-L396 HydrophobicContact CG2-CB 4.4Å
369	D	96.8	Very high	96.3	Very high	42 Å²	42	48.4 Å²	48.4	23%	0.225	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.8	153.8	174.3	-177.2	31.4	0	0	0	109.8	C321 R324 R394	C321-D369 VanDerWaalsContact SG-C 3.53Å; C321-D369 PolarHBondContact SG-N 3Å; R324-D369 IonicContact CZ-OD1 3.83Å; R324-D369 IonicContact NH2-OD1 3.81Å; R324-D369 PolarHBondContact NH2-OD1 3.19Å; D369-R394 HydrophobicContact CB-CB 4.04Å; D369-R394 HydrophobicContact CB-CG 4.13Å; D369-R394 PolarHBondContact N-O 3.38Å; D369-R394 PolarHBondContact O-N 3Å; D369-R394 IonicContact OD2-CZ 2.8Å; D369-R394 IonicContact OD2-NE 2.88Å; D369-R394 IonicContact OD2-NH1 2.77Å; D369-R394 PolarHBondContact OD2-NH1 3.12Å
370	F	98	Very high	96	Very high	5 Å²	5	55.3 Å²	55.3	2%	0.022	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	124.9	178	-177.5	-90.1	0	0	0	109.9	V317 W318 C321 R324 I327 M358 I391 L392	V317-F370 HydrophobicContact CB-CD2 4.22Å; V317-F370 HydrophobicContact CG1-CB 4.3Å; V317-F370 HydrophobicContact CG1-CD2 3.69Å; V317-F370 HydrophobicContact CG1-CG 4.42Å; W318-F370 HydrophobicContact CB-CD1 3.96Å; W318-F370 HydrophobicContact CB-CD2 4.48Å; W318-F370 HydrophobicContact CB-CE1 3.88Å; W318-F370 HydrophobicContact CB-CE2 4.38Å; W318-F370 HydrophobicContact CB-CG 4.25Å; W318-F370 HydrophobicContact CB-CZ 4.07Å; W318-F370 AromaticContact CD1-CD1 3.67Å; W318-F370 AromaticContact CD1-CE1 3.74Å; W318-F370 HydrophobicContact CG-CD1 4.22Å; W318-F370 HydrophobicContact CG-CE1 4.16Å; C321-F370 HydrophobicContact CB-CB 3.79Å; R324-F370 PolarHBondContact NH2-O 2.85Å; I327-F370 HydrophobicContact CD1-CD1 3.94Å; I327-F370 WeakPolarHBondContact CD1-O 3.35Å; M358-F370 HydrophobicContact CB-CE2 4.38Å; F370-I391 HydrophobicContact CE1-CB 4.43Å; F370-I391 HydrophobicContact CE1-CG2 4.22Å; F370-I391 HydrophobicContact CE2-CB 3.88Å; F370-I391 HydrophobicContact CE2-CD1 4.18Å; F370-I391 HydrophobicContact CE2-CG1 4.48Å; F370-I391 HydrophobicContact CE2-CG2 4.38Å; F370-I391 HydrophobicContact CZ-CB 3.58Å; F370-I391 HydrophobicContact CZ-CD1 4.2Å; F370-I391 HydrophobicContact CZ-CG1 4.45Å; F370-I391 HydrophobicContact CZ-CG2 3.58Å; F370-L392 CarbonylContact C-O 3.55Å; F370-L392 WeakPolarHBondContact CA-O 3.26Å
371	G	97.2	Very high	95.8	Very high	9 Å²	9	56.8 Å²	56.8	9%	0.093	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	166.1	-176.1	0	0	0	0	0	114	I391 L392	G371-I391 CarbonylContact O-C 3.58Å; G371-I391 WeakPolarHBondContact O-CA 3.09Å; G371-L392 PolarHBondContact N-O 2.92Å; G371-L392 PolarHBondContact O-N 3.13Å
372	L	98.4	Very high	95.6	Very high	23 Å²	23	60.1 Å²	60.1	12%	0.12	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	151.8	172.2	-60.5	-178.7	0	0	0	111.4	I327 T330 I375 W389 A390 I391	I327-L372 HydrophobicContact CB-CD1 4.09Å; I327-L372 HydrophobicContact CB-CG 3.88Å; I327-L372 HydrophobicContact CG2-CD1 4.08Å; I327-L372 HydrophobicContact CG2-CG 3.9Å; T330-L372 HydrophobicContact CG2-CD2 4.21Å; L372-I375 HydrophobicContact CB-CG2 4.24Å; L372-W389 HydrophobicContact CB-CB 4.42Å; L372-W389 HydrophobicContact CD1-CB 4.25Å; L372-W389 HydrophobicContact CD1-CG 4.18Å; L372-W389 HydrophobicContact CD2-CB 4.04Å; L372-W389 HydrophobicContact CG-CB 4.46Å; L372-A390 CarbonylContact C-O 3.58Å; L372-A390 VanDerWaalsContact CA-O 3.24Å; L372-A390 WeakPolarHBondContact CA-O 3.18Å; L372-I391 HydrophobicContact CD2-CG2 3.95Å
373	R	98.1	Very high	95.6	Very high	46 Å²	46	58.5 Å²	58.5	17%	0.174	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	168.6	168.3	-64	-61.9	-172.8	-80.8	-6.6	111.3	L125 E151 F153 I375 A390 L392	L125-R373 HydrophobicContact CD1-CB 4.31Å; L125-R373 HydrophobicContact CD1-CG 4.26Å; E151-R373 WeakPolarHBondContact OE1-CD 3.27Å; E151-R373 IonicContact OE1-CZ 3.92Å; E151-R373 IonicContact OE1-NE 3.4Å; E151-R373 PolarHBondContact OE1-NE 3.41Å; E151-R373 IonicContact OE2-CZ 3.47Å; E151-R373 VanDerWaalsContact OE2-CZ 3.26Å; E151-R373 IonicContact OE2-NE 3.55Å; E151-R373 PolarHBondContact OE2-NE 3.29Å; E151-R373 IonicContact OE2-NH2 3.76Å; E151-R373 PolarHBondContact OE2-NH2 3.24Å; F153-R373 HydrophobicContact CZ-CG 4.34Å; R373-I375 VanDerWaalsContact C-N 3.3Å; R373-A390 HydrophobicContact CB-CB 4.02Å; R373-A390 PolarHBondContact N-O 2.82Å; R373-A390 PolarHBondContact O-N 2.97Å; R373-L392 VanDerWaalsContact NH2-CD2 3.29Å
374	G	97.3	Very high	95.9	Very high	1 Å²	1	56.3 Å²	56.3	1%	0.01	28%	0.276	C	S	.	.			trans	72.5	26.7	-177.5	0	0	0	0	0	113	E376 W389	G374-E376 VanDerWaalsContact C-N 3.34Å; G374-W389 VanDerWaalsContact O-CE3 3.3Å; G374-W389 WeakPolarHBondContact O-CZ3 3.15Å
375	I	96.5	Very high	96.2	Very high	94 Å²	94	55.2 Å²	55.2	48%	0.482	27%	0.272	S	S	.	.			trans	-84.1	-15.6	179.2	61.1	173.2	0	0	0	112	L372 R373 L384 W389	L372-I375 HydrophobicContact CB-CG2 4.24Å; R373-I375 VanDerWaalsContact C-N 3.3Å; I375-L384 VanDerWaalsContact O-CD2 3.27Å; I375-L384 WeakPolarHBondContact O-CD2 3.31Å; I375-W389 HydrophobicContact CB-CE3 4.5Å; I375-W389 HydrophobicContact CB-CZ3 4.39Å; I375-W389 HydrophobicContact CG2-CD2 4.04Å; I375-W389 HydrophobicContact CG2-CE3 3.96Å; I375-W389 HydrophobicContact CG2-CG 4.46Å; I375-W389 HydrophobicContact CG2-CZ3 4.3Å
376	E	95.4	Very high	96.4	Very high	112 Å²	112	54.3 Å²	54.3	52%	0.523	27%	0.268	S	S	.	.	S	Bend	trans	-81.9	142.8	177.8	-56.4	87.7	164.4	0	0	111.3	G374 L384 P385	G374-E376 VanDerWaalsContact C-N 3.34Å; E376-L384 WeakPolarHBondContact O-CD2 3.18Å; E376-P385 WeakPolarHBondContact O-CD 3.33Å
377	K	96.7	Very high	96.5	Very high	128 Å²	128	49 Å²	49	56%	0.557	25%	0.245	S	C	*	.	P	Polyproline II helix	trans	-64.8	145.2	173.1	-70.6	178.4	177	174.5	0	110.5	R379 L384	K377-R379 PolarHBondContact O-N 3.27Å; K377-L384 HydrophobicContact CG-CD2 4.27Å
378	V	97.2	Very high	96.5	Very high	6 Å²	6	48.8 Å²	48.8	4%	0.036	24%	0.243	C	C	.	.	P	Polyproline II helix	trans	-59.5	134.8	170.2	179.3	0	0	0	0	108.7	K139 R140 N380 L381 C383 P385	K139-V378 HydrophobicContact CB-CG1 4.14Å; K139-V378 WeakPolarHBondContact O-CG1 3.38Å; R140-V378 HydrophobicContact CG-CG2 4.25Å; V378-N380 PolarHBondContact O-N 3.01Å; V378-L381 HydrophobicContact CB-CB 4.18Å; V378-L381 HydrophobicContact CB-CD1 4.1Å; V378-L381 HydrophobicContact CG1-CB 4.45Å; V378-L381 HydrophobicContact CG1-CD1 3.74Å; V378-L381 HydrophobicContact CG1-CG 4.24Å; V378-L381 PolarHBondContact O-N 2.92Å; V378-C383 PolarHBondContact N-O 3.16Å; V378-P385 HydrophobicContact CG2-CB 4.38Å; V378-P385 HydrophobicContact CG2-CG 4.06Å
379	R	94	Very high	96.7	Very high	197 Å²	197	46.2 Å²	46.2	74%	0.743	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-51.6	130.1	-176.4	-171.7	177.9	-179.8	177.8	0.9	111.2	K377 L381	K377-R379 PolarHBondContact O-N 3.27Å; R379-L381 PolarHBondContact O-N 3.41Å
380	N	93.4	Very high	96.8	Very high	147 Å²	147	44.2 Å²	44.2	79%	0.786	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.7	19.3	-179.1	-51.3	-33	0	0	0	114.8	V378	V378-N380 PolarHBondContact O-N 3.01Å
381	L	94.3	Very high	96.8	Very high	35 Å²	35	44 Å²	44	18%	0.183	21%	0.214	C	C	.	.	S	Bend	trans	-126.1	157.1	177.4	-65	-175.9	0	0	0	113.2	N136 K139 V378 R379 C383	N136-L381 HydrophobicContact CB-CD1 3.85Å; K139-L381 HydrophobicContact CB-CD1 3.8Å; K139-L381 HydrophobicContact CD-CD1 3.76Å; K139-L381 HydrophobicContact CD-CD2 4.13Å; K139-L381 HydrophobicContact CD-CG 4.18Å; K139-L381 HydrophobicContact CG-CD1 4.44Å; V378-L381 HydrophobicContact CB-CB 4.18Å; V378-L381 HydrophobicContact CB-CD1 4.1Å; V378-L381 HydrophobicContact CG1-CB 4.45Å; V378-L381 HydrophobicContact CG1-CD1 3.74Å; V378-L381 HydrophobicContact CG1-CG 4.24Å; V378-L381 PolarHBondContact O-N 2.92Å; R379-L381 PolarHBondContact O-N 3.41Å; L381-C383 VanDerWaalsContact C-N 3.34Å
382	S	92.3	Very high	96.9	Very high	84 Å²	84	43.6 Å²	43.6	59%	0.587	21%	0.21	S	C	*	.	S	Bend	trans	-37.4	-60.6	155.5	98.8	0	0	0	0	115.7	Q337	Q337-S382 PolarHBondContact NE2-O 3.39Å; Q337-S382 PolarHBondContact OE1-O 3.16Å
383	C	94.9	Very high	96.9	Very high	4 Å²	4	42.5 Å²	42.5	3%	0.027	20%	0.204	C	C	.	.	S	Bend	trans	-89.4	161.2	-152.2	59.7	0	0	0	0	113	N338 V378 L381	N338-C383 WeakPolarHBondContact OD1-CB 3.48Å; V378-C383 PolarHBondContact N-O 3.16Å; L381-C383 VanDerWaalsContact C-N 3.34Å
384	L	97.4	Very high	96.9	Very high	8 Å²	8	44.4 Å²	44.4	4%	0.042	21%	0.211	C	C	.	.			trans	-86.1	166.6	169.1	-65.3	150.3	0	0	0	108.7	N336 Q337 N338 I375 E376 K377 S386 W389	N336-L384 HydrophobicContact CB-CD1 4.01Å; N336-L384 VanDerWaalsContact CG-CD1 3.41Å; N336-L384 VanDerWaalsContact OD1-CD1 3.3Å; N336-L384 WeakPolarHBondContact OD1-CD1 3.46Å; Q337-L384 HydrophobicContact CG-CD1 4.18Å; N338-L384 PolarHBondContact ND2-O 3.33Å; N338-L384 PolarHBondContact OD1-N 3.48Å; I375-L384 VanDerWaalsContact O-CD2 3.27Å; I375-L384 WeakPolarHBondContact O-CD2 3.31Å; E376-L384 WeakPolarHBondContact O-CD2 3.18Å; K377-L384 HydrophobicContact CG-CD2 4.27Å; L384-S386 PolarHBondContact O-N 2.91Å; L384-W389 HydrophobicContact CB-CZ3 4.31Å; L384-W389 HydrophobicContact CD1-CH2 3.36Å; L384-W389 HydrophobicContact CD1-CZ2 4.46Å; L384-W389 HydrophobicContact CD1-CZ3 3.65Å; L384-W389 HydrophobicContact CD2-CH2 3.87Å; L384-W389 HydrophobicContact CD2-CZ3 3.71Å; L384-W389 HydrophobicContact CG-CH2 4.14Å; L384-W389 HydrophobicContact CG-CZ3 4.05Å
385	P	98.1	Very high	96.9	Very high	2 Å²	2	44.3 Å²	44.3	1%	0.013	21%	0.211	C	C	.	.	S	Bend	trans	-62.7	-34.5	179.6	-20.5	32.2	0	0	0	112.1	W127 R140 V144 E376 V378	W127-P385 HydrophobicContact CH2-CB 3.65Å; W127-P385 HydrophobicContact CH2-CG 3.83Å; W127-P385 HydrophobicContact CZ2-CB 3.57Å; W127-P385 HydrophobicContact CZ2-CG 3.93Å; R140-P385 WeakPolarHBondContact CB-O 3.35Å; R140-P385 WeakPolarHBondContact CD-O 3.47Å; R140-P385 PolarHBondContact NH1-O 3.05Å; V144-P385 HydrophobicContact CG2-CB 3.93Å; E376-P385 WeakPolarHBondContact O-CD 3.33Å; V378-P385 HydrophobicContact CG2-CB 4.38Å; V378-P385 HydrophobicContact CG2-CG 4.06Å
386	S	98.6	Very high	96.8	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	20%	0.199	C	C	.	.			trans	-144	165.8	178.5	177.9	0	0	0	0	110.7	N128 Q130 N336 N338 L384 H388	N128-S386 VanDerWaalsContact O-CB 3.29Å; N128-S386 WeakPolarHBondContact O-CB 3.39Å; N128-S386 PolarHBondContact O-OG 3.38Å; Q130-S386 WeakPolarHBondContact CB-OG 3.27Å; N336-S386 PolarHBondContact ND2-O 2.91Å; N338-S386 PolarHBondContact ND2-O 2.91Å; L384-S386 PolarHBondContact O-N 2.91Å; S386-H388 WeakPolarHBondContact CB-O 3.41Å; S386-H388 PolarHBondContact OG-N 3.33Å
387	D	98	Very high	96.8	Very high	6 Å²	6	36.7 Å²	36.7	3%	0.032	17%	0.174	C	C	.	.	S	Bend	trans	-74.5	-10.3	163.8	68.9	-40	0	0	0	113.3	Q130 W331 N336 N338 A339 Q342	Q130-D387 WeakPolarHBondContact CB-OD1 3.46Å; Q130-D387 VanDerWaalsContact CD-CG 3.41Å; Q130-D387 WeakPolarHBondContact CG-OD1 3.28Å; Q130-D387 PolarHBondContact NE2-OD1 3.33Å; Q130-D387 VanDerWaalsContact NE2-OD1 3.16Å; Q130-D387 PolarHBondContact OE1-OD1 3.36Å; W331-D387 PolarHBondContact NE1-OD2 3.15Å; N336-D387 WeakPolarHBondContact ND2-CA 3.32Å; N336-D387 PolarHBondContact ND2-O 3.1Å; N336-D387 VanDerWaalsContact ND2-O 3.09Å; N338-D387 HydrophobicContact CB-CB 3.84Å; A339-D387 HydrophobicContact CB-CB 3.92Å; Q342-D387 PolarHBondContact NE2-OD2 3.08Å
388	H	98.7	Very high	96.3	Very high	6 Å²	6	32.5 Å²	32.5	3%	0.028	16%	0.159	C	C	.	.	B	Isolated β-bridge	trans	-101.1	144.5	168.4	-68.6	-114.3	0	0	0	112.3	W127 N128 D296 W331 D356 S386	W127-H388 PolarHBondContact NE1-O 3.24Å; N128-H388 HydrophobicContact CB-CB 4.16Å; D296-H388 IonicContact OD2-CE1 3.54Å; D296-H388 PolarHBondContact OD2-CE1 3.08Å; D296-H388 IonicContact OD2-NE2 3.46Å; W331-H388 AromaticContact CD1-CD2 3.56Å; W331-H388 AromaticContact CD1-CE1 3.75Å; W331-H388 AromaticContact CD1-CG 3.95Å; W331-H388 AromaticContact CD1-NE2 3.37Å; D356-H388 IonicContact OD1-ND1 3.38Å; D356-H388 PolarHBondContact OD1-ND1 3.28Å; D356-H388 IonicContact OD2-CE1 2.77Å; D356-H388 IonicContact OD2-CG 3.54Å; D356-H388 IonicContact OD2-ND1 2.74Å; D356-H388 PolarHBondContact OD2-ND1 2.73Å; S386-H388 WeakPolarHBondContact CB-O 3.41Å; S386-H388 PolarHBondContact OG-N 3.33Å
389	W	98.7	Very high	95.1	Very high	16 Å²	16	33 Å²	33	6%	0.061	17%	0.166	C	C	.	.	P	Polyproline II helix	trans	-77.4	138.5	158.7	-52.2	136.2	0	0	0	109.8	T330 R335 N336 L372 G374 I375 L384	T330-W389 PolarHBondContact O-N 2.93Å; R335-W389 HydrophobicContact CB-CZ2 4.29Å; N336-W389 HydrophobicContact CB-CH2 3.91Å; N336-W389 HydrophobicContact CB-CZ2 3.73Å; L372-W389 HydrophobicContact CB-CB 4.42Å; L372-W389 HydrophobicContact CD1-CB 4.25Å; L372-W389 HydrophobicContact CD1-CG 4.18Å; L372-W389 HydrophobicContact CD2-CB 4.04Å; L372-W389 HydrophobicContact CG-CB 4.46Å; G374-W389 VanDerWaalsContact O-CE3 3.3Å; G374-W389 WeakPolarHBondContact O-CZ3 3.15Å; I375-W389 HydrophobicContact CB-CE3 4.5Å; I375-W389 HydrophobicContact CB-CZ3 4.39Å; I375-W389 HydrophobicContact CG2-CD2 4.04Å; I375-W389 HydrophobicContact CG2-CE3 3.96Å; I375-W389 HydrophobicContact CG2-CG 4.46Å; I375-W389 HydrophobicContact CG2-CZ3 4.3Å; L384-W389 HydrophobicContact CB-CZ3 4.31Å; L384-W389 HydrophobicContact CD1-CH2 3.36Å; L384-W389 HydrophobicContact CD1-CZ2 4.46Å; L384-W389 HydrophobicContact CD1-CZ3 3.65Å; L384-W389 HydrophobicContact CD2-CH2 3.87Å; L384-W389 HydrophobicContact CD2-CZ3 3.71Å; L384-W389 HydrophobicContact CG-CH2 4.14Å; L384-W389 HydrophobicContact CG-CZ3 4.05Å
390	A	98.9	Very high	93.4	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	149.9	169.2	0	0	0	0	0	110	L125 S126 W127 L372 R373	L125-A390 HydrophobicContact CD1-CB 3.86Å; L125-A390 HydrophobicContact CD2-CB 4.5Å; L125-A390 HydrophobicContact CG-CB 4.27Å; S126-A390 CarbonylContact O-C 3.54Å; S126-A390 VanDerWaalsContact O-CA 3.29Å; S126-A390 WeakPolarHBondContact O-CA 3.35Å; W127-A390 HydrophobicContact CB-CB 3.73Å; W127-A390 HydrophobicContact CD2-CB 3.5Å; W127-A390 HydrophobicContact CE3-CB 3.88Å; W127-A390 HydrophobicContact CG-CB 3.44Å; W127-A390 VanDerWaalsContact CG-CB 3.44Å; L372-A390 CarbonylContact C-O 3.58Å; L372-A390 VanDerWaalsContact CA-O 3.24Å; L372-A390 WeakPolarHBondContact CA-O 3.18Å; R373-A390 HydrophobicContact CB-CB 4.02Å; R373-A390 PolarHBondContact N-O 2.82Å; R373-A390 PolarHBondContact O-N 2.97Å
391	I	98.9	Very high	93.4	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	133.7	172.7	59.6	173	0	0	0	110	L125 S126 T330 D356 R357 M358 F370 G371 L372	L125-I391 CarbonylContact C-O 3.46Å; L125-I391 WeakPolarHBondContact CA-O 3.14Å; S126-I391 PolarHBondContact N-O 2.95Å; S126-I391 PolarHBondContact O-N 3.42Å; T330-I391 HydrophobicContact CG2-CG2 3.49Å; T330-I391 VanDerWaalsContact CG2-CG2 3.49Å; D356-I391 HydrophobicContact CB-CD1 4.02Å; D356-I391 HydrophobicContact CB-CG1 4.34Å; D356-I391 HydrophobicContact CB-CG2 4.14Å; R357-I391 VanDerWaalsContact C-CD1 3.46Å; M358-I391 HydrophobicContact CB-CD1 4.14Å; F370-I391 HydrophobicContact CE1-CB 4.43Å; F370-I391 HydrophobicContact CE1-CG2 4.22Å; F370-I391 HydrophobicContact CE2-CB 3.88Å; F370-I391 HydrophobicContact CE2-CD1 4.18Å; F370-I391 HydrophobicContact CE2-CG1 4.48Å; F370-I391 HydrophobicContact CE2-CG2 4.38Å; F370-I391 HydrophobicContact CZ-CB 3.58Å; F370-I391 HydrophobicContact CZ-CD1 4.2Å; F370-I391 HydrophobicContact CZ-CG1 4.45Å; F370-I391 HydrophobicContact CZ-CG2 3.58Å; G371-I391 CarbonylContact O-C 3.58Å; G371-I391 WeakPolarHBondContact O-CA 3.09Å; L372-I391 HydrophobicContact CD2-CG2 3.95Å
392	L	98.8	Very high	93.3	Very high	1 Å²	1	26.7 Å²	26.7	1%	0.005	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	119.1	175.3	171.2	63.8	0	0	0	108.6	N123 V124 L125 F153 F370 G371 R373 R394	N123-L392 HydrophobicContact CB-CD1 4.16Å; V124-L392 WeakPolarHBondContact O-CA 3.33Å; L125-L392 HydrophobicContact CD1-CB 4.25Å; F153-L392 HydrophobicContact CD1-CD1 3.68Å; F153-L392 HydrophobicContact CE1-CD1 3.72Å; F153-L392 HydrophobicContact CE1-CD2 4.11Å; F153-L392 HydrophobicContact CE1-CG 4.42Å; F370-L392 CarbonylContact C-O 3.55Å; F370-L392 WeakPolarHBondContact CA-O 3.26Å; G371-L392 PolarHBondContact N-O 2.92Å; G371-L392 PolarHBondContact O-N 3.13Å; R373-L392 VanDerWaalsContact NH2-CD2 3.29Å; L392-R394 HydrophobicContact CD2-CG 4.37Å; L392-R394 HydrophobicContact CG-CG 4.28Å
393	G	98.7	Very high	93.4	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	131.9	164.1	0	0	0	0	0	110.7	V124	V124-G393 PolarHBondContact N-O 2.95Å; V124-G393 PolarHBondContact O-N 3.16Å
394	R	98.2	Very high	93.3	Very high	85 Å²	85	24.7 Å²	24.7	32%	0.321	13%	0.128	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	131	169.7	-55.4	-167.1	165.8	141	-15.8	109.3	I121 N123 V368 D369 L392	I121-R394 HydrophobicContact CG2-CB 4.19Å; N123-R394 WeakPolarHBondContact OD1-CG 3.4Å; V368-R394 HydrophobicContact CG2-CB 4.12Å; V368-R394 WeakPolarHBondContact CG2-O 3.27Å; V368-R394 PolarHBondContact N-O 3.25Å; D369-R394 HydrophobicContact CB-CB 4.04Å; D369-R394 HydrophobicContact CB-CG 4.13Å; D369-R394 PolarHBondContact N-O 3.38Å; D369-R394 PolarHBondContact O-N 3Å; D369-R394 IonicContact OD2-CZ 2.8Å; D369-R394 IonicContact OD2-NE 2.88Å; D369-R394 IonicContact OD2-NH1 2.77Å; D369-R394 PolarHBondContact OD2-NH1 3.12Å; L392-R394 HydrophobicContact CD2-CG 4.37Å; L392-R394 HydrophobicContact CG-CG 4.28Å
395	F	97.7	Very high	93	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	125.1	-176.1	-55	-98.9	0	0	0	111	I121 I122 V124 I292 V317 M358 V360 I365 K366 P367	I121-F395 CarbonylContact C-O 3.55Å; I121-F395 VanDerWaalsContact CA-O 3.29Å; I121-F395 WeakPolarHBondContact CA-O 3.37Å; I122-F395 HydrophobicContact CG2-CB 3.74Å; I122-F395 HydrophobicContact CG2-CD2 4.28Å; I122-F395 HydrophobicContact CG2-CG 4.39Å; I122-F395 PolarHBondContact N-O 2.77Å; I122-F395 PolarHBondContact O-N 2.71Å; V124-F395 HydrophobicContact CB-CE2 4.14Å; V124-F395 HydrophobicContact CG2-CD2 4.21Å; V124-F395 HydrophobicContact CG2-CE2 3.98Å; I292-F395 HydrophobicContact CD1-CD1 4.21Å; I292-F395 HydrophobicContact CD1-CD2 3.84Å; I292-F395 HydrophobicContact CD1-CE1 3.92Å; I292-F395 HydrophobicContact CD1-CE2 3.55Å; I292-F395 HydrophobicContact CD1-CG 4.16Å; I292-F395 HydrophobicContact CD1-CZ 3.56Å; I292-F395 HydrophobicContact CG1-CE1 4.22Å; I292-F395 HydrophobicContact CG1-CE2 4.48Å; I292-F395 HydrophobicContact CG1-CZ 4.02Å; I292-F395 HydrophobicContact CG2-CZ 4.43Å; V317-F395 HydrophobicContact CG1-CE1 4.45Å; V317-F395 HydrophobicContact CG1-CZ 4.3Å; V317-F395 HydrophobicContact CG2-CE1 3.73Å; V317-F395 HydrophobicContact CG2-CZ 3.79Å; M358-F395 HydrophobicContact CG-CZ 4.13Å; M358-F395 HydrophobicContact SD-CE2 3.64Å; M358-F395 HydrophobicContact SD-CZ 3.44Å; M358-F395 WeakPolarHBondContact SD-CZ 3.32Å; V360-F395 HydrophobicContact CB-CE1 3.9Å; V360-F395 HydrophobicContact CG1-CE1 4.17Å; V360-F395 HydrophobicContact CG2-CD1 4.35Å; V360-F395 HydrophobicContact CG2-CE1 4Å; I365-F395 HydrophobicContact CD1-CB 3.9Å; I365-F395 HydrophobicContact CD1-CD1 4.06Å; I365-F395 HydrophobicContact CD1-CG 4.03Å; I365-F395 HydrophobicContact CG1-CB 3.62Å; I365-F395 HydrophobicContact CG1-CD1 3.88Å; I365-F395 HydrophobicContact CG1-CG 4.04Å; K366-F395 CarbonylContact O-C 3.46Å; K366-F395 WeakPolarHBondContact O-CA 3.41Å; P367-F395 HydrophobicContact CB-CD1 3.99Å; P367-F395 HydrophobicContact CB-CE1 3.96Å
396	L	95	Very high	92.7	Very high	43 Å²	43	27.3 Å²	27.3	23%	0.225	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	124.9	168.6	-179.7	66.8	0	0	0	109.2	L119 P120 I121 K366 V368 T398	L119-L396 HydrophobicContact CB-CD1 4.08Å; L119-L396 HydrophobicContact CD2-CD1 4.32Å; P120-L396 HydrophobicContact CG-CD1 4.21Å; I121-L396 HydrophobicContact CD1-CB 3.95Å; I121-L396 HydrophobicContact CD1-CD1 3.95Å; K366-L396 PolarHBondContact N-O 2.92Å; K366-L396 PolarHBondContact O-N 2.97Å; V368-L396 HydrophobicContact CG1-CB 3.62Å; V368-L396 HydrophobicContact CG2-CB 4.4Å; L396-T398 HydrophobicContact CD2-CG2 4.18Å; L396-T398 HydrophobicContact CG-CG2 4.09Å
397	L	94.1	Very high	92.2	Very high	3 Å²	3	29.3 Å²	29.3	2%	0.016	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	123.8	173.5	-53.1	-177.6	0	0	0	108.8	P120 I122 L231 F234 L235 L242 R364 I365	P120-L397 HydrophobicContact CB-CB 4.2Å; P120-L397 HydrophobicContact CG-CB 4.41Å; P120-L397 VanDerWaalsContact CG-O 3.25Å; P120-L397 WeakPolarHBondContact CG-O 3.18Å; P120-L397 WeakPolarHBondContact O-CB 3.34Å; P120-L397 WeakPolarHBondContact O-CG 3.48Å; P120-L397 PolarHBondContact O-N 3.47Å; I122-L397 HydrophobicContact CB-CD1 4.49Å; I122-L397 HydrophobicContact CG2-CD2 3.78Å; I122-L397 HydrophobicContact CG2-CG 4.34Å; L231-L397 HydrophobicContact CB-CD1 4.21Å; L231-L397 HydrophobicContact CD1-CD1 4.11Å; L231-L397 HydrophobicContact CD1-CD2 4.41Å; F234-L397 HydrophobicContact CB-CD1 3.58Å; F234-L397 HydrophobicContact CD1-CD1 4.43Å; F234-L397 HydrophobicContact CD2-CD1 4.12Å; F234-L397 HydrophobicContact CG-CD1 3.81Å; L235-L397 HydrophobicContact CD2-CB 4.03Å; L242-L397 HydrophobicContact CD2-CB 4.43Å; L242-L397 HydrophobicContact CD2-CD1 4.39Å; L242-L397 HydrophobicContact CD2-CD2 3.82Å; L242-L397 HydrophobicContact CD2-CG 4.43Å; R364-L397 CarbonylContact O-C 3.5Å; R364-L397 VanDerWaalsContact O-CA 3.31Å; R364-L397 WeakPolarHBondContact O-CA 3.28Å; I365-L397 HydrophobicContact CB-CD2 4.4Å; I365-L397 HydrophobicContact CD1-CD2 4.07Å; I365-L397 HydrophobicContact CG1-CD2 3.96Å
398	T	85.9	Confident	91.8	Very high	39 Å²	39	31.1 Å²	31.1	24%	0.239	16%	0.16	C	C	.	.			trans	-112.5	134.2	-172.7	68.2	0	0	0	0	112.3	R364 L396 L400	R364-T398 WeakPolarHBondContact CA-O 3.42Å; R364-T398 WeakPolarHBondContact CA-OG1 3.33Å; R364-T398 WeakPolarHBondContact CB-O 3.48Å; R364-T398 WeakPolarHBondContact CG-O 3.38Å; R364-T398 PolarHBondContact O-N 3.3Å; L396-T398 HydrophobicContact CD2-CG2 4.18Å; L396-T398 HydrophobicContact CG-CG2 4.09Å; T398-L400 PolarHBondContact O-N 3.13Å; T398-L400 PolarHBondContact OG1-O 3.13Å
399	G	71.9	Confident	91.2	Very high	17 Å²	17	33.2 Å²	33.2	18%	0.175	17%	0.171	C	C	.	.			trans	-79.3	-3.8	171.4	0	0	0	0	0	114.2	L240 R364	L240-G399 VanDerWaalsContact CD1-CA 3.46Å; L240-G399 WeakPolarHBondContact CD1-O 3.4Å; R364-G399 PolarHBondContact NH1-O 2.84Å
400	L	58.1	Low	90.6	Very high	194 Å²	194	34.7 Å²	34.7	100%	1.016	18%	0.182	S	C	*	.			trans	-99.8	0	-179.5	-67	170.6	0	0	0	111	T398	T398-L400 PolarHBondContact O-N 3.13Å; T398-L400 PolarHBondContact OG1-O 3.13Å

Retrieved 400 of 400 residues in 474.9 ms (Link to these results)

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