A0A096NUT8_PAPAN Loading...

Kelch domain-containing protein 2

AlphaFold DB (F7AKA8), UniProt , Accession A0A096NUT8, Species PAPAN (Papio anubis, Olive baboon), Gene KLHDC2, Length 406 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	37.7	Very low	39.2	Very low	247 Å²	247	161.7 Å²	161.7	100%	1.217	89%	0.888	S	S	*	*				0	123.4	0	-76.7	-174.7	-171.3	0	0	107.3
2	A	36.5	Very low	39.4	Very low	104 Å²	104	161.9 Å²	161.9	86%	0.86	89%	0.887	S	S	*	*			trans	43.8	110	165.3	0	0	0	0	0	120.6
3	D	39.2	Very low	39.4	Very low	172 Å²	172	162.2 Å²	162.2	92%	0.92	89%	0.886	S	S	*	*			trans	-52	153.1	140.5	-98.5	-35.1	0	0	0	111.8
4	G	34.5	Very low	39.3	Very low	76 Å²	76	159.8 Å²	159.8	78%	0.784	88%	0.882	S	S	*	*			trans	-154	80.9	169.9	0	0	0	0	0	111.5
5	N	38.3	Very low	39.1	Very low	158 Å²	158	153.2 Å²	153.2	85%	0.845	87%	0.865	S	S	*	*			trans	-68.6	137	164	-109.6	-8.4	0	0	0	109.6	D7	N5-D7 PolarHBondContact O-N 3.48Å
6	E	41.5	Very low	38.8	Very low	195 Å²	195	150.4 Å²	150.4	91%	0.911	86%	0.855	S	S	*	*			trans	-78.4	107.9	171	-70.6	-177.3	157.5	0	0	110.1
7	D	38.4	Very low	38.6	Very low	157 Å²	157	147.2 Å²	147.2	84%	0.84	85%	0.852	S	S	*	*	P	Polyproline II helix	trans	-80.7	116.1	170.3	-87.2	-29.5	0	0	0	110.7	N5	N5-D7 PolarHBondContact O-N 3.48Å
8	M	39.7	Very low	38.2	Very low	185 Å²	185	149.6 Å²	149.6	91%	0.911	85%	0.851	S	S	*	*	P	Polyproline II helix	trans	-68.4	130.3	161	-80.3	-170.8	-80.5	0	0	109.7	A10	M8-A10 PolarHBondContact O-N 2.91Å
9	R	37.6	Very low	37.9	Very low	243 Å²	243	150 Å²	150	92%	0.917	85%	0.845	S	S	*	*	P	Polyproline II helix	trans	-63.4	120.9	176.4	-67.5	-178.4	-179.4	-179.6	-0.5	110.5	D11	R9-D11 PolarHBondContact O-N 3.07Å
10	A	43.4	Very low	37.5	Very low	94 Å²	94	147.5 Å²	147.5	78%	0.777	84%	0.837	S	S	*	*			trans	-81.1	93.9	164.8	0	0	0	0	0	108.7	M8	M8-A10 PolarHBondContact O-N 2.91Å
11	D	44	Very low	37.3	Very low	148 Å²	148	150.6 Å²	150.6	79%	0.791	84%	0.837	S	S	*	*			trans	-161.2	79.2	162.8	-90.8	-29.3	0	0	0	107	R9	R9-D11 PolarHBondContact O-N 3.07Å
12	D	41.6	Very low	37.2	Very low	164 Å²	164	146.9 Å²	146.9	88%	0.877	82%	0.817	S	S	*	*			trans	-178.1	74.5	157.8	-93.7	-23.6	0	0	0	109.9
13	L	39.6	Very low	37.2	Very low	165 Å²	165	146.6 Å²	146.6	86%	0.864	81%	0.808	S	S	*	*			trans	-130	127.2	160.4	-76.3	172.2	0	0	0	108.6	G15	L13-G15 PolarHBondContact O-N 3.06Å; L13-G15 VanDerWaalsContact O-N 3.12Å
14	P	37.7	Very low	37.2	Very low	129 Å²	129	146.4 Å²	146.4	84%	0.838	80%	0.804	S	S	*	*			trans	-66.7	115.3	175.6	26.3	-30	0	0	0	108.7
15	G	36.6	Very low	37.7	Very low	61 Å²	61	151.1 Å²	151.1	63%	0.629	81%	0.806	S	S	*	*			trans	-60.5	149.7	174.8	0	0	0	0	0	111.2	L13 A17	L13-G15 PolarHBondContact O-N 3.06Å; L13-G15 VanDerWaalsContact O-N 3.12Å; G15-A17 PolarHBondContact O-N 2.9Å
16	P	34.6	Very low	38.6	Very low	109 Å²	109	149.8 Å²	149.8	71%	0.708	80%	0.798	S	S	*	*			trans	-59.8	128.7	176.5	25.4	-31.5	0	0	0	108.7	F18	P16-F18 VanDerWaalsContact C-N 3.32Å; P16-F18 HydrophobicContact CG-CE2 4.43Å; P16-F18 PolarHBondContact O-N 3.3Å
17	A	35.4	Very low	40.6	Very low	96 Å²	96	143 Å²	143	79%	0.793	78%	0.775	S	S	*	*			trans	-58.2	99.3	170.2	0	0	0	0	0	107.9	G15 E19	G15-A17 PolarHBondContact O-N 2.9Å; A17-E19 PolarHBondContact O-N 2.91Å
18	F	31.8	Very low	43.1	Very low	190 Å²	190	138.7 Å²	138.7	83%	0.833	76%	0.757	S	S	*	*			trans	-67.2	89.3	160.9	-91.3	-93.7	0	0	0	105.8	P16 S20	P16-F18 VanDerWaalsContact C-N 3.32Å; P16-F18 HydrophobicContact CG-CE2 4.43Å; P16-F18 PolarHBondContact O-N 3.3Å; F18-S20 VanDerWaalsContact C-N 3.31Å; F18-S20 PolarHBondContact O-N 2.94Å
19	E	32.8	Very low	45.8	Very low	157 Å²	157	130 Å²	130	73%	0.734	71%	0.713	S	S	*	*			trans	-53.1	108.3	151.8	-77.8	-176.9	163.8	0	0	105.5	A17 Y21	A17-E19 PolarHBondContact O-N 2.91Å; E19-Y21 VanDerWaalsContact C-N 3.3Å; E19-Y21 PolarHBondContact O-N 3.02Å
20	S	29.4	Very low	48.6	Very low	99 Å²	99	120 Å²	120	69%	0.692	68%	0.683	S	S	*	*			trans	-57.9	103.4	168.5	53.2	0	0	0	0	106.1	F18 E22	F18-S20 VanDerWaalsContact C-N 3.31Å; F18-S20 PolarHBondContact O-N 2.94Å; S20-E22 PolarHBondContact O-N 2.92Å
21	Y	32.4	Very low	51.2	Low	214 Å²	214	118.2 Å²	118.2	84%	0.839	66%	0.659	S	S	*	*			trans	-60.6	81.2	153.4	-80.3	-95.6	0	0	0	105.7	E19 S23	E19-Y21 VanDerWaalsContact C-N 3.3Å; E19-Y21 PolarHBondContact O-N 3.02Å; Y21-S23 PolarHBondContact O-N 3.16Å
22	E	35.8	Very low	53.8	Low	168 Å²	168	111.2 Å²	111.2	79%	0.785	62%	0.621	S	S	*	*			trans	-52.7	107.1	150.9	-85.8	-173.3	158.6	0	0	103.9	S20 M24	S20-E22 PolarHBondContact O-N 2.92Å; E22-M24 VanDerWaalsContact C-N 3.34Å; E22-M24 PolarHBondContact O-N 3.07Å
23	S	36.7	Very low	56.5	Low	98 Å²	98	103.4 Å²	103.4	69%	0.685	58%	0.579	S	S	*	*			trans	-47.5	107.4	165.5	49.2	0	0	0	0	106	Y21 E25	Y21-S23 PolarHBondContact O-N 3.16Å; S23-E25 PolarHBondContact O-N 3.42Å
24	M	40.1	Very low	59.3	Low	169 Å²	169	95.6 Å²	95.6	83%	0.833	54%	0.539	S	S	*	.			trans	-60.3	87.1	165.1	-77.4	179.2	69.3	0	0	105.5	E22 L26	E22-M24 VanDerWaalsContact C-N 3.34Å; E22-M24 PolarHBondContact O-N 3.07Å; M24-L26 PolarHBondContact O-N 3.37Å
25	E	44.8	Very low	62.2	Low	175 Å²	175	89.9 Å²	89.9	82%	0.818	50%	0.501	S	S	*	.			trans	-50.2	116.7	162.1	-84.1	-172.6	149.4	0	0	104.9	S23 A27	S23-E25 PolarHBondContact O-N 3.42Å; E25-A27 PolarHBondContact O-N 3.21Å
26	L	57.2	Low	65.2	Low	130 Å²	130	87.7 Å²	87.7	68%	0.681	48%	0.475	S	S	*	.			trans	-53.5	108	172	-102.7	86.1	0	0	0	105.9	M24 C28 T403	M24-L26 PolarHBondContact O-N 3.37Å; L26-C28 PolarHBondContact O-N 2.83Å; L26-T403 HydrophobicContact CD2-CG2 4.11Å
27	A	82.8	Confident	68.2	Low	52 Å²	52	83.2 Å²	83.2	43%	0.43	45%	0.448	S	S	.	.			trans	-55.2	110.8	179.2	0	0	0	0	0	107.4	E25 W69 W78	E25-A27 PolarHBondContact O-N 3.21Å; A27-W69 HydrophobicContact CB-CH2 4.45Å; A27-W69 HydrophobicContact CB-CZ3 4.17Å; A27-W78 WeakPolarHBondContact O-CB 3.29Å
28	C	91.3	Very high	71.2	Confident	67 Å²	67	79.1 Å²	79.1	45%	0.453	41%	0.413	S	S	.	.			trans	-124	133.1	-177.4	-171	0	0	0	0	108.5	L26 W69	L26-C28 PolarHBondContact O-N 2.83Å; C28-W69 VanDerWaalsContact O-CH2 3.3Å; C28-W69 WeakPolarHBondContact O-CH2 3.29Å
29	P	96.6	Very high	74.4	Confident	1 Å²	1	71.4 Å²	71.4	1%	0.006	38%	0.382	C	S	.	.	P	Polyproline II helix	trans	-63.4	144.6	177.4	26	-35.1	0	0	0	111	W69 W78 F335 N352	P29-W69 HydrophobicContact CB-CD2 3.66Å; P29-W69 HydrophobicContact CB-CE3 3.92Å; P29-W69 HydrophobicContact CB-CG 3.95Å; P29-W69 HydrophobicContact CB-CZ2 4.34Å; P29-W69 HydrophobicContact CB-CZ3 4.37Å; P29-W69 HydrophobicContact CG-CD2 4.47Å; P29-W69 HydrophobicContact CG-CE3 4.31Å; P29-W78 VanDerWaalsContact CD-CD2 3.45Å; P29-W78 HydrophobicContact CG-CD2 3.73Å; P29-W78 HydrophobicContact CG-CE3 3.91Å; P29-W78 HydrophobicContact CG-CG 4.37Å; P29-W78 HydrophobicContact CG-CH2 3.86Å; P29-W78 HydrophobicContact CG-CZ2 3.66Å; P29-W78 HydrophobicContact CG-CZ3 3.97Å; P29-F335 HydrophobicContact CB-CZ 3.88Å; P29-F335 HydrophobicContact CG-CE1 4.46Å; P29-F335 HydrophobicContact CG-CE2 3.7Å; P29-F335 HydrophobicContact CG-CZ 3.41Å; P29-F335 VanDerWaalsContact CG-CZ 3.41Å; P29-N352 WeakPolarHBondContact O-CB 3.3Å; P29-N352 PolarHBondContact O-ND2 3.18Å
30	A	96.5	Very high	77.4	Confident	33 Å²	33	66.4 Å²	66.4	27%	0.273	36%	0.361	S	S	.	.	P	Polyproline II helix	trans	-60.2	152.7	166.2	0	0	0	0	0	111.4	R32 L63	A30-R32 PolarHBondContact O-NE 3.05Å; A30-R32 PolarHBondContact O-NH2 3.25Å; A30-L63 HydrophobicContact CB-CD1 4.3Å
31	E	97.3	Very high	80.5	Confident	58 Å²	58	62.2 Å²	62.2	27%	0.271	33%	0.333	S	S	.	.	P	Polyproline II helix	trans	-58.3	141.3	174.2	74	-74.5	-169.2	0	0	112	K51 H350 S351 N352	E31-K51 HydrophobicContact CG-CB 4.34Å; E31-K51 HydrophobicContact CG-CD 4.05Å; E31-K51 WeakPolarHBondContact O-CD 3.42Å; E31-K51 VanDerWaalsContact OE1-CD 3.3Å; E31-K51 WeakPolarHBondContact OE1-CD 3.47Å; E31-K51 WeakPolarHBondContact OE1-CE 3.15Å; E31-K51 IonicContact OE1-NZ 3.63Å; E31-K51 PolarHBondContact OE1-NZ 2.7Å; E31-K51 IonicContact OE2-NZ 3.98Å; E31-K51 PolarHBondContact OE2-NZ 3.24Å; E31-H350 HydrophobicContact CB-CB 4.06Å; E31-H350 HydrophobicContact CG-CB 3.76Å; E31-S351 VanDerWaalsContact CA-O 3.32Å; E31-S351 WeakPolarHBondContact CA-O 3.44Å; E31-N352 HydrophobicContact CB-CB 4.25Å
32	R	98.2	Very high	83.4	Confident	1 Å²	1	57.7 Å²	57.7	0%	0.004	31%	0.314	C	S	.	.			trans	-162.9	144.1	-173.5	58.6	-172.9	79.5	-162.2	6.9	114.6	A30 H35 G48 Y50 L63 F335 G337 S351	A30-R32 PolarHBondContact O-NE 3.05Å; A30-R32 PolarHBondContact O-NH2 3.25Å; R32-H35 HydrophobicContact CG-CB 4.08Å; R32-H35 PolarHBondContact O-ND1 3.4Å; R32-G48 WeakPolarHBondContact CD-O 3.24Å; R32-G48 PolarHBondContact NH1-O 2.8Å; R32-G48 VanDerWaalsContact NH1-O 3.09Å; R32-Y50 WeakPolarHBondContact CA-O 3.42Å; R32-L63 HydrophobicContact CB-CD2 3.54Å; R32-L63 HydrophobicContact CB-CG 4.45Å; R32-F335 HydrophobicContact CG-CE1 4.05Å; R32-G337 PolarHBondContact O-N 3.05Å; R32-S351 PolarHBondContact N-O 2.89Å
33	S	98.6	Very high	86.3	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	152.9	166	-67.2	0	0	0	0	111	H35 G49 Y50 G337 C338 H350	S33-H35 PolarHBondContact O-N 2.97Å; S33-G49 VanDerWaalsContact O-CA 3.24Å; S33-G49 WeakPolarHBondContact O-CA 3.23Å; S33-Y50 PolarHBondContact N-O 2.87Å; S33-Y50 VanDerWaalsContact O-CD1 3.3Å; S33-Y50 WeakPolarHBondContact O-CD1 3.26Å; S33-Y50 PolarHBondContact O-N 3.34Å; S33-G337 PolarHBondContact OG-O 3.3Å; S33-C338 WeakPolarHBondContact OG-CB 3.49Å; S33-C338 PolarHBondContact OG-N 3.46Å; S33-H350 WeakPolarHBondContact CB-ND1 3.46Å; S33-H350 PolarHBondContact OG-ND1 3.13Å
34	G	98.4	Very high	89.3	Confident	1 Å²	1	47 Å²	47	1%	0.01	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	64.9	20.5	176.9	0	0	0	0	0	115.8	S92 G93 W321	G34-S92 CarbonylContact O-C 3.53Å; G34-S92 VanDerWaalsContact O-CA 3.26Å; G34-S92 WeakPolarHBondContact O-CA 3.39Å; G34-G93 PolarHBondContact O-N 2.75Å; G34-W321 PolarHBondContact N-O 3.2Å
35	H	98.9	Very high	92.1	Very high	9 Å²	9	39.2 Å²	39.2	4%	0.042	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	168.7	165	62.5	-78.2	0	0	0	110	R32 S33 V46 W47 G48 T323 F335	R32-H35 HydrophobicContact CG-CB 4.08Å; R32-H35 PolarHBondContact O-ND1 3.4Å; S33-H35 PolarHBondContact O-N 2.97Å; H35-V46 HydrophobicContact CB-CG1 4.45Å; H35-W47 WeakPolarHBondContact CB-O 3.26Å; H35-G48 WeakPolarHBondContact CB-O 3.43Å; H35-T323 VanDerWaalsContact CD2-CG2 3.48Å; H35-T323 WeakPolarHBondContact CD2-CG2 3.47Å; H35-T323 VanDerWaalsContact NE2-CG2 3.31Å; H35-T323 WeakPolarHBondContact NE2-CG2 3.26Å; H35-T323 PolarHBondContact NE2-OG1 2.83Å; H35-T323 VanDerWaalsContact O-CG2 3.3Å; H35-T323 WeakPolarHBondContact O-CG2 3.4Å; H35-F335 AromaticContact CD2-CD1 3.92Å; H35-F335 AromaticContact CE1-CD1 4Å; H35-F335 PolarHBondContact CE1-O 3.39Å; H35-F335 AromaticContact NE2-CD1 3.34Å; H35-F335 VanDerWaalsContact NE2-CD1 3.34Å; H35-F335 WeakPolarHBondContact NE2-CD1 3.4Å; H35-F335 AromaticContact NE2-CE1 3.98Å; H35-F335 PolarHBondContact NE2-O 2.89Å
36	V	98.9	Very high	94.6	Very high	14 Å²	14	30.9 Å²	30.9	9%	0.085	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	147.1	167.9	-62.2	0	0	0	0	109.8	V46 W47 S94 A96 L105	V36-V46 WeakPolarHBondContact O-CA 3.38Å; V36-W47 HydrophobicContact CG2-CB 4.02Å; V36-W47 HydrophobicContact CG2-CE3 4.14Å; V36-W47 PolarHBondContact N-O 3.26Å; V36-W47 PolarHBondContact O-N 3.21Å; V36-W47 VanDerWaalsContact O-N 3.15Å; V36-S94 WeakPolarHBondContact CG1-O 3.24Å; V36-A96 HydrophobicContact CB-CB 3.74Å; V36-A96 HydrophobicContact CG1-CB 3.87Å; V36-A96 HydrophobicContact CG2-CB 3.92Å; V36-L105 HydrophobicContact CG1-CD1 4.1Å; V36-L105 HydrophobicContact CG2-CD1 4.09Å
37	A	98.9	Very high	96.6	Very high	16 Å²	16	24.9 Å²	24.9	13%	0.132	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	132.6	164.9	0	0	0	0	0	109.1	M44 F45 V46 T323	A37-M44 HydrophobicContact CB-CG 3.89Å; A37-M44 HydrophobicContact CB-SD 3.98Å; A37-F45 VanDerWaalsContact CA-O 3.25Å; A37-F45 WeakPolarHBondContact CA-O 3.48Å; A37-V46 HydrophobicContact CB-CG2 3.92Å; A37-T323 VanDerWaalsContact CB-CB 3.46Å; A37-T323 HydrophobicContact CB-CG2 3.87Å; A37-T323 WeakPolarHBondContact CB-OG1 3.42Å
38	V	98.8	Very high	97.4	Very high	10 Å²	10	22.4 Å²	22.4	6%	0.061	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	152.4	177.5	-61.8	0	0	0	0	108.8	M44 F45 A96 C98 L103	V38-M44 CarbonylContact O-C 3.59Å; V38-M44 WeakPolarHBondContact O-CA 3.35Å; V38-F45 HydrophobicContact CG2-CB 4.07Å; V38-F45 HydrophobicContact CG2-CD2 4.47Å; V38-F45 PolarHBondContact N-O 3.17Å; V38-F45 VanDerWaalsContact N-O 3.08Å; V38-F45 PolarHBondContact O-N 3.15Å; V38-A96 VanDerWaalsContact CG1-C 3.47Å; V38-A96 HydrophobicContact CG1-CB 3.67Å; V38-A96 WeakPolarHBondContact CG1-O 3.33Å; V38-C98 HydrophobicContact CB-CB 3.85Å; V38-C98 HydrophobicContact CG2-CB 3.92Å; V38-L103 HydrophobicContact CG2-CD2 3.91Å; V38-L103 HydrophobicContact CG2-CG 3.77Å
39	S	98.4	Very high	97.7	Very high	27 Å²	27	19.2 Å²	19.2	19%	0.189	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	149.6	-171.9	-177.6	0	0	0	0	111.7	G41 H43 M73	S39-G41 PolarHBondContact OG-N 3.35Å; S39-H43 VanDerWaalsContact CA-O 3.32Å; S39-H43 WeakPolarHBondContact CA-O 3.35Å; S39-H43 PolarHBondContact OG-O 3.31Å; S39-M73 VanDerWaalsContact OG-CE 3.26Å; S39-M73 WeakPolarHBondContact OG-CE 3.14Å
40	D	96	Very high	97.7	Very high	53 Å²	53	19.6 Å²	19.6	28%	0.283	10%	0.104	S	C	.	.	S	Bend	trans	-96.6	7.2	165.6	69.1	-2.5	0	0	0	112.7	R42 H43 R101	D40-R42 WeakPolarHBondContact OD1-CA 3.46Å; D40-R42 PolarHBondContact OD1-N 3.25Å; D40-H43 PolarHBondContact N-O 3.4Å; D40-H43 PolarHBondContact OD1-N 2.76Å; D40-H43 IonicContact OD1-ND1 2.79Å; D40-H43 IonicContact OD2-CG 3.26Å; D40-H43 IonicContact OD2-ND1 3.56Å; D40-H43 PolarHBondContact OD2-ND1 3.41Å; D40-H43 VanDerWaalsContact OD2-ND1 3.16Å; D40-R101 WeakPolarHBondContact OD2-CD 3.33Å; D40-R101 IonicContact OD2-CZ 3.86Å; D40-R101 IonicContact OD2-NE 2.93Å; D40-R101 IonicContact OD2-NH1 3.13Å; D40-R101 PolarHBondContact OD2-NH1 3.38Å
41	G	94	Very high	97.6	Very high	11 Å²	11	20.5 Å²	20.5	11%	0.113	10%	0.101	C	C	.	.	S	Bend	trans	98.9	-22.3	-173.6	0	0	0	0	0	114.2	S39 S327 D328	S39-G41 PolarHBondContact OG-N 3.35Å; G41-S327 CarbonylContact O-C 3.56Å; G41-S327 VanDerWaalsContact O-CA 3.27Å; G41-S327 WeakPolarHBondContact O-CA 3.33Å; G41-D328 WeakPolarHBondContact CA-OD1 3.37Å; G41-D328 PolarHBondContact O-N 3.07Å
42	R	93.8	Very high	97.1	Very high	118 Å²	118	18.7 Å²	18.7	45%	0.445	10%	0.095	S	C	.	.	S	Bend	trans	-120.8	-36.7	-178.5	179.8	179.8	-71	151.7	8.1	113.4	D40 M73 E74	D40-R42 WeakPolarHBondContact OD1-CA 3.46Å; D40-R42 PolarHBondContact OD1-N 3.25Å; R42-M73 WeakPolarHBondContact O-CB 3.36Å; R42-M73 WeakPolarHBondContact O-CG 3.34Å; R42-M73 PolarHBondContact O-N 3.31Å; R42-E74 HydrophobicContact CG-CG 4.28Å; R42-E74 IonicContact CZ-OE1 3.96Å; R42-E74 IonicContact NE-OE1 3.44Å; R42-E74 PolarHBondContact NE-OE1 2.71Å; R42-E74 IonicContact NH2-OE1 3.44Å
43	H	96.8	Very high	95.7	Very high	43 Å²	43	21.9 Å²	21.9	20%	0.199	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	123.2	-178	-53.3	94.2	0	0	0	109.5	S39 D40 F45 I70 Y71 R101	S39-H43 VanDerWaalsContact CA-O 3.32Å; S39-H43 WeakPolarHBondContact CA-O 3.35Å; S39-H43 PolarHBondContact OG-O 3.31Å; D40-H43 PolarHBondContact N-O 3.4Å; D40-H43 PolarHBondContact OD1-N 2.76Å; D40-H43 IonicContact OD1-ND1 2.79Å; D40-H43 IonicContact OD2-CG 3.26Å; D40-H43 IonicContact OD2-ND1 3.56Å; D40-H43 PolarHBondContact OD2-ND1 3.41Å; D40-H43 VanDerWaalsContact OD2-ND1 3.16Å; H43-F45 HydrophobicContact CB-CE2 4.03Å; H43-F45 HydrophobicContact CB-CZ 4.1Å; H43-I70 HydrophobicContact CB-CG2 4.1Å; H43-Y71 CarbonylContact C-O 3.47Å; H43-Y71 WeakPolarHBondContact CA-O 3.33Å; H43-R101 PolarHBondContact ND1-NH1 3.16Å
44	M	98.6	Very high	93.7	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	122.5	170.3	-168.3	171.4	60.8	0	0	109.5	A37 V38 V46 I70 Y71 M73 W78 C325 I333 F335 I354	A37-M44 HydrophobicContact CB-CG 3.89Å; A37-M44 HydrophobicContact CB-SD 3.98Å; V38-M44 CarbonylContact O-C 3.59Å; V38-M44 WeakPolarHBondContact O-CA 3.35Å; M44-V46 HydrophobicContact CE-CG2 4.08Å; M44-V46 HydrophobicContact CG-CG2 4.12Å; M44-I70 CarbonylContact O-C 3.55Å; M44-I70 WeakPolarHBondContact O-CA 3.35Å; M44-Y71 HydrophobicContact CB-CD1 4.49Å; M44-Y71 HydrophobicContact CE-CD1 4.03Å; M44-Y71 HydrophobicContact CE-CG 4.25Å; M44-Y71 PolarHBondContact N-O 3.3Å; M44-Y71 PolarHBondContact O-N 2.82Å; M44-M73 HydrophobicContact CB-CE 3.66Å; M44-M73 HydrophobicContact CG-CE 4.19Å; M44-M73 HydrophobicContact SD-CE 4.26Å; M44-W78 HydrophobicContact CE-CH2 4Å; M44-C325 HydrophobicContact CG-CB 4.22Å; M44-C325 HydrophobicContact SD-CB 3.95Å; M44-I333 HydrophobicContact CE-CG2 4Å; M44-I333 HydrophobicContact SD-CG2 4.26Å; M44-F335 HydrophobicContact CE-CB 3.81Å; M44-F335 HydrophobicContact CE-CG 4.32Å; M44-I354 HydrophobicContact CE-CD1 3.79Å
45	F	98.7	Very high	91.6	Very high	4 Å²	4	36.5 Å²	36.5	2%	0.018	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	122.7	175.8	-57.2	-92.3	0	0	0	109.3	A37 V38 H43 L68 W69 I70 L103	A37-F45 VanDerWaalsContact CA-O 3.25Å; A37-F45 WeakPolarHBondContact CA-O 3.48Å; V38-F45 HydrophobicContact CG2-CB 4.07Å; V38-F45 HydrophobicContact CG2-CD2 4.47Å; V38-F45 PolarHBondContact N-O 3.17Å; V38-F45 VanDerWaalsContact N-O 3.08Å; V38-F45 PolarHBondContact O-N 3.15Å; H43-F45 HydrophobicContact CB-CE2 4.03Å; H43-F45 HydrophobicContact CB-CZ 4.1Å; F45-L68 HydrophobicContact CB-CD1 4.27Å; F45-L68 HydrophobicContact CD1-CD2 3.96Å; F45-W69 CarbonylContact C-O 3.56Å; F45-W69 WeakPolarHBondContact CA-O 3.35Å; F45-I70 HydrophobicContact CD1-CD1 4.1Å; F45-I70 HydrophobicContact CD1-CG1 3.84Å; F45-I70 HydrophobicContact CD1-CG2 4.45Å; F45-I70 HydrophobicContact CE1-CD1 3.9Å; F45-I70 HydrophobicContact CE1-CG1 4.1Å; F45-I70 HydrophobicContact CE1-CG2 4.32Å; F45-L103 HydrophobicContact CB-CD2 3.68Å; F45-L103 HydrophobicContact CD1-CD2 4.31Å; F45-L103 HydrophobicContact CD2-CD1 4.27Å; F45-L103 HydrophobicContact CE2-CD1 4.46Å; F45-L103 HydrophobicContact CG-CD1 4.33Å; F45-L103 HydrophobicContact CG-CD2 3.94Å
46	V	98.9	Very high	89	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	127.1	-175.8	179.8	0	0	0	0	110.8	H35 V36 A37 M44 W69 W78 F335	H35-V46 HydrophobicContact CB-CG1 4.45Å; V36-V46 WeakPolarHBondContact O-CA 3.38Å; A37-V46 HydrophobicContact CB-CG2 3.92Å; M44-V46 HydrophobicContact CE-CG2 4.08Å; M44-V46 HydrophobicContact CG-CG2 4.12Å; V46-W69 HydrophobicContact CB-CB 4.21Å; V46-W69 PolarHBondContact N-O 2.91Å; V46-W69 PolarHBondContact O-N 3.12Å; V46-W78 HydrophobicContact CB-CZ3 4.24Å; V46-W78 HydrophobicContact CG2-CH2 3.91Å; V46-W78 HydrophobicContact CG2-CZ3 3.9Å; V46-F335 HydrophobicContact CB-CE1 4.48Å; V46-F335 HydrophobicContact CG1-CD1 3.89Å; V46-F335 HydrophobicContact CG1-CE1 3.65Å; V46-F335 HydrophobicContact CG2-CD1 3.98Å; V46-F335 HydrophobicContact CG2-CE1 4.35Å
47	W	98.9	Very high	86.6	Confident	4 Å²	4	47.8 Å²	47.8	2%	0.015	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	147.8	-177.9	-178.8	87.9	0	0	0	112.3	H35 V36 R65 L68 P88 P89 M91 L105 W132	H35-W47 WeakPolarHBondContact CB-O 3.26Å; V36-W47 HydrophobicContact CG2-CB 4.02Å; V36-W47 HydrophobicContact CG2-CE3 4.14Å; V36-W47 PolarHBondContact N-O 3.26Å; V36-W47 PolarHBondContact O-N 3.21Å; V36-W47 VanDerWaalsContact O-N 3.15Å; W47-R65 PolarHBondContact NE1-O 2.85Å; W47-L68 HydrophobicContact CB-CD1 3.87Å; W47-P88 HydrophobicContact CH2-CB 4.07Å; W47-P88 HydrophobicContact CH2-CG 4.02Å; W47-P88 HydrophobicContact CZ2-CB 3.98Å; W47-P88 HydrophobicContact CZ2-CG 3.57Å; W47-P89 WeakPolarHBondContact CH2-O 3.34Å; W47-P89 WeakPolarHBondContact CZ2-O 3.28Å; W47-M91 HydrophobicContact CH2-CB 4.04Å; W47-M91 HydrophobicContact CH2-CE 3.69Å; W47-M91 HydrophobicContact CZ3-CB 4.16Å; W47-M91 HydrophobicContact CZ3-CE 4.12Å; W47-L105 HydrophobicContact CE3-CD1 4.34Å; W47-L105 HydrophobicContact CE3-CD2 4.07Å; W47-L105 HydrophobicContact CH2-CD2 4.09Å; W47-L105 HydrophobicContact CZ3-CD1 4.39Å; W47-L105 HydrophobicContact CZ3-CD2 3.76Å; W47-W132 HydrophobicContact CG-CZ2 4.36Å
48	G	98.6	Very high	84.4	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	68.5	-147.5	172.1	0	0	0	0	0	114	R32 H35	R32-G48 WeakPolarHBondContact CD-O 3.24Å; R32-G48 PolarHBondContact NH1-O 2.8Å; R32-G48 VanDerWaalsContact NH1-O 3.09Å; H35-G48 WeakPolarHBondContact CB-O 3.43Å
49	G	98.4	Very high	82.6	Confident	0 Å²	0	62 Å²	62	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	85.7	-179.5	-170.5	0	0	0	0	0	112.8	S33 Y62 L63 M91	S33-G49 VanDerWaalsContact O-CA 3.24Å; S33-G49 WeakPolarHBondContact O-CA 3.23Å; G49-Y62 WeakPolarHBondContact O-CA 3.43Å; G49-L63 VanDerWaalsContact O-CD2 3.26Å; G49-L63 WeakPolarHBondContact O-CD2 3.19Å; G49-L63 PolarHBondContact O-N 3.16Å; G49-M91 PolarHBondContact N-O 2.85Å
50	Y	97.1	Very high	81.6	Confident	10 Å²	10	63.3 Å²	63.3	4%	0.039	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	165.6	177.4	81.9	-77	0	0	0	111.1	R32 S33 D60 F61 W321 H350	R32-Y50 WeakPolarHBondContact CA-O 3.42Å; S33-Y50 PolarHBondContact N-O 2.87Å; S33-Y50 VanDerWaalsContact O-CD1 3.3Å; S33-Y50 WeakPolarHBondContact O-CD1 3.26Å; S33-Y50 PolarHBondContact O-N 3.34Å; Y50-D60 HydrophobicContact CD2-CB 3.58Å; Y50-D60 VanDerWaalsContact CD2-CG 3.43Å; Y50-D60 HydrophobicContact CE2-CB 3.99Å; Y50-D60 WeakPolarHBondContact CE2-OD1 3.23Å; Y50-D60 WeakPolarHBondContact CE2-OD2 3.44Å; Y50-F61 CarbonylContact C-O 3.48Å; Y50-F61 VanDerWaalsContact CA-O 3.24Å; Y50-F61 WeakPolarHBondContact CA-O 3.27Å; Y50-F61 WeakPolarHBondContact CB-O 3.47Å; Y50-W321 HydrophobicContact CD1-CZ3 4.47Å; Y50-W321 AromaticContact CE1-CE3 3.93Å; Y50-W321 HydrophobicContact CE1-CE3 3.93Å; Y50-W321 HydrophobicContact CE1-CH2 4.02Å; Y50-W321 AromaticContact CE1-CZ3 3.47Å; Y50-W321 HydrophobicContact CE1-CZ3 3.47Å; Y50-W321 VanDerWaalsContact CE1-CZ3 3.47Å; Y50-H350 AromaticContact CE2-CE1 3.64Å; Y50-H350 AromaticContact CE2-NE2 3.9Å; Y50-H350 AromaticContact CZ-CE1 3.76Å
51	K	93.4	Very high	81.2	Confident	51 Å²	51	66.4 Å²	66.4	22%	0.222	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	165.5	169.9	69.2	-178.4	-157.5	159.1	0	111.7	E31 F61 L63	E31-K51 HydrophobicContact CG-CB 4.34Å; E31-K51 HydrophobicContact CG-CD 4.05Å; E31-K51 WeakPolarHBondContact O-CD 3.42Å; E31-K51 VanDerWaalsContact OE1-CD 3.3Å; E31-K51 WeakPolarHBondContact OE1-CD 3.47Å; E31-K51 WeakPolarHBondContact OE1-CE 3.15Å; E31-K51 IonicContact OE1-NZ 3.63Å; E31-K51 PolarHBondContact OE1-NZ 2.7Å; E31-K51 IonicContact OE2-NZ 3.98Å; E31-K51 PolarHBondContact OE2-NZ 3.24Å; K51-F61 PolarHBondContact N-O 3.45Å; K51-F61 PolarHBondContact O-N 2.95Å; K51-L63 HydrophobicContact CD-CD1 4.09Å; K51-L63 HydrophobicContact CG-CD1 4.31Å
52	S	87.4	Confident	81.3	Confident	21 Å²	21	68 Å²	68	15%	0.147	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	144.7	172.1	59	0	0	0	0	111.2	H350	S52-H350 PolarHBondContact N-CD2 2.88Å; S52-H350 VanDerWaalsContact N-CD2 3.35Å; S52-H350 PolarHBondContact N-NE2 3.44Å
53	N	68.5	Low	81.4	Confident	68 Å²	68	62.7 Å²	62.7	36%	0.364	30%	0.303	S	S	.	.			trans	-101.5	108.7	172.2	-172.6	-13.3	0	0	0	110	V55 R56	N53-V55 VanDerWaalsContact C-N 3.25Å; N53-V55 PolarHBondContact O-N 3.05Å; N53-V55 PolarHBondContact OD1-N 3.07Å; N53-R56 PolarHBondContact OD1-N 3.49Å
54	Q	57	Low	81.5	Confident	182 Å²	182	62.5 Å²	62.5	85%	0.85	31%	0.306	S	S	*	.	S	Bend	trans	-71.8	-16.4	179.1	-66.4	-171.4	5.2	0	0	113.6
55	V	53.3	Low	81.4	Confident	126 Å²	126	67.5 Å²	67.5	76%	0.764	33%	0.325	S	S	*	.	S	Bend	trans	-103.7	-21.6	-165.8	-176.3	0	0	0	0	113.7	N53	N53-V55 VanDerWaalsContact C-N 3.25Å; N53-V55 PolarHBondContact O-N 3.05Å; N53-V55 PolarHBondContact OD1-N 3.07Å
56	R	44.7	Very low	81.4	Confident	214 Å²	214	71.1 Å²	71.1	81%	0.808	34%	0.341	S	S	*	.	S	Bend	trans	-129.2	30.1	-173.6	-68.5	-168.2	177.4	-167.4	0.6	115.8	N53	N53-R56 PolarHBondContact OD1-N 3.49Å
57	G	47.5	Very low	81.4	Confident	45 Å²	45	72.4 Å²	72.4	46%	0.464	35%	0.348	S	S	.	.			trans	88.6	175.3	174.5	0	0	0	0	0	114.2	Y59	G57-Y59 PolarHBondContact O-N 2.88Å
58	L	53.8	Low	81.3	Confident	140 Å²	140	72.2 Å²	72.2	73%	0.733	35%	0.347	S	S	*	.	S	Bend	trans	-63.4	25	-156	-67.6	156.6	0	0	0	117.9	H346	L58-H346 HydrophobicContact CD2-CB 4.22Å
59	Y	61.5	Low	81.3	Confident	184 Å²	184	72.9 Å²	72.9	72%	0.722	35%	0.349	S	S	*	.			trans	-113.8	132.4	-170.7	-56.8	-74.6	0	0	0	113	G57	G57-Y59 PolarHBondContact O-N 2.88Å
60	D	75.9	Confident	81.3	Confident	56 Å²	56	74.2 Å²	74.2	30%	0.299	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	137.1	167	-72.6	-16.6	0	0	0	110.5	Y50 H345	Y50-D60 HydrophobicContact CD2-CB 3.58Å; Y50-D60 VanDerWaalsContact CD2-CG 3.43Å; Y50-D60 HydrophobicContact CE2-CB 3.99Å; Y50-D60 WeakPolarHBondContact CE2-OD1 3.23Å; Y50-D60 WeakPolarHBondContact CE2-OD2 3.44Å; D60-H345 IonicContact OD1-CD2 3.58Å; D60-H345 IonicContact OD2-CD2 3.21Å; D60-H345 PolarHBondContact OD2-CD2 3.31Å; D60-H345 IonicContact OD2-NE2 3.67Å
61	F	87.9	Confident	81.3	Confident	117 Å²	117	74.3 Å²	74.3	51%	0.513	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	125.7	176.9	-179.4	-98.5	0	0	0	110.3	Y50 K51	Y50-F61 CarbonylContact C-O 3.48Å; Y50-F61 VanDerWaalsContact CA-O 3.24Å; Y50-F61 WeakPolarHBondContact CA-O 3.27Å; Y50-F61 WeakPolarHBondContact CB-O 3.47Å; K51-F61 PolarHBondContact N-O 3.45Å; K51-F61 PolarHBondContact O-N 2.95Å
62	Y	96.2	Very high	81.4	Confident	46 Å²	46	73 Å²	73	18%	0.18	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	141	173.9	-61.3	-83.5	0	0	0	111	G49 H109	G49-Y62 WeakPolarHBondContact O-CA 3.43Å; Y62-H109 WeakPolarHBondContact CE1-O 3.21Å; Y62-H109 PolarHBondContact OH-ND1 2.9Å; Y62-H109 PolarHBondContact OH-O 2.93Å
63	L	97.1	Very high	81.6	Confident	5 Å²	5	72.4 Å²	72.4	3%	0.026	35%	0.347	C	S	.	.	P	Polyproline II helix	trans	-67.2	157.6	179.2	-73.7	-38.8	0	0	0	111.9	A30 R32 G49 K51 R65 S90	A30-L63 HydrophobicContact CB-CD1 4.3Å; R32-L63 HydrophobicContact CB-CD2 3.54Å; R32-L63 HydrophobicContact CB-CG 4.45Å; G49-L63 VanDerWaalsContact O-CD2 3.26Å; G49-L63 WeakPolarHBondContact O-CD2 3.19Å; G49-L63 PolarHBondContact O-N 3.16Å; K51-L63 HydrophobicContact CD-CD1 4.09Å; K51-L63 HydrophobicContact CG-CD1 4.31Å; L63-R65 PolarHBondContact O-N 3.4Å; L63-S90 WeakPolarHBondContact O-CB 3.37Å; L63-S90 PolarHBondContact O-OG 2.89Å
64	P	97.9	Very high	82.5	Confident	39 Å²	39	70.9 Å²	70.9	25%	0.253	34%	0.337	S	S	.	.	P	Polyproline II helix	trans	-52.5	132.2	-179.3	-27.3	35.8	0	0	0	112.2	E67	P64-E67 HydrophobicContact CB-CB 4.41Å; P64-E67 HydrophobicContact CB-CG 3.87Å; P64-E67 HydrophobicContact CG-CG 4.46Å
65	R	97.8	Very high	83.8	Confident	106 Å²	106	62.7 Å²	62.7	40%	0.4	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-28.4	-171.3	58.7	-168.9	-66.8	-166.2	-3.3	113.4	W47 L63 E67 V87 P88 S90	W47-R65 PolarHBondContact NE1-O 2.85Å; L63-R65 PolarHBondContact O-N 3.4Å; R65-E67 VanDerWaalsContact C-N 3.34Å; R65-V87 HydrophobicContact CB-CG1 4.05Å; R65-V87 HydrophobicContact CG-CG1 3.95Å; R65-V87 PolarHBondContact NH2-O 2.93Å; R65-V87 VanDerWaalsContact O-CG1 3.26Å; R65-V87 WeakPolarHBondContact O-CG1 3.4Å; R65-P88 WeakPolarHBondContact CB-O 3.27Å; R65-P88 PolarHBondContact NE-O 3.39Å; R65-P88 PolarHBondContact NH2-O 2.94Å; R65-S90 WeakPolarHBondContact CB-OG 3.3Å; R65-S90 PolarHBondContact N-OG 3.33Å
66	E	97.8	Very high	85.4	Confident	79 Å²	79	58.5 Å²	58.5	37%	0.369	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-18.9	-178.5	66.6	-80.3	-169.8	0	0	112.2	L68 N82 T83	E66-L68 PolarHBondContact O-N 3.31Å; E66-N82 CarbonylContact O-C 3.54Å; E66-N82 WeakPolarHBondContact O-CA 3.44Å; E66-T83 PolarHBondContact O-N 2.96Å; E66-T83 PolarHBondContact O-OG1 2.85Å
67	E	97.9	Very high	87.5	Confident	28 Å²	28	54.1 Å²	54.1	13%	0.131	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	118.3	-176.7	-70.6	-171.6	167.7	0	0	112.3	P64 R65 W69 K80	P64-E67 HydrophobicContact CB-CB 4.41Å; P64-E67 HydrophobicContact CB-CG 3.87Å; P64-E67 HydrophobicContact CG-CG 4.46Å; R65-E67 VanDerWaalsContact C-N 3.34Å; E67-W69 PolarHBondContact OE2-NE1 3.4Å; E67-K80 HydrophobicContact CG-CD 3.96Å; E67-K80 HydrophobicContact CG-CG 4.43Å; E67-K80 WeakPolarHBondContact OE1-CD 3.47Å; E67-K80 IonicContact OE1-NZ 3.16Å; E67-K80 PolarHBondContact OE1-NZ 2.76Å
68	L	98.3	Very high	89.9	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	121.9	162.5	-172.8	70	0	0	0	109.2	F45 W47 E66 I81 T83 L103 L121 L130	F45-L68 HydrophobicContact CB-CD1 4.27Å; F45-L68 HydrophobicContact CD1-CD2 3.96Å; W47-L68 HydrophobicContact CB-CD1 3.87Å; E66-L68 PolarHBondContact O-N 3.31Å; L68-I81 HydrophobicContact CB-CD1 4.36Å; L68-I81 HydrophobicContact CB-CG1 3.83Å; L68-I81 HydrophobicContact CD2-CD1 3.99Å; L68-I81 HydrophobicContact CD2-CG1 4.36Å; L68-I81 HydrophobicContact CG-CG1 4.45Å; L68-I81 PolarHBondContact N-O 2.92Å; L68-I81 WeakPolarHBondContact O-CG1 3.38Å; L68-I81 PolarHBondContact O-N 3.3Å; L68-T83 HydrophobicContact CB-CG2 3.9Å; L68-L103 HydrophobicContact CD1-CD2 4.48Å; L68-L121 HydrophobicContact CD2-CD2 3.72Å; L68-L130 HydrophobicContact CD2-CD1 4.01Å
69	W	98.5	Very high	91.8	Very high	14 Å²	14	53.6 Å²	53.6	5%	0.053	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	127.9	177	-75.3	86.4	0	0	0	109.7	A27 C28 P29 F45 V46 E67 W78 K80	A27-W69 HydrophobicContact CB-CH2 4.45Å; A27-W69 HydrophobicContact CB-CZ3 4.17Å; C28-W69 VanDerWaalsContact O-CH2 3.3Å; C28-W69 WeakPolarHBondContact O-CH2 3.29Å; P29-W69 HydrophobicContact CB-CD2 3.66Å; P29-W69 HydrophobicContact CB-CE3 3.92Å; P29-W69 HydrophobicContact CB-CG 3.95Å; P29-W69 HydrophobicContact CB-CZ2 4.34Å; P29-W69 HydrophobicContact CB-CZ3 4.37Å; P29-W69 HydrophobicContact CG-CD2 4.47Å; P29-W69 HydrophobicContact CG-CE3 4.31Å; F45-W69 CarbonylContact C-O 3.56Å; F45-W69 WeakPolarHBondContact CA-O 3.35Å; V46-W69 HydrophobicContact CB-CB 4.21Å; V46-W69 PolarHBondContact N-O 2.91Å; V46-W69 PolarHBondContact O-N 3.12Å; E67-W69 PolarHBondContact OE2-NE1 3.4Å; W69-W78 HydrophobicContact CB-CE3 3.94Å; W69-W78 HydrophobicContact CB-CZ3 3.87Å; W69-W78 HydrophobicContact CE3-CB 4.18Å; W69-W78 HydrophobicContact CE3-CE3 4.14Å; W69-W78 HydrophobicContact CZ3-CB 4.23Å; W69-K80 HydrophobicContact CD2-CB 4.13Å; W69-K80 HydrophobicContact CD2-CG 4.2Å; W69-K80 HydrophobicContact CE3-CB 4.01Å; W69-K80 HydrophobicContact CH2-CB 3.96Å; W69-K80 HydrophobicContact CH2-CD 4.02Å; W69-K80 HydrophobicContact CH2-CG 4.38Å; W69-K80 HydrophobicContact CZ2-CB 4.06Å; W69-K80 HydrophobicContact CZ2-CD 3.43Å; W69-K80 VanDerWaalsContact CZ2-CD 3.43Å; W69-K80 HydrophobicContact CZ2-CG 3.97Å; W69-K80 HydrophobicContact CZ3-CB 3.92Å
70	I	97.7	Very high	93.4	Very high	27 Å²	27	49.1 Å²	49.1	14%	0.138	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	117.6	-179.6	-52.8	178.5	0	0	0	108	H43 M44 F45 W78 K79 I81	H43-I70 HydrophobicContact CB-CG2 4.1Å; M44-I70 CarbonylContact O-C 3.55Å; M44-I70 WeakPolarHBondContact O-CA 3.35Å; F45-I70 HydrophobicContact CD1-CD1 4.1Å; F45-I70 HydrophobicContact CD1-CG1 3.84Å; F45-I70 HydrophobicContact CD1-CG2 4.45Å; F45-I70 HydrophobicContact CE1-CD1 3.9Å; F45-I70 HydrophobicContact CE1-CG1 4.1Å; F45-I70 HydrophobicContact CE1-CG2 4.32Å; I70-W78 CarbonylContact O-C 3.59Å; I70-W78 VanDerWaalsContact O-CA 3.32Å; I70-W78 WeakPolarHBondContact O-CA 3.4Å; I70-K79 PolarHBondContact N-O 3.25Å; I70-K79 PolarHBondContact O-N 3.08Å; I70-I81 HydrophobicContact CD1-CD1 3.79Å; I70-I81 HydrophobicContact CD1-CG1 4.28Å
71	Y	97.6	Very high	94.3	Very high	12 Å²	12	48 Å²	48	5%	0.047	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	120.9	172.7	178.7	-104.5	0	0	0	109.7	H43 M44 M73 G76 W78 I333 I354	H43-Y71 CarbonylContact C-O 3.47Å; H43-Y71 WeakPolarHBondContact CA-O 3.33Å; M44-Y71 HydrophobicContact CB-CD1 4.49Å; M44-Y71 HydrophobicContact CE-CD1 4.03Å; M44-Y71 HydrophobicContact CE-CG 4.25Å; M44-Y71 PolarHBondContact N-O 3.3Å; M44-Y71 PolarHBondContact O-N 2.82Å; Y71-M73 HydrophobicContact CD1-CG 3.99Å; Y71-M73 HydrophobicContact CE1-CB 4.43Å; Y71-M73 HydrophobicContact CE1-CG 4.18Å; Y71-M73 PolarHBondContact O-N 3.46Å; Y71-G76 VanDerWaalsContact CE2-C 3.42Å; Y71-G76 WeakPolarHBondContact CE2-O 3.49Å; Y71-G76 WeakPolarHBondContact OH-CA 3.46Å; Y71-W78 AromaticContact CD2-CD1 3.91Å; Y71-W78 AromaticContact CD2-CD2 3.76Å; Y71-W78 HydrophobicContact CD2-CD2 3.76Å; Y71-W78 AromaticContact CD2-CE2 3.45Å; Y71-W78 VanDerWaalsContact CD2-CE2 3.45Å; Y71-W78 HydrophobicContact CD2-CE3 4.41Å; Y71-W78 HydrophobicContact CD2-CG 4.05Å; Y71-W78 HydrophobicContact CD2-CH2 4.49Å; Y71-W78 AromaticContact CD2-CZ2 3.86Å; Y71-W78 HydrophobicContact CD2-CZ2 3.86Å; Y71-W78 AromaticContact CD2-NE1 3.54Å; Y71-W78 AromaticContact CE2-NE1 3.93Å; Y71-W78 HydrophobicContact CG-CD2 4.3Å; Y71-W78 HydrophobicContact CG-CH2 4.36Å; Y71-W78 HydrophobicContact CG-CZ2 4.13Å; Y71-I333 HydrophobicContact CD1-CG2 4.26Å; Y71-I333 HydrophobicContact CE1-CG2 3.85Å; Y71-I354 HydrophobicContact CD1-CD1 4.46Å; Y71-I354 HydrophobicContact CE1-CD1 4.31Å; Y71-I354 HydrophobicContact CE2-CD1 4.38Å; Y71-I354 HydrophobicContact CE2-CG1 4.11Å
72	N	94.6	Very high	94.8	Very high	23 Å²	23	46.8 Å²	46.8	12%	0.123	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81	112.9	170.1	-179.4	-39.8	0	0	0	108.6	E74 T75 G76 R77	N72-E74 VanDerWaalsContact C-N 3.26Å; N72-E74 PolarHBondContact O-N 3.44Å; N72-E74 WeakPolarHBondContact OD1-CA 3.47Å; N72-E74 WeakPolarHBondContact OD1-CB 3.39Å; N72-E74 PolarHBondContact OD1-N 3.42Å; N72-T75 WeakPolarHBondContact CB-OG1 3.47Å; N72-T75 PolarHBondContact O-N 2.72Å; N72-T75 PolarHBondContact OD1-N 3.44Å; N72-G76 WeakPolarHBondContact O-CA 3.09Å; N72-G76 PolarHBondContact O-N 3.32Å; N72-R77 PolarHBondContact N-O 3.2Å
73	M	93.1	Very high	94.8	Very high	10 Å²	10	44.9 Å²	44.9	5%	0.049	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-22.6	-176.8	-61	-176.4	169.5	0	0	113	S39 R42 M44 Y71 C325 S327 I333	S39-M73 VanDerWaalsContact OG-CE 3.26Å; S39-M73 WeakPolarHBondContact OG-CE 3.14Å; R42-M73 WeakPolarHBondContact O-CB 3.36Å; R42-M73 WeakPolarHBondContact O-CG 3.34Å; R42-M73 PolarHBondContact O-N 3.31Å; M44-M73 HydrophobicContact CB-CE 3.66Å; M44-M73 HydrophobicContact CG-CE 4.19Å; M44-M73 HydrophobicContact SD-CE 4.26Å; Y71-M73 HydrophobicContact CD1-CG 3.99Å; Y71-M73 HydrophobicContact CE1-CB 4.43Å; Y71-M73 HydrophobicContact CE1-CG 4.18Å; Y71-M73 PolarHBondContact O-N 3.46Å; M73-C325 HydrophobicContact CE-CB 3.49Å; M73-C325 VanDerWaalsContact CE-CB 3.49Å; M73-S327 VanDerWaalsContact SD-CB 3.57Å; M73-I333 HydrophobicContact CE-CB 4.18Å; M73-I333 HydrophobicContact CE-CG1 3.91Å; M73-I333 HydrophobicContact CG-CG1 4.01Å; M73-I333 HydrophobicContact SD-CG1 3.83Å
74	E	86.1	Confident	94.8	Very high	35 Å²	35	49.6 Å²	49.6	16%	0.164	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.6	-37.9	177.4	-64.3	-179.1	-166	0	0	112.3	R42 N72	R42-E74 HydrophobicContact CG-CG 4.28Å; R42-E74 IonicContact CZ-OE1 3.96Å; R42-E74 IonicContact NE-OE1 3.44Å; R42-E74 PolarHBondContact NE-OE1 2.71Å; R42-E74 IonicContact NH2-OE1 3.44Å; N72-E74 VanDerWaalsContact C-N 3.26Å; N72-E74 PolarHBondContact O-N 3.44Å; N72-E74 WeakPolarHBondContact OD1-CA 3.47Å; N72-E74 WeakPolarHBondContact OD1-CB 3.39Å; N72-E74 PolarHBondContact OD1-N 3.42Å
75	T	84.1	Confident	94.8	Very high	11 Å²	11	50.1 Å²	50.1	7%	0.067	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.1	-11.6	-174.6	75.5	0	0	0	0	113.5	N72 R77 Q396 S400	N72-T75 WeakPolarHBondContact CB-OG1 3.47Å; N72-T75 PolarHBondContact O-N 2.72Å; N72-T75 PolarHBondContact OD1-N 3.44Å; T75-R77 PolarHBondContact O-N 3.13Å; T75-R77 WeakPolarHBondContact OG1-CB 3.38Å; T75-R77 PolarHBondContact OG1-N 2.99Å; T75-Q396 HydrophobicContact CG2-CB 3.67Å; T75-Q396 HydrophobicContact CG2-CG 4.41Å; T75-S400 WeakPolarHBondContact O-CB 3.34Å
76	G	88.4	Confident	94.8	Very high	38 Å²	38	49 Å²	49	39%	0.392	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	65	21.2	-175.2	0	0	0	0	0	114.9	Y71 N72	Y71-G76 VanDerWaalsContact CE2-C 3.42Å; Y71-G76 WeakPolarHBondContact CE2-O 3.49Å; Y71-G76 WeakPolarHBondContact OH-CA 3.46Å; N72-G76 WeakPolarHBondContact O-CA 3.09Å; N72-G76 PolarHBondContact O-N 3.32Å
77	R	89.1	Confident	94.9	Very high	122 Å²	122	46.3 Å²	46.3	46%	0.46	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	143.4	-176.2	-70.6	-177.8	169.8	-156.8	-4.2	111.3	N72 T75 G399	N72-R77 PolarHBondContact N-O 3.2Å; T75-R77 PolarHBondContact O-N 3.13Å; T75-R77 WeakPolarHBondContact OG1-CB 3.38Å; T75-R77 PolarHBondContact OG1-N 2.99Å; R77-G399 VanDerWaalsContact NH2-CA 3.35Å; R77-G399 PolarHBondContact NH2-O 2.89Å
78	W	95.9	Very high	94.9	Very high	38 Å²	38	45 Å²	45	14%	0.144	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	148.2	173.8	-70.3	98.4	0	0	0	111.2	A27 P29 M44 V46 W69 I70 Y71 F335 I354	A27-W78 WeakPolarHBondContact O-CB 3.29Å; P29-W78 VanDerWaalsContact CD-CD2 3.45Å; P29-W78 HydrophobicContact CG-CD2 3.73Å; P29-W78 HydrophobicContact CG-CE3 3.91Å; P29-W78 HydrophobicContact CG-CG 4.37Å; P29-W78 HydrophobicContact CG-CH2 3.86Å; P29-W78 HydrophobicContact CG-CZ2 3.66Å; P29-W78 HydrophobicContact CG-CZ3 3.97Å; M44-W78 HydrophobicContact CE-CH2 4Å; V46-W78 HydrophobicContact CB-CZ3 4.24Å; V46-W78 HydrophobicContact CG2-CH2 3.91Å; V46-W78 HydrophobicContact CG2-CZ3 3.9Å; W69-W78 HydrophobicContact CB-CE3 3.94Å; W69-W78 HydrophobicContact CB-CZ3 3.87Å; W69-W78 HydrophobicContact CE3-CB 4.18Å; W69-W78 HydrophobicContact CE3-CE3 4.14Å; W69-W78 HydrophobicContact CZ3-CB 4.23Å; I70-W78 CarbonylContact O-C 3.59Å; I70-W78 VanDerWaalsContact O-CA 3.32Å; I70-W78 WeakPolarHBondContact O-CA 3.4Å; Y71-W78 AromaticContact CD2-CD1 3.91Å; Y71-W78 AromaticContact CD2-CD2 3.76Å; Y71-W78 HydrophobicContact CD2-CD2 3.76Å; Y71-W78 AromaticContact CD2-CE2 3.45Å; Y71-W78 VanDerWaalsContact CD2-CE2 3.45Å; Y71-W78 HydrophobicContact CD2-CE3 4.41Å; Y71-W78 HydrophobicContact CD2-CG 4.05Å; Y71-W78 HydrophobicContact CD2-CH2 4.49Å; Y71-W78 AromaticContact CD2-CZ2 3.86Å; Y71-W78 HydrophobicContact CD2-CZ2 3.86Å; Y71-W78 AromaticContact CD2-NE1 3.54Å; Y71-W78 AromaticContact CE2-NE1 3.93Å; Y71-W78 HydrophobicContact CG-CD2 4.3Å; Y71-W78 HydrophobicContact CG-CH2 4.36Å; Y71-W78 HydrophobicContact CG-CZ2 4.13Å; W78-F335 HydrophobicContact CH2-CD1 4.07Å; W78-F335 AromaticContact CH2-CD2 3.77Å; W78-F335 HydrophobicContact CH2-CD2 3.77Å; W78-F335 HydrophobicContact CH2-CE1 4.03Å; W78-F335 AromaticContact CH2-CE2 3.67Å; W78-F335 HydrophobicContact CH2-CE2 3.67Å; W78-F335 AromaticContact CH2-CG 3.97Å; W78-F335 HydrophobicContact CH2-CG 3.97Å; W78-F335 AromaticContact CH2-CZ 3.84Å; W78-F335 HydrophobicContact CH2-CZ 3.84Å; W78-F335 AromaticContact CZ2-CD2 3.53Å; W78-F335 HydrophobicContact CZ2-CD2 3.53Å; W78-F335 AromaticContact CZ2-CE2 3.39Å; W78-F335 HydrophobicContact CZ2-CE2 3.39Å; W78-F335 HydrophobicContact CZ2-CG 4.17Å; W78-F335 AromaticContact CZ2-CZ 3.99Å; W78-F335 HydrophobicContact CZ2-CZ 3.99Å; W78-I354 HydrophobicContact CH2-CD1 4.47Å; W78-I354 HydrophobicContact CZ2-CD1 3.8Å; W78-I354 HydrophobicContact CZ2-CG1 3.99Å
79	K	94.7	Very high	94.9	Very high	135 Å²	135	46.3 Å²	46.3	59%	0.587	24%	0.241	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-132.7	126.1	168	179.6	-179.8	178.9	-178	0	108	I70 I81	I70-K79 PolarHBondContact N-O 3.25Å; I70-K79 PolarHBondContact O-N 3.08Å; K79-I81 HydrophobicContact CD-CG2 4.3Å; K79-I81 HydrophobicContact CG-CG2 4.24Å
80	K	95.9	Very high	94.9	Very high	91 Å²	91	46.9 Å²	46.9	40%	0.396	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	136	169.2	-169.8	173.5	91	167.1	0	109.6	E67 W69	E67-K80 HydrophobicContact CG-CD 3.96Å; E67-K80 HydrophobicContact CG-CG 4.43Å; E67-K80 WeakPolarHBondContact OE1-CD 3.47Å; E67-K80 IonicContact OE1-NZ 3.16Å; E67-K80 PolarHBondContact OE1-NZ 2.76Å; W69-K80 HydrophobicContact CD2-CB 4.13Å; W69-K80 HydrophobicContact CD2-CG 4.2Å; W69-K80 HydrophobicContact CE3-CB 4.01Å; W69-K80 HydrophobicContact CH2-CB 3.96Å; W69-K80 HydrophobicContact CH2-CD 4.02Å; W69-K80 HydrophobicContact CH2-CG 4.38Å; W69-K80 HydrophobicContact CZ2-CB 4.06Å; W69-K80 HydrophobicContact CZ2-CD 3.43Å; W69-K80 VanDerWaalsContact CZ2-CD 3.43Å; W69-K80 HydrophobicContact CZ2-CG 3.97Å; W69-K80 HydrophobicContact CZ3-CB 3.92Å
81	I	94.8	Very high	95	Very high	33 Å²	33	45.7 Å²	45.7	17%	0.169	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	145.5	165.4	64	173.5	0	0	0	109.2	L68 I70 K79 L130	L68-I81 HydrophobicContact CB-CD1 4.36Å; L68-I81 HydrophobicContact CB-CG1 3.83Å; L68-I81 HydrophobicContact CD2-CD1 3.99Å; L68-I81 HydrophobicContact CD2-CG1 4.36Å; L68-I81 HydrophobicContact CG-CG1 4.45Å; L68-I81 PolarHBondContact N-O 2.92Å; L68-I81 WeakPolarHBondContact O-CG1 3.38Å; L68-I81 PolarHBondContact O-N 3.3Å; I70-I81 HydrophobicContact CD1-CD1 3.79Å; I70-I81 HydrophobicContact CD1-CG1 4.28Å; K79-I81 HydrophobicContact CD-CG2 4.3Å; K79-I81 HydrophobicContact CG-CG2 4.24Å; I81-L130 HydrophobicContact CD1-CD1 3.32Å; I81-L130 HydrophobicContact CD1-CG 3.76Å
82	N	96.6	Very high	95	Very high	90 Å²	90	45.5 Å²	45.5	48%	0.481	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	139.9	169.3	-67.6	-13.4	0	0	0	108.6	E66 V129	E66-N82 CarbonylContact O-C 3.54Å; E66-N82 WeakPolarHBondContact O-CA 3.44Å; N82-V129 WeakPolarHBondContact O-CG1 3.16Å
83	T	97.6	Very high	95.2	Very high	6 Å²	6	44.6 Å²	44.6	4%	0.037	24%	0.238	C	C	.	.			trans	-106.9	153.2	-179.7	56.3	0	0	0	0	110.4	E66 L68 L121 L130 W132	E66-T83 PolarHBondContact O-N 2.96Å; E66-T83 PolarHBondContact O-OG1 2.85Å; L68-T83 HydrophobicContact CB-CG2 3.9Å; T83-L121 HydrophobicContact CG2-CD2 4.22Å; T83-L130 WeakPolarHBondContact CA-O 3.48Å; T83-L130 HydrophobicContact CG2-CB 4.24Å; T83-W132 VanDerWaalsContact OG1-CD1 3.29Å; T83-W132 PolarHBondContact OG1-NE1 3.46Å; T83-W132 VanDerWaalsContact OG1-NE1 3.14Å
84	E	97.4	Very high	95.5	Very high	105 Å²	105	44.7 Å²	44.7	49%	0.491	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	-168.5	179.9	-70.6	179	-177.3	0	0	110.7	V129 L130 Q131 W132	E84-V129 HydrophobicContact CB-CG1 4.27Å; E84-V129 HydrophobicContact CG-CG1 3.82Å; E84-L130 PolarHBondContact N-O 2.78Å; E84-Q131 HydrophobicContact CB-CG 4.29Å; E84-Q131 CarbonylContact O-C 3.54Å; E84-Q131 WeakPolarHBondContact O-CA 3.31Å; E84-W132 PolarHBondContact O-N 2.92Å
85	G	97.3	Very high	96.1	Very high	49 Å²	49	43.5 Å²	43.5	51%	0.505	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	79.6	-143.8	180	0	0	0	0	0	112.9	V87	G85-V87 PolarHBondContact O-N 2.97Å
86	D	98.3	Very high	96.8	Very high	84 Å²	84	44.1 Å²	44.1	45%	0.449	24%	0.241	S	C	.	.	S	Bend	trans	-78.8	56.4	178.1	-64.8	-37.7	0	0	0	111.4	Y119 W132 R134	D86-Y119 WeakPolarHBondContact O-CD1 3.24Å; D86-Y119 WeakPolarHBondContact O-CE1 3.46Å; D86-W132 PolarHBondContact N-O 2.69Å; D86-W132 WeakPolarHBondContact O-CB 3.43Å; D86-R134 HydrophobicContact CB-CB 3.82Å; D86-R134 PolarHBondContact OD2-N 3.13Å; D86-R134 VanDerWaalsContact OD2-N 3.09Å
87	V	98.6	Very high	97.3	Very high	22 Å²	22	43.1 Å²	43.1	13%	0.133	23%	0.228	C	C	.	.	P	Polyproline II helix	trans	-51.4	126.6	-176.5	-174.3	0	0	0	0	108.8	R65 G85	R65-V87 HydrophobicContact CB-CG1 4.05Å; R65-V87 HydrophobicContact CG-CG1 3.95Å; R65-V87 PolarHBondContact NH2-O 2.93Å; R65-V87 VanDerWaalsContact O-CG1 3.26Å; R65-V87 WeakPolarHBondContact O-CG1 3.4Å; G85-V87 PolarHBondContact O-N 2.97Å
88	P	98.7	Very high	97.7	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	21%	0.214	C	C	.	.	P	Polyproline II helix	trans	-61.5	155.4	176.5	18.4	-27.3	0	0	0	111.2	W47 R65 M91 L105 Y119 W132	W47-P88 HydrophobicContact CH2-CB 4.07Å; W47-P88 HydrophobicContact CH2-CG 4.02Å; W47-P88 HydrophobicContact CZ2-CB 3.98Å; W47-P88 HydrophobicContact CZ2-CG 3.57Å; R65-P88 WeakPolarHBondContact CB-O 3.27Å; R65-P88 PolarHBondContact NE-O 3.39Å; R65-P88 PolarHBondContact NH2-O 2.94Å; P88-M91 HydrophobicContact CB-CE 3.86Å; P88-L105 HydrophobicContact CB-CD2 3.97Å; P88-L105 HydrophobicContact CG-CD2 3.76Å; P88-Y119 HydrophobicContact CB-CD1 4.08Å; P88-Y119 HydrophobicContact CB-CD2 3.99Å; P88-Y119 HydrophobicContact CB-CE1 3.96Å; P88-Y119 HydrophobicContact CB-CE2 3.86Å; P88-Y119 HydrophobicContact CB-CG 4.11Å; P88-Y119 HydrophobicContact CG-CD1 4.47Å; P88-Y119 HydrophobicContact CG-CG 4.44Å; P88-W132 VanDerWaalsContact CD-CD2 3.4Å; P88-W132 VanDerWaalsContact CD-CG 3.43Å; P88-W132 HydrophobicContact CG-CD2 3.95Å; P88-W132 HydrophobicContact CG-CE3 4.17Å; P88-W132 HydrophobicContact CG-CG 4.46Å; P88-W132 HydrophobicContact CG-CH2 4.33Å; P88-W132 HydrophobicContact CG-CZ2 4.12Å; P88-W132 HydrophobicContact CG-CZ3 4.36Å
89	P	98.5	Very high	97.8	Very high	28 Å²	28	38.7 Å²	38.7	18%	0.182	22%	0.219	C	C	.	.	P	Polyproline II helix	trans	-63	153.3	172	28.2	-33.7	0	0	0	110.1	W47 M91 H110	W47-P89 WeakPolarHBondContact CH2-O 3.34Å; W47-P89 WeakPolarHBondContact CZ2-O 3.28Å; P89-M91 HydrophobicContact CG-CE 4.14Å; P89-M91 HydrophobicContact CG-CG 4.12Å; P89-M91 HydrophobicContact CG-SD 3.95Å; P89-M91 WeakPolarHBondContact O-CE 3.21Å; P89-M91 WeakPolarHBondContact O-CG 3.48Å; P89-M91 PolarHBondContact O-N 2.95Å; P89-H110 HydrophobicContact CB-CB 4.05Å; P89-H110 HydrophobicContact CG-CB 4.2Å
90	S	98.6	Very high	97.8	Very high	26 Å²	26	38.7 Å²	38.7	18%	0.182	23%	0.225	C	C	.	.	P	Polyproline II helix	trans	-59.5	125.5	172.8	-55.7	0	0	0	0	110	L63 R65 H110	L63-S90 WeakPolarHBondContact O-CB 3.37Å; L63-S90 PolarHBondContact O-OG 2.89Å; R65-S90 WeakPolarHBondContact CB-OG 3.3Å; R65-S90 PolarHBondContact N-OG 3.33Å; S90-H110 WeakPolarHBondContact O-CB 3Å
91	M	98.6	Very high	97.8	Very high	1 Å²	1	37.9 Å²	37.9	1%	0.005	22%	0.22	C	C	.	.			trans	-138.6	153.7	-171.8	-75.1	179.5	-64.5	0	0	112.6	W47 G49 P88 P89 S94 L105 G107 H109 H110 T115	W47-M91 HydrophobicContact CH2-CB 4.04Å; W47-M91 HydrophobicContact CH2-CE 3.69Å; W47-M91 HydrophobicContact CZ3-CB 4.16Å; W47-M91 HydrophobicContact CZ3-CE 4.12Å; G49-M91 PolarHBondContact N-O 2.85Å; P88-M91 HydrophobicContact CB-CE 3.86Å; P89-M91 HydrophobicContact CG-CE 4.14Å; P89-M91 HydrophobicContact CG-CG 4.12Å; P89-M91 HydrophobicContact CG-SD 3.95Å; P89-M91 WeakPolarHBondContact O-CE 3.21Å; P89-M91 WeakPolarHBondContact O-CG 3.48Å; P89-M91 PolarHBondContact O-N 2.95Å; M91-S94 WeakPolarHBondContact CB-OG 3.38Å; M91-L105 HydrophobicContact CE-CD2 4.1Å; M91-G107 VanDerWaalsContact SD-O 3.39Å; M91-H109 VanDerWaalsContact CA-O 3.25Å; M91-H109 WeakPolarHBondContact CA-O 3.36Å; M91-H110 HydrophobicContact CG-CB 3.71Å; M91-T115 HydrophobicContact SD-CG2 3.5Å; M91-T115 VanDerWaalsContact SD-CG2 3.5Å
92	S	98.6	Very high	98	Very high	8 Å²	8	36.8 Å²	36.8	6%	0.056	21%	0.214	C	C	.	.	B	Isolated β-bridge	trans	-111.2	157.2	160.6	69	0	0	0	0	110.7	G34 S94 G108 H109	G34-S92 CarbonylContact O-C 3.53Å; G34-S92 VanDerWaalsContact O-CA 3.26Å; G34-S92 WeakPolarHBondContact O-CA 3.39Å; S92-S94 PolarHBondContact O-N 3.18Å; S92-S94 VanDerWaalsContact O-N 3.14Å; S92-G108 WeakPolarHBondContact O-CA 3.32Å; S92-H109 PolarHBondContact N-O 2.93Å; S92-H109 PolarHBondContact O-N 3.17Å
93	G	98.6	Very high	98.1	Very high	4 Å²	4	32.9 Å²	32.9	4%	0.041	19%	0.194	C	C	.	.	S	Bend	trans	67.3	14	173.8	0	0	0	0	0	114.9	G34 D146 K147	G34-G93 PolarHBondContact O-N 2.75Å; G93-D146 CarbonylContact O-C 3.58Å; G93-D146 WeakPolarHBondContact O-CA 3.13Å; G93-D146 WeakPolarHBondContact O-CB 3.49Å; G93-K147 PolarHBondContact O-N 2.86Å
94	S	98.9	Very high	98.1	Very high	13 Å²	13	33.9 Å²	33.9	9%	0.091	20%	0.197	C	C	.	.			trans	-60.6	158.3	168.6	-58.2	0	0	0	0	110.5	V36 M91 S92 L105 G107 G108	V36-S94 WeakPolarHBondContact CG1-O 3.24Å; M91-S94 WeakPolarHBondContact CB-OG 3.38Å; S92-S94 PolarHBondContact O-N 3.18Å; S92-S94 VanDerWaalsContact O-N 3.14Å; S94-L105 VanDerWaalsContact CB-CD1 3.48Å; S94-G107 WeakPolarHBondContact CB-O 3.32Å; S94-G107 PolarHBondContact OG-O 2.88Å; S94-G108 WeakPolarHBondContact OG-CA 3.42Å
95	C	98.9	Very high	98.2	Very high	9 Å²	9	29 Å²	29	6%	0.061	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	128.4	176.3	-164.3	0	0	0	0	108.8	L105 F106 L148 V150 F159	C95-L105 WeakPolarHBondContact O-CA 3.32Å; C95-F106 PolarHBondContact N-O 3.2Å; C95-F106 PolarHBondContact O-N 3.03Å; C95-L148 HydrophobicContact CB-CD1 4.27Å; C95-L148 HydrophobicContact CB-CD2 3.8Å; C95-L148 HydrophobicContact CB-CG 3.76Å; C95-V150 WeakPolarHBondContact SG-CG1 3.46Å; C95-F159 HydrophobicContact CB-CE1 4.34Å
96	A	98.9	Very high	98.3	Very high	25 Å²	25	26.7 Å²	26.7	21%	0.207	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	152.6	-176.7	0	0	0	0	0	112.8	V36 V38 Y104 L105	V36-A96 HydrophobicContact CB-CB 3.74Å; V36-A96 HydrophobicContact CG1-CB 3.87Å; V36-A96 HydrophobicContact CG2-CB 3.92Å; V38-A96 VanDerWaalsContact CG1-C 3.47Å; V38-A96 HydrophobicContact CG1-CB 3.67Å; V38-A96 WeakPolarHBondContact CG1-O 3.33Å; A96-Y104 CarbonylContact C-O 3.56Å; A96-Y104 WeakPolarHBondContact CA-O 3.42Å; A96-Y104 WeakPolarHBondContact CB-O 3.37Å; A96-L105 HydrophobicContact CB-CD1 3.85Å
97	V	98.8	Very high	98.3	Very high	17 Å²	17	22.7 Å²	22.7	10%	0.103	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	157	171.3	-66.8	0	0	0	0	110.6	V99 L103 Y104 V150 V152 L157	V97-V99 HydrophobicContact CG2-CG2 4.3Å; V97-L103 WeakPolarHBondContact O-CA 3.41Å; V97-Y104 HydrophobicContact CG2-CD2 4.13Å; V97-Y104 HydrophobicContact CG2-CG 4.5Å; V97-Y104 PolarHBondContact N-O 3.34Å; V97-Y104 PolarHBondContact O-N 2.86Å; V97-V150 HydrophobicContact CG1-CB 4.37Å; V97-V150 HydrophobicContact CG1-CG1 3.31Å; V97-V150 HydrophobicContact CG1-CG2 4.13Å; V97-V152 HydrophobicContact CB-CG2 3.92Å; V97-V152 HydrophobicContact CG1-CG2 3.68Å; V97-V152 HydrophobicContact CG2-CG2 4.17Å; V97-L157 HydrophobicContact CG2-CD1 4.13Å; V97-L157 HydrophobicContact CG2-CD2 3.86Å
98	C	98.5	Very high	98.3	Very high	27 Å²	27	21.7 Å²	21.7	18%	0.182	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	122.9	167.3	-177.2	0	0	0	0	107.7	V38 V102	V38-C98 HydrophobicContact CB-CB 3.85Å; V38-C98 HydrophobicContact CG2-CB 3.92Å; C98-V102 WeakPolarHBondContact CA-O 3.45Å
99	V	97.9	Very high	98.3	Very high	39 Å²	39	23.6 Å²	23.6	24%	0.236	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	118.4	172.7	-173.6	0	0	0	0	107	V97 R101 V102 Y104 V152 L157	V97-V99 HydrophobicContact CG2-CG2 4.3Å; V99-R101 VanDerWaalsContact C-N 3.26Å; V99-R101 PolarHBondContact O-N 2.59Å; V99-V102 PolarHBondContact N-O 2.7Å; V99-V102 WeakPolarHBondContact O-CA 3.4Å; V99-V102 WeakPolarHBondContact O-CB 3.44Å; V99-V102 PolarHBondContact O-N 3.1Å; V99-Y104 HydrophobicContact CB-CE2 4.08Å; V99-Y104 HydrophobicContact CG2-CD2 4.32Å; V99-Y104 HydrophobicContact CG2-CE2 4.28Å; V99-V152 HydrophobicContact CG2-CG1 3.73Å; V99-V152 HydrophobicContact CG2-CG2 4.17Å; V99-L157 HydrophobicContact CG2-CD2 4.23Å
100	D	95.1	Very high	98.2	Very high	136 Å²	136	23.9 Å²	23.9	73%	0.727	13%	0.131	S	C	*	.	T	Hydrogen-bonded Turn	trans	48.7	45.3	-179.6	-58.9	-35	0	0	0	113.9	V102	D100-V102 PolarHBondContact O-N 2.84Å
101	R	95.4	Very high	98.1	Very high	74 Å²	74	27.7 Å²	27.7	28%	0.279	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	64.8	11.5	-177.7	-64.5	-73.4	-62.4	-109.9	-13.9	114.9	D40 H43 V99 S123 R124	D40-R101 WeakPolarHBondContact OD2-CD 3.33Å; D40-R101 IonicContact OD2-CZ 3.86Å; D40-R101 IonicContact OD2-NE 2.93Å; D40-R101 IonicContact OD2-NH1 3.13Å; D40-R101 PolarHBondContact OD2-NH1 3.38Å; H43-R101 PolarHBondContact ND1-NH1 3.16Å; V99-R101 VanDerWaalsContact C-N 3.26Å; V99-R101 PolarHBondContact O-N 2.59Å; R101-S123 PolarHBondContact NE-OG 2.91Å; R101-S123 VanDerWaalsContact NE-OG 3.1Å; R101-S123 PolarHBondContact NH2-O 2.83Å; R101-S123 WeakPolarHBondContact O-CB 3.08Å; R101-S123 PolarHBondContact O-N 2.85Å; R101-S123 PolarHBondContact O-OG 2.69Å; R101-R124 HydrophobicContact CB-CG 3.46Å; R101-R124 VanDerWaalsContact CB-CG 3.46Å; R101-R124 HydrophobicContact CG-CG 4.38Å
102	V	98	Very high	97.8	Very high	9 Å²	9	38.1 Å²	38.1	6%	0.055	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	122.9	167.7	-175	0	0	0	0	108.5	C98 V99 D100 Y104 M120	C98-V102 WeakPolarHBondContact CA-O 3.45Å; V99-V102 PolarHBondContact N-O 2.7Å; V99-V102 WeakPolarHBondContact O-CA 3.4Å; V99-V102 WeakPolarHBondContact O-CB 3.44Å; V99-V102 PolarHBondContact O-N 3.1Å; D100-V102 PolarHBondContact O-N 2.84Å; V102-Y104 HydrophobicContact CB-CE2 4.05Å; V102-Y104 HydrophobicContact CG1-CD2 4.47Å; V102-Y104 HydrophobicContact CG1-CE1 3.95Å; V102-Y104 HydrophobicContact CG1-CE2 3.84Å; V102-M120 HydrophobicContact CG1-CG 3.33Å; V102-M120 HydrophobicContact CG1-SD 3.64Å
103	L	98.6	Very high	97.7	Very high	9 Å²	9	38 Å²	38	5%	0.047	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	130	177.4	-74.9	65.1	0	0	0	108.4	V38 F45 L68 V97 M120 L121	V38-L103 HydrophobicContact CG2-CD2 3.91Å; V38-L103 HydrophobicContact CG2-CG 3.77Å; F45-L103 HydrophobicContact CB-CD2 3.68Å; F45-L103 HydrophobicContact CD1-CD2 4.31Å; F45-L103 HydrophobicContact CD2-CD1 4.27Å; F45-L103 HydrophobicContact CE2-CD1 4.46Å; F45-L103 HydrophobicContact CG-CD1 4.33Å; F45-L103 HydrophobicContact CG-CD2 3.94Å; L68-L103 HydrophobicContact CD1-CD2 4.48Å; V97-L103 WeakPolarHBondContact O-CA 3.41Å; L103-M120 CarbonylContact O-C 3.58Å; L103-M120 VanDerWaalsContact O-CA 3.29Å; L103-M120 WeakPolarHBondContact O-CA 3.36Å; L103-L121 HydrophobicContact CB-CB 4.2Å; L103-L121 HydrophobicContact CD2-CD2 4.4Å; L103-L121 PolarHBondContact N-O 3.44Å; L103-L121 PolarHBondContact O-N 2.95Å
104	Y	98.9	Very high	97.7	Very high	26 Å²	26	38.2 Å²	38.2	10%	0.102	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	136.5	172.8	-61.7	-76.7	0	0	0	109.3	A96 V97 V99 V102 F118 Y119 M120 L157 F203	A96-Y104 CarbonylContact C-O 3.56Å; A96-Y104 WeakPolarHBondContact CA-O 3.42Å; A96-Y104 WeakPolarHBondContact CB-O 3.37Å; V97-Y104 HydrophobicContact CG2-CD2 4.13Å; V97-Y104 HydrophobicContact CG2-CG 4.5Å; V97-Y104 PolarHBondContact N-O 3.34Å; V97-Y104 PolarHBondContact O-N 2.86Å; V99-Y104 HydrophobicContact CB-CE2 4.08Å; V99-Y104 HydrophobicContact CG2-CD2 4.32Å; V99-Y104 HydrophobicContact CG2-CE2 4.28Å; V102-Y104 HydrophobicContact CB-CE2 4.05Å; V102-Y104 HydrophobicContact CG1-CD2 4.47Å; V102-Y104 HydrophobicContact CG1-CE1 3.95Å; V102-Y104 HydrophobicContact CG1-CE2 3.84Å; Y104-F118 AromaticContact CD1-CE1 3.65Å; Y104-F118 HydrophobicContact CD1-CE1 3.65Å; Y104-F118 HydrophobicContact CD1-CE2 4.48Å; Y104-F118 AromaticContact CD1-CZ 3.34Å; Y104-F118 HydrophobicContact CD1-CZ 3.34Å; Y104-F118 HydrophobicContact CE1-CE1 4.31Å; Y104-F118 HydrophobicContact CE1-CZ 4.24Å; Y104-F118 AromaticContact CG-CZ 3.84Å; Y104-F118 HydrophobicContact CG-CZ 3.84Å; Y104-Y119 WeakPolarHBondContact CA-O 3.36Å; Y104-M120 HydrophobicContact CD1-CB 4.16Å; Y104-M120 HydrophobicContact CD1-CG 3.94Å; Y104-M120 HydrophobicContact CE1-CB 4.22Å; Y104-M120 HydrophobicContact CE1-CG 3.65Å; Y104-M120 HydrophobicContact CE1-SD 3.67Å; Y104-L157 HydrophobicContact CD1-CD1 4.35Å; Y104-L157 HydrophobicContact CD2-CD1 4.02Å; Y104-L157 HydrophobicContact CG-CD1 3.8Å; Y104-F203 HydrophobicContact CE1-CE1 4.15Å
105	L	98.9	Very high	97.7	Very high	3 Å²	3	38.1 Å²	38.1	2%	0.016	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	124.3	-178.1	-175.7	76.6	0	0	0	109.7	V36 W47 P88 M91 S94 C95 A96 F118 Y119 W132	V36-L105 HydrophobicContact CG1-CD1 4.1Å; V36-L105 HydrophobicContact CG2-CD1 4.09Å; W47-L105 HydrophobicContact CE3-CD1 4.34Å; W47-L105 HydrophobicContact CE3-CD2 4.07Å; W47-L105 HydrophobicContact CH2-CD2 4.09Å; W47-L105 HydrophobicContact CZ3-CD1 4.39Å; W47-L105 HydrophobicContact CZ3-CD2 3.76Å; P88-L105 HydrophobicContact CB-CD2 3.97Å; P88-L105 HydrophobicContact CG-CD2 3.76Å; M91-L105 HydrophobicContact CE-CD2 4.1Å; S94-L105 VanDerWaalsContact CB-CD1 3.48Å; C95-L105 WeakPolarHBondContact O-CA 3.32Å; A96-L105 HydrophobicContact CB-CD1 3.85Å; L105-F118 CarbonylContact O-C 3.55Å; L105-F118 WeakPolarHBondContact O-CA 3.3Å; L105-Y119 HydrophobicContact CD2-CD2 4.46Å; L105-Y119 PolarHBondContact N-O 3.47Å; L105-Y119 PolarHBondContact O-N 2.76Å; L105-W132 HydrophobicContact CB-CH2 4.18Å; L105-W132 HydrophobicContact CB-CZ3 3.98Å; L105-W132 HydrophobicContact CD2-CH2 4.1Å; L105-W132 HydrophobicContact CD2-CZ3 4.29Å
106	F	98.9	Very high	97.7	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	137.8	177.6	175.6	-99.3	0	0	0	111.5	C95 N116 F118 P142 K145 L148 F159 W205	C95-F106 PolarHBondContact N-O 3.2Å; C95-F106 PolarHBondContact O-N 3.03Å; F106-N116 HydrophobicContact CE2-CB 4.16Å; F106-N116 VanDerWaalsContact CE2-O 3.32Å; F106-N116 WeakPolarHBondContact CE2-O 3.45Å; F106-N116 HydrophobicContact CZ-CB 4.16Å; F106-F118 HydrophobicContact CB-CD2 3.99Å; F106-F118 HydrophobicContact CB-CE2 4.5Å; F106-F118 HydrophobicContact CD2-CD2 4.25Å; F106-P142 HydrophobicContact CE1-CB 4.43Å; F106-P142 HydrophobicContact CE1-CG 4.24Å; F106-P142 HydrophobicContact CE2-CG 3.96Å; F106-P142 HydrophobicContact CZ-CB 3.77Å; F106-P142 HydrophobicContact CZ-CG 3.52Å; F106-K145 HydrophobicContact CE1-CG 4.38Å; F106-L148 HydrophobicContact CD1-CD1 3.85Å; F106-L148 HydrophobicContact CD1-CD2 4.19Å; F106-L148 HydrophobicContact CE1-CD1 3.89Å; F106-L148 HydrophobicContact CE1-CD2 4.29Å; F106-F159 HydrophobicContact CB-CD1 4.3Å; F106-F159 HydrophobicContact CB-CE1 3.51Å; F106-F159 HydrophobicContact CB-CZ 3.66Å; F106-F159 AromaticContact CD1-CD1 3.91Å; F106-F159 HydrophobicContact CD1-CD1 3.91Å; F106-F159 AromaticContact CD1-CE1 3.99Å; F106-F159 HydrophobicContact CD1-CE1 3.99Å; F106-F159 HydrophobicContact CD1-CG 4.41Å; F106-F159 HydrophobicContact CG-CD1 4.29Å; F106-F159 AromaticContact CG-CE1 3.94Å; F106-F159 HydrophobicContact CG-CE1 3.94Å; F106-F159 HydrophobicContact CG-CZ 4.12Å; F106-W205 AromaticContact CD2-CH2 3.73Å; F106-W205 HydrophobicContact CD2-CH2 3.73Å; F106-W205 AromaticContact CD2-CZ2 3.7Å; F106-W205 HydrophobicContact CD2-CZ2 3.7Å; F106-W205 AromaticContact CE2-CH2 3.82Å; F106-W205 HydrophobicContact CE2-CH2 3.82Å; F106-W205 AromaticContact CE2-CZ2 3.75Å; F106-W205 HydrophobicContact CE2-CZ2 3.75Å; F106-W205 HydrophobicContact CG-CH2 4.33Å
107	G	98.8	Very high	97.7	Very high	1 Å²	1	42.8 Å²	42.8	1%	0.01	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	64.3	-154.9	169.7	0	0	0	0	0	114	M91 S94 T115 K117	M91-G107 VanDerWaalsContact SD-O 3.39Å; S94-G107 WeakPolarHBondContact CB-O 3.32Å; S94-G107 PolarHBondContact OG-O 2.88Å; G107-T115 VanDerWaalsContact CA-O 3.24Å; G107-T115 WeakPolarHBondContact CA-O 3.4Å; G107-K117 PolarHBondContact N-O 2.78Å; G107-K117 VanDerWaalsContact N-O 3.13Å
108	G	98.8	Very high	97.7	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	114.5	-178.2	-175.6	0	0	0	0	0	112.9	S92 S94 N114 T115 K145	S92-G108 WeakPolarHBondContact O-CA 3.32Å; S94-G108 WeakPolarHBondContact OG-CA 3.42Å; G108-N114 VanDerWaalsContact O-CA 3.28Å; G108-N114 WeakPolarHBondContact O-CA 3.26Å; G108-N114 PolarHBondContact O-ND2 3.18Å; G108-T115 PolarHBondContact O-N 3.15Å; G108-K145 PolarHBondContact N-O 2.66Å
109	H	98.1	Very high	97.7	Very high	40 Å²	40	41.8 Å²	41.8	19%	0.185	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	117.5	-178.5	-173.6	-81	0	0	0	109.8	Y62 M91 S92 G113 D146 R189	Y62-H109 WeakPolarHBondContact CE1-O 3.21Å; Y62-H109 PolarHBondContact OH-ND1 2.9Å; Y62-H109 PolarHBondContact OH-O 2.93Å; M91-H109 VanDerWaalsContact CA-O 3.25Å; M91-H109 WeakPolarHBondContact CA-O 3.36Å; S92-H109 PolarHBondContact N-O 2.93Å; S92-H109 PolarHBondContact O-N 3.17Å; H109-G113 WeakPolarHBondContact CA-O 3.47Å; H109-D146 HydrophobicContact CB-CB 4.21Å; H109-R189 PolarHBondContact CD2-NH1 2.93Å; H109-R189 VanDerWaalsContact CD2-NH1 3.3Å
110	H	97.2	Very high	97.7	Very high	35 Å²	35	41.5 Å²	41.5	16%	0.162	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	-175	175.3	54.8	89.5	0	0	0	110.6	P89 S90 M91 R112 G113	P89-H110 HydrophobicContact CB-CB 4.05Å; P89-H110 HydrophobicContact CG-CB 4.2Å; S90-H110 WeakPolarHBondContact O-CB 3Å; M91-H110 HydrophobicContact CG-CB 3.71Å; H110-R112 PolarHBondContact ND1-N 3.43Å; H110-R112 PolarHBondContact O-N 3.37Å; H110-G113 PolarHBondContact CD2-O 3.47Å; H110-G113 PolarHBondContact N-O 3.12Å; H110-G113 PolarHBondContact O-N 2.84Å
111	S	94.8	Very high	97.8	Very high	105 Å²	105	35 Å²	35	73%	0.734	17%	0.165	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.5	-16.8	-179.1	59.2	0	0	0	0	115.8
112	R	94.3	Very high	97.9	Very high	221 Å²	221	33.7 Å²	33.7	83%	0.834	16%	0.163	S	C	*	.	T	Hydrogen-bonded Turn	trans	-112	7.9	179	-60.3	177.7	61.2	175.9	-0.4	113.2	H110	H110-R112 PolarHBondContact ND1-N 3.43Å; H110-R112 PolarHBondContact O-N 3.37Å
113	G	95.6	Very high	97.7	Very high	5 Å²	5	33.5 Å²	33.5	5%	0.052	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	115.3	-162.5	177.5	0	0	0	0	0	114.9	H109 H110 Y165	H109-G113 WeakPolarHBondContact CA-O 3.47Å; H110-G113 PolarHBondContact CD2-O 3.47Å; H110-G113 PolarHBondContact N-O 3.12Å; H110-G113 PolarHBondContact O-N 2.84Å; G113-Y165 VanDerWaalsContact CA-OH 3.27Å; G113-Y165 WeakPolarHBondContact CA-OH 3.32Å
114	N	98.3	Very high	97.3	Very high	9 Å²	9	39.9 Å²	39.9	5%	0.048	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	153	-178.8	-70.1	105.4	0	0	0	112.2	G108 S144 D146 Y165 R189	G108-N114 VanDerWaalsContact O-CA 3.28Å; G108-N114 WeakPolarHBondContact O-CA 3.26Å; G108-N114 PolarHBondContact O-ND2 3.18Å; N114-S144 WeakPolarHBondContact CB-O 3.29Å; N114-D146 VanDerWaalsContact ND2-CB 3.34Å; N114-D146 WeakPolarHBondContact ND2-CB 3.37Å; N114-D146 PolarHBondContact ND2-N 2.9Å; N114-D146 PolarHBondContact ND2-OD1 3.37Å; N114-D146 VanDerWaalsContact ND2-OD1 3.16Å; N114-Y165 HydrophobicContact CB-CD2 4.24Å; N114-Y165 HydrophobicContact CB-CE2 3.78Å; N114-Y165 PolarHBondContact N-OH 3.28Å; N114-R189 WeakPolarHBondContact OD1-CD 3.49Å; N114-R189 PolarHBondContact OD1-NH1 3.47Å
115	T	98.6	Very high	96.3	Very high	11 Å²	11	41.6 Å²	41.6	7%	0.067	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	160.1	175.7	-170.8	0	0	0	0	111.8	M91 G107 G108 K117 S144 K145	M91-T115 HydrophobicContact SD-CG2 3.5Å; M91-T115 VanDerWaalsContact SD-CG2 3.5Å; G107-T115 VanDerWaalsContact CA-O 3.24Å; G107-T115 WeakPolarHBondContact CA-O 3.4Å; G108-T115 PolarHBondContact O-N 3.15Å; T115-K117 VanDerWaalsContact OG1-CG 3.29Å; T115-K117 WeakPolarHBondContact OG1-CG 3.28Å; T115-K117 PolarHBondContact OG1-N 2.77Å; T115-S144 WeakPolarHBondContact O-CA 3.13Å; T115-K145 PolarHBondContact O-N 3.14Å; T115-K145 VanDerWaalsContact O-N 3.09Å
116	N	98.5	Very high	94.9	Very high	40 Å²	40	47.3 Å²	47.3	21%	0.214	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	17	168.2	61.2	-1.9	0	0	0	112.1	F106 P142 S144	F106-N116 HydrophobicContact CE2-CB 4.16Å; F106-N116 VanDerWaalsContact CE2-O 3.32Å; F106-N116 WeakPolarHBondContact CE2-O 3.45Å; F106-N116 HydrophobicContact CZ-CB 4.16Å; N116-P142 WeakPolarHBondContact CB-O 3.49Å; N116-P142 PolarHBondContact ND2-O 3.37Å; N116-S144 PolarHBondContact N-OG 2.86Å
117	K	98.8	Very high	93.5	Very high	91 Å²	91	54.5 Å²	54.5	40%	0.396	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	146.5	176.4	-61.9	-57.4	179.3	-173.3	0	110.9	G107 T115 Y119	G107-K117 PolarHBondContact N-O 2.78Å; G107-K117 VanDerWaalsContact N-O 3.13Å; T115-K117 VanDerWaalsContact OG1-CG 3.29Å; T115-K117 WeakPolarHBondContact OG1-CG 3.28Å; T115-K117 PolarHBondContact OG1-N 2.77Å; K117-Y119 HydrophobicContact CB-CD2 4.39Å; K117-Y119 HydrophobicContact CB-CE2 3.5Å
118	F	98.9	Very high	92.7	Very high	4 Å²	4	64.1 Å²	64.1	2%	0.018	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	133.9	178.4	-172.9	-94.3	0	0	0	109.7	Y104 L105 F106 I135 L157 F159 L198 F203 W205	Y104-F118 AromaticContact CD1-CE1 3.65Å; Y104-F118 HydrophobicContact CD1-CE1 3.65Å; Y104-F118 HydrophobicContact CD1-CE2 4.48Å; Y104-F118 AromaticContact CD1-CZ 3.34Å; Y104-F118 HydrophobicContact CD1-CZ 3.34Å; Y104-F118 HydrophobicContact CE1-CE1 4.31Å; Y104-F118 HydrophobicContact CE1-CZ 4.24Å; Y104-F118 AromaticContact CG-CZ 3.84Å; Y104-F118 HydrophobicContact CG-CZ 3.84Å; L105-F118 CarbonylContact O-C 3.55Å; L105-F118 WeakPolarHBondContact O-CA 3.3Å; F106-F118 HydrophobicContact CB-CD2 3.99Å; F106-F118 HydrophobicContact CB-CE2 4.5Å; F106-F118 HydrophobicContact CD2-CD2 4.25Å; F118-I135 HydrophobicContact CD1-CB 3.97Å; F118-I135 HydrophobicContact CD1-CG1 3.96Å; F118-I135 HydrophobicContact CE1-CG1 4.25Å; F118-I135 PolarHBondContact O-N 2.98Å; F118-L157 HydrophobicContact CE2-CD1 4Å; F118-L157 HydrophobicContact CZ-CD1 3.84Å; F118-F159 HydrophobicContact CE2-CZ 4.23Å; F118-L198 HydrophobicContact CD1-CD2 3.9Å; F118-L198 HydrophobicContact CD2-CD2 3.6Å; F118-L198 HydrophobicContact CE1-CD2 3.55Å; F118-L198 HydrophobicContact CE2-CD2 3.24Å; F118-L198 HydrophobicContact CG-CD2 3.91Å; F118-L198 HydrophobicContact CZ-CD2 3.19Å; F118-F203 HydrophobicContact CE1-CD1 4.24Å; F118-F203 HydrophobicContact CE1-CE1 4.12Å; F118-W205 HydrophobicContact CD2-CZ2 4.24Å
119	Y	98.9	Very high	92.3	Very high	19 Å²	19	67.6 Å²	67.6	8%	0.075	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	152.1	-178.6	-56.8	-99.8	0	0	0	110.4	D86 P88 Y104 L105 K117 E133 R134	D86-Y119 WeakPolarHBondContact O-CD1 3.24Å; D86-Y119 WeakPolarHBondContact O-CE1 3.46Å; P88-Y119 HydrophobicContact CB-CD1 4.08Å; P88-Y119 HydrophobicContact CB-CD2 3.99Å; P88-Y119 HydrophobicContact CB-CE1 3.96Å; P88-Y119 HydrophobicContact CB-CE2 3.86Å; P88-Y119 HydrophobicContact CB-CG 4.11Å; P88-Y119 HydrophobicContact CG-CD1 4.47Å; P88-Y119 HydrophobicContact CG-CG 4.44Å; Y104-Y119 WeakPolarHBondContact CA-O 3.36Å; L105-Y119 HydrophobicContact CD2-CD2 4.46Å; L105-Y119 PolarHBondContact N-O 3.47Å; L105-Y119 PolarHBondContact O-N 2.76Å; K117-Y119 HydrophobicContact CB-CD2 4.39Å; K117-Y119 HydrophobicContact CB-CE2 3.5Å; Y119-E133 CarbonylContact C-O 3.6Å; Y119-E133 VanDerWaalsContact CA-O 3.31Å; Y119-E133 WeakPolarHBondContact CA-O 3.31Å; Y119-R134 HydrophobicContact CD1-CB 3.87Å; Y119-R134 HydrophobicContact CD1-CG 4.09Å; Y119-R134 HydrophobicContact CE1-CB 3.8Å; Y119-R134 HydrophobicContact CE1-CG 3.78Å
120	M	98.3	Very high	92.2	Very high	34 Å²	34	66.4 Å²	66.4	17%	0.167	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	145.4	174.9	-174.3	-179.9	69.7	0	0	109.9	V102 L103 Y104 W132 E133 I135 F203	V102-M120 HydrophobicContact CG1-CG 3.33Å; V102-M120 HydrophobicContact CG1-SD 3.64Å; L103-M120 CarbonylContact O-C 3.58Å; L103-M120 VanDerWaalsContact O-CA 3.29Å; L103-M120 WeakPolarHBondContact O-CA 3.36Å; Y104-M120 HydrophobicContact CD1-CB 4.16Å; Y104-M120 HydrophobicContact CD1-CG 3.94Å; Y104-M120 HydrophobicContact CE1-CB 4.22Å; Y104-M120 HydrophobicContact CE1-CG 3.65Å; Y104-M120 HydrophobicContact CE1-SD 3.67Å; M120-W132 WeakPolarHBondContact O-CA 3.44Å; M120-E133 WeakPolarHBondContact CE-OE2 3.48Å; M120-E133 PolarHBondContact N-O 2.79Å; M120-E133 PolarHBondContact O-N 2.79Å; M120-I135 HydrophobicContact CB-CD1 4.22Å; M120-I135 HydrophobicContact CB-CG1 4.17Å; M120-I135 HydrophobicContact CE-CD1 4.37Å; M120-F203 HydrophobicContact SD-CZ 4.24Å
121	L	98.2	Very high	92.2	Very high	0 Å²	0	70.5 Å²	70.5	0%	0	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	112.1	173	-178.4	71.3	0	0	0	109.7	L68 T83 L103 S123 L130 Q131 W132	L68-L121 HydrophobicContact CD2-CD2 3.72Å; T83-L121 HydrophobicContact CG2-CD2 4.22Å; L103-L121 HydrophobicContact CB-CB 4.2Å; L103-L121 HydrophobicContact CD2-CD2 4.4Å; L103-L121 PolarHBondContact N-O 3.44Å; L103-L121 PolarHBondContact O-N 2.95Å; L121-S123 PolarHBondContact O-N 2.85Å; L121-L130 HydrophobicContact CD1-CB 3.72Å; L121-L130 HydrophobicContact CD2-CD1 4.3Å; L121-L130 HydrophobicContact CG-CB 4.35Å; L121-Q131 WeakPolarHBondContact CD1-O 3.41Å; L121-W132 HydrophobicContact CB-CD2 3.92Å; L121-W132 HydrophobicContact CB-CE3 3.69Å; L121-W132 HydrophobicContact CB-CH2 4.1Å; L121-W132 HydrophobicContact CB-CZ2 4.31Å; L121-W132 HydrophobicContact CB-CZ3 3.78Å; L121-W132 HydrophobicContact CD1-CD2 4.14Å; L121-W132 HydrophobicContact CD1-CG 4.07Å; L121-W132 HydrophobicContact CD2-CD2 4.32Å; L121-W132 HydrophobicContact CD2-CH2 4.33Å; L121-W132 HydrophobicContact CD2-CZ2 3.83Å; L121-W132 HydrophobicContact CG-CD2 4.37Å
122	D	96.2	Very high	92.4	Very high	45 Å²	45	66 Å²	66	24%	0.241	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	111.9	176.5	-171.5	-17.5	0	0	0	111	R124	D122-R124 WeakPolarHBondContact OD1-CB 3.25Å; D122-R124 VanDerWaalsContact OD1-CG 3.29Å; D122-R124 WeakPolarHBondContact OD1-CG 3.48Å; D122-R124 IonicContact OD1-CZ 2.71Å; D122-R124 PolarHBondContact OD1-N 3.41Å; D122-R124 IonicContact OD1-NE 2.69Å; D122-R124 PolarHBondContact OD1-NE 2.7Å; D122-R124 IonicContact OD1-NH2 3.33Å; D122-R124 IonicContact OD2-CZ 3.53Å; D122-R124 IonicContact OD2-NE 3.81Å; D122-R124 PolarHBondContact OD2-NE 2.84Å; D122-R124 VanDerWaalsContact OD2-NE 3.13Å; D122-R124 IonicContact OD2-NH2 2.76Å; D122-R124 PolarHBondContact OD2-NH2 2.91Å
123	S	93.5	Very high	92.6	Very high	5 Å²	5	60.1 Å²	60.1	4%	0.035	30%	0.295	C	S	.	.			trans	-95	10.4	-179.5	77.7	0	0	0	0	114.4	R101 L121	R101-S123 PolarHBondContact NE-OG 2.91Å; R101-S123 VanDerWaalsContact NE-OG 3.1Å; R101-S123 PolarHBondContact NH2-O 2.83Å; R101-S123 WeakPolarHBondContact O-CB 3.08Å; R101-S123 PolarHBondContact O-N 2.85Å; R101-S123 PolarHBondContact O-OG 2.69Å; L121-S123 PolarHBondContact O-N 2.85Å
124	R	90.8	Very high	92.7	Very high	143 Å²	143	64.6 Å²	64.6	54%	0.54	31%	0.311	S	S	.	.			trans	-79.4	-30.4	178.4	-61.9	173.6	-68.4	-169.1	2.8	112.5	R101 D122 T126	R101-R124 HydrophobicContact CB-CG 3.46Å; R101-R124 VanDerWaalsContact CB-CG 3.46Å; R101-R124 HydrophobicContact CG-CG 4.38Å; D122-R124 WeakPolarHBondContact OD1-CB 3.25Å; D122-R124 VanDerWaalsContact OD1-CG 3.29Å; D122-R124 WeakPolarHBondContact OD1-CG 3.48Å; D122-R124 IonicContact OD1-CZ 2.71Å; D122-R124 PolarHBondContact OD1-N 3.41Å; D122-R124 IonicContact OD1-NE 2.69Å; D122-R124 PolarHBondContact OD1-NE 2.7Å; D122-R124 IonicContact OD1-NH2 3.33Å; D122-R124 IonicContact OD2-CZ 3.53Å; D122-R124 IonicContact OD2-NE 3.81Å; D122-R124 PolarHBondContact OD2-NE 2.84Å; D122-R124 VanDerWaalsContact OD2-NE 3.13Å; D122-R124 IonicContact OD2-NH2 2.76Å; D122-R124 PolarHBondContact OD2-NH2 2.91Å; R124-T126 PolarHBondContact O-N 3.09Å
125	S	77.3	Confident	92.7	Very high	63 Å²	63	65 Å²	65	44%	0.441	31%	0.313	S	S	.	.			trans	-69.4	117.8	-178.9	-67.3	0	0	0	0	110.7
126	T	70.5	Confident	92.7	Very high	123 Å²	123	69.9 Å²	69.9	76%	0.755	34%	0.338	S	S	*	.	S	Bend	trans	-93.3	-20.9	176.5	52.3	0	0	0	0	113.5	R124	R124-T126 PolarHBondContact O-N 3.09Å
127	D	68.6	Low	92.7	Very high	151 Å²	151	69.5 Å²	69.5	81%	0.807	34%	0.338	S	S	*	.	S	Bend	trans	-102.9	2.7	-166.5	-56.3	-16.5	0	0	0	113
128	R	81.8	Confident	92.6	Very high	202 Å²	202	71.2 Å²	71.2	76%	0.762	35%	0.348	S	S	*	.	S	Bend	trans	-136.9	152.7	-178.9	-63.5	-175.2	-179.2	-177.7	0.4	110.3	L130	R128-L130 PolarHBondContact O-N 2.9Å
129	V	91.4	Very high	92.5	Very high	73 Å²	73	73.4 Å²	73.4	44%	0.442	37%	0.372	S	S	.	.			trans	-58.6	134.4	168.2	-178.6	0	0	0	0	108.2	N82 E84 Q131	N82-V129 WeakPolarHBondContact O-CG1 3.16Å; E84-V129 HydrophobicContact CB-CG1 4.27Å; E84-V129 HydrophobicContact CG-CG1 3.82Å; V129-Q131 PolarHBondContact O-N 2.97Å
130	L	96	Very high	92.4	Very high	16 Å²	16	77 Å²	77	8%	0.084	39%	0.391	C	S	.	.			trans	-69.2	132.9	-179.5	-54.8	-171.2	0	0	0	109.7	L68 I81 T83 E84 L121 R128	L68-L130 HydrophobicContact CD2-CD1 4.01Å; I81-L130 HydrophobicContact CD1-CD1 3.32Å; I81-L130 HydrophobicContact CD1-CG 3.76Å; T83-L130 WeakPolarHBondContact CA-O 3.48Å; T83-L130 HydrophobicContact CG2-CB 4.24Å; E84-L130 PolarHBondContact N-O 2.78Å; L121-L130 HydrophobicContact CD1-CB 3.72Å; L121-L130 HydrophobicContact CD2-CD1 4.3Å; L121-L130 HydrophobicContact CG-CB 4.35Å; R128-L130 PolarHBondContact O-N 2.9Å
131	Q	96.9	Very high	92.4	Very high	121 Å²	121	77.7 Å²	77.7	57%	0.565	40%	0.398	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115	125.3	-177.6	-63.7	-167.5	6.2	0	0	111	E84 L121 V129	E84-Q131 HydrophobicContact CB-CG 4.29Å; E84-Q131 CarbonylContact O-C 3.54Å; E84-Q131 WeakPolarHBondContact O-CA 3.31Å; L121-Q131 WeakPolarHBondContact CD1-O 3.41Å; V129-Q131 PolarHBondContact O-N 2.97Å
132	W	98.5	Very high	92.4	Very high	10 Å²	10	77.7 Å²	77.7	4%	0.038	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	141.8	167.9	-74.9	99	0	0	0	109.9	W47 T83 E84 D86 P88 L105 M120 L121	W47-W132 HydrophobicContact CG-CZ2 4.36Å; T83-W132 VanDerWaalsContact OG1-CD1 3.29Å; T83-W132 PolarHBondContact OG1-NE1 3.46Å; T83-W132 VanDerWaalsContact OG1-NE1 3.14Å; E84-W132 PolarHBondContact O-N 2.92Å; D86-W132 PolarHBondContact N-O 2.69Å; D86-W132 WeakPolarHBondContact O-CB 3.43Å; P88-W132 VanDerWaalsContact CD-CD2 3.4Å; P88-W132 VanDerWaalsContact CD-CG 3.43Å; P88-W132 HydrophobicContact CG-CD2 3.95Å; P88-W132 HydrophobicContact CG-CE3 4.17Å; P88-W132 HydrophobicContact CG-CG 4.46Å; P88-W132 HydrophobicContact CG-CH2 4.33Å; P88-W132 HydrophobicContact CG-CZ2 4.12Å; P88-W132 HydrophobicContact CG-CZ3 4.36Å; L105-W132 HydrophobicContact CB-CH2 4.18Å; L105-W132 HydrophobicContact CB-CZ3 3.98Å; L105-W132 HydrophobicContact CD2-CH2 4.1Å; L105-W132 HydrophobicContact CD2-CZ3 4.29Å; M120-W132 WeakPolarHBondContact O-CA 3.44Å; L121-W132 HydrophobicContact CB-CD2 3.92Å; L121-W132 HydrophobicContact CB-CE3 3.69Å; L121-W132 HydrophobicContact CB-CH2 4.1Å; L121-W132 HydrophobicContact CB-CZ2 4.31Å; L121-W132 HydrophobicContact CB-CZ3 3.78Å; L121-W132 HydrophobicContact CD1-CD2 4.14Å; L121-W132 HydrophobicContact CD1-CG 4.07Å; L121-W132 HydrophobicContact CD2-CD2 4.32Å; L121-W132 HydrophobicContact CD2-CH2 4.33Å; L121-W132 HydrophobicContact CD2-CZ2 3.83Å; L121-W132 HydrophobicContact CG-CD2 4.37Å
133	E	98.4	Very high	92.5	Very high	98 Å²	98	76.1 Å²	76.1	46%	0.458	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	125	171.8	-167.4	-175.8	160	0	0	108.2	Y119 M120 I135	Y119-E133 CarbonylContact C-O 3.6Å; Y119-E133 VanDerWaalsContact CA-O 3.31Å; Y119-E133 WeakPolarHBondContact CA-O 3.31Å; M120-E133 WeakPolarHBondContact CE-OE2 3.48Å; M120-E133 PolarHBondContact N-O 2.79Å; M120-E133 PolarHBondContact O-N 2.79Å; E133-I135 HydrophobicContact CB-CD1 4.11Å; E133-I135 HydrophobicContact CG-CD1 3.7Å; E133-I135 WeakPolarHBondContact OE1-CD1 3.41Å
134	R	98.6	Very high	92.7	Very high	98 Å²	98	77 Å²	77	37%	0.37	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	117.1	170.6	-172.2	-169.4	81.4	-149.1	-3.6	107.8	D86 Y119 D136	D86-R134 HydrophobicContact CB-CB 3.82Å; D86-R134 PolarHBondContact OD2-N 3.13Å; D86-R134 VanDerWaalsContact OD2-N 3.09Å; Y119-R134 HydrophobicContact CD1-CB 3.87Å; Y119-R134 HydrophobicContact CD1-CG 4.09Å; Y119-R134 HydrophobicContact CE1-CB 3.8Å; Y119-R134 HydrophobicContact CE1-CG 3.78Å; R134-D136 IonicContact CZ-OD1 3.68Å; R134-D136 IonicContact NE-OD1 3.72Å; R134-D136 PolarHBondContact NE-OD1 3.01Å; R134-D136 IonicContact NH2-OD1 2.76Å; R134-D136 PolarHBondContact NH2-OD1 3.32Å; R134-D136 IonicContact NH2-OD2 3.33Å; R134-D136 PolarHBondContact NH2-OD2 3.36Å; R134-D136 PolarHBondContact O-N 2.82Å
135	I	98.5	Very high	93.1	Very high	19 Å²	19	70.2 Å²	70.2	10%	0.097	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	118.1	179.8	-44.3	-59.3	0	0	0	108.9	F118 M120 E133 C137 F203	F118-I135 HydrophobicContact CD1-CB 3.97Å; F118-I135 HydrophobicContact CD1-CG1 3.96Å; F118-I135 HydrophobicContact CE1-CG1 4.25Å; F118-I135 PolarHBondContact O-N 2.98Å; M120-I135 HydrophobicContact CB-CD1 4.22Å; M120-I135 HydrophobicContact CB-CG1 4.17Å; M120-I135 HydrophobicContact CE-CD1 4.37Å; E133-I135 HydrophobicContact CB-CD1 4.11Å; E133-I135 HydrophobicContact CG-CD1 3.7Å; E133-I135 WeakPolarHBondContact OE1-CD1 3.41Å; I135-C137 VanDerWaalsContact C-N 3.26Å; I135-C137 PolarHBondContact O-N 2.99Å; I135-F203 HydrophobicContact CB-CD1 4.5Å; I135-F203 HydrophobicContact CG1-CD1 4.46Å; I135-F203 HydrophobicContact CG1-CE1 4.3Å; I135-F203 HydrophobicContact CG2-CB 3.84Å; I135-F203 HydrophobicContact CG2-CD1 3.78Å; I135-F203 HydrophobicContact CG2-CD2 4.22Å; I135-F203 HydrophobicContact CG2-CE1 4.36Å; I135-F203 HydrophobicContact CG2-CG 3.69Å
136	D	98.2	Very high	94.1	Very high	113 Å²	113	67.4 Å²	67.4	60%	0.604	35%	0.351	S	S	*	.			trans	-81	80.3	170.7	-68.8	-32	0	0	0	108.6	R134	R134-D136 IonicContact CZ-OD1 3.68Å; R134-D136 IonicContact NE-OD1 3.72Å; R134-D136 PolarHBondContact NE-OD1 3.01Å; R134-D136 IonicContact NH2-OD1 2.76Å; R134-D136 PolarHBondContact NH2-OD1 3.32Å; R134-D136 IonicContact NH2-OD2 3.33Å; R134-D136 PolarHBondContact NH2-OD2 3.36Å; R134-D136 PolarHBondContact O-N 2.82Å
137	C	98.3	Very high	95.5	Very high	31 Å²	31	63.3 Å²	63.3	21%	0.209	32%	0.323	C	S	.	.			trans	-61.5	149.5	-176.4	-58.2	0	0	0	0	112.9	I135 L198 F203 W205	I135-C137 VanDerWaalsContact C-N 3.26Å; I135-C137 PolarHBondContact O-N 2.99Å; C137-L198 HydrophobicContact CB-CD1 4.28Å; C137-F203 CarbonylContact C-O 3.48Å; C137-F203 VanDerWaalsContact CA-O 3.23Å; C137-F203 WeakPolarHBondContact CA-O 3.37Å; C137-F203 VanDerWaalsContact CB-O 3.23Å; C137-F203 WeakPolarHBondContact CB-O 3.16Å; C137-W205 VanDerWaalsContact CB-CD1 3.43Å; C137-W205 VanDerWaalsContact CB-NE1 3.3Å
138	Q	98.1	Very high	96.9	Very high	128 Å²	128	56.8 Å²	56.8	60%	0.598	29%	0.288	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.4	168.1	171.5	-57.9	179.6	16.1	0	0	111.1	F203 T204 W205	Q138-F203 PolarHBondContact N-O 2.81Å; Q138-T204 HydrophobicContact CB-CG2 4.1Å; Q138-T204 WeakPolarHBondContact O-CA 3.47Å; Q138-W205 PolarHBondContact O-N 3.4Å
139	G	96.3	Very high	97.7	Very high	50 Å²	50	47.4 Å²	47.4	52%	0.515	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	78.5	-174.4	179.6	0	0	0	0	0	113.7	P141	G139-P141 WeakPolarHBondContact O-CD 3.35Å
140	I	96.5	Very high	98.1	Very high	93 Å²	93	44.9 Å²	44.9	48%	0.477	24%	0.239	S	C	.	.			trans	-89.4	112.8	179.4	-58.1	177.7	0	0	0	108.2	D169 W205	I140-D169 HydrophobicContact CG2-CB 4.15Å; I140-W205 WeakPolarHBondContact O-CB 3.41Å
141	P	97.5	Very high	98.2	Very high	49 Å²	49	44.1 Å²	44.1	32%	0.318	24%	0.235	S	C	.	.	P	Polyproline II helix	trans	-71.3	161.7	179.9	31.7	-35.9	0	0	0	111.1	G139 W205	G139-P141 WeakPolarHBondContact O-CD 3.35Å; P141-W205 HydrophobicContact CB-CG 4.35Å
142	P	98.2	Very high	98.3	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	22%	0.222	C	C	.	.	P	Polyproline II helix	trans	-59.4	157.8	168.3	-10.7	22.3	0	0	0	110.9	F106 N116 H196 W205	F106-P142 HydrophobicContact CE1-CB 4.43Å; F106-P142 HydrophobicContact CE1-CG 4.24Å; F106-P142 HydrophobicContact CE2-CG 3.96Å; F106-P142 HydrophobicContact CZ-CB 3.77Å; F106-P142 HydrophobicContact CZ-CG 3.52Å; N116-P142 WeakPolarHBondContact CB-O 3.49Å; N116-P142 PolarHBondContact ND2-O 3.37Å; P142-H196 WeakPolarHBondContact CA-NE2 3.48Å; P142-H196 HydrophobicContact CG-CB 3.82Å; P142-W205 HydrophobicContact CG-CD2 4.48Å; P142-W205 HydrophobicContact CG-CE3 3.97Å; P142-W205 HydrophobicContact CG-CH2 3.93Å; P142-W205 HydrophobicContact CG-CZ2 4.46Å; P142-W205 HydrophobicContact CG-CZ3 3.65Å
143	S	98.3	Very high	98.3	Very high	12 Å²	12	41.7 Å²	41.7	8%	0.084	23%	0.226	C	C	.	.	P	Polyproline II helix	trans	-58.4	152.4	169.8	64.9	0	0	0	0	111.3	K145	S143-K145 VanDerWaalsContact O-CG 3.26Å; S143-K145 WeakPolarHBondContact O-CG 3.23Å; S143-K145 PolarHBondContact O-N 3.45Å
144	S	98.5	Very high	98.3	Very high	25 Å²	25	43.6 Å²	43.6	18%	0.175	23%	0.233	C	C	.	.	S	Bend	trans	-61.4	115.7	176.8	-73	0	0	0	0	111.2	N114 T115 N116 G164 Y165	N114-S144 WeakPolarHBondContact CB-O 3.29Å; T115-S144 WeakPolarHBondContact O-CA 3.13Å; N116-S144 PolarHBondContact N-OG 2.86Å; S144-G164 VanDerWaalsContact O-CA 3.23Å; S144-G164 WeakPolarHBondContact O-CA 3.44Å; S144-Y165 PolarHBondContact O-N 2.85Å; S144-Y165 VanDerWaalsContact O-N 3.14Å
145	K	98.8	Very high	98.3	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	162.6	-170.9	64.1	-168.8	174.5	165	0	113.6	F106 G108 T115 S143 L148 G161 Y163 N192	F106-K145 HydrophobicContact CE1-CG 4.38Å; G108-K145 PolarHBondContact N-O 2.66Å; T115-K145 PolarHBondContact O-N 3.14Å; T115-K145 VanDerWaalsContact O-N 3.09Å; S143-K145 VanDerWaalsContact O-CG 3.26Å; S143-K145 WeakPolarHBondContact O-CG 3.23Å; S143-K145 PolarHBondContact O-N 3.45Å; K145-L148 HydrophobicContact CG-CD2 4.29Å; K145-G161 VanDerWaalsContact CD-O 3.31Å; K145-G161 WeakPolarHBondContact CD-O 3.47Å; K145-G161 VanDerWaalsContact CE-O 3.26Å; K145-G161 WeakPolarHBondContact CE-O 3.4Å; K145-G161 PolarHBondContact NZ-O 3.45Å; K145-Y163 CarbonylContact C-O 3.49Å; K145-Y163 VanDerWaalsContact CA-O 3.24Å; K145-Y163 WeakPolarHBondContact CA-O 3.5Å; K145-Y163 WeakPolarHBondContact CB-O 3.38Å; K145-N192 PolarHBondContact NZ-OD1 2.82Å
146	D	98.9	Very high	98.3	Very high	3 Å²	3	41.8 Å²	41.8	2%	0.016	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	177.7	174.3	73.7	-23.3	0	0	0	111	G93 H109 N114 L148 G162 Y163	G93-D146 CarbonylContact O-C 3.58Å; G93-D146 WeakPolarHBondContact O-CA 3.13Å; G93-D146 WeakPolarHBondContact O-CB 3.49Å; H109-D146 HydrophobicContact CB-CB 4.21Å; N114-D146 VanDerWaalsContact ND2-CB 3.34Å; N114-D146 WeakPolarHBondContact ND2-CB 3.37Å; N114-D146 PolarHBondContact ND2-N 2.9Å; N114-D146 PolarHBondContact ND2-OD1 3.37Å; N114-D146 VanDerWaalsContact ND2-OD1 3.16Å; D146-L148 VanDerWaalsContact C-N 3.28Å; D146-L148 PolarHBondContact O-N 2.58Å; D146-G162 WeakPolarHBondContact O-CA 3.28Å; D146-Y163 PolarHBondContact N-O 3.11Å; D146-Y163 PolarHBondContact O-N 3.15Å
147	K	98.8	Very high	98.3	Very high	37 Å²	37	36.5 Å²	36.5	16%	0.161	20%	0.2	C	C	.	.	S	Bend	trans	54.3	43.5	176.1	-59.3	178.1	-65.3	-69.2	0	112.4	G93 A219 A220 W321	G93-K147 PolarHBondContact O-N 2.86Å; K147-A219 HydrophobicContact CB-CB 4.19Å; K147-A219 CarbonylContact O-C 3.54Å; K147-A219 WeakPolarHBondContact O-CA 3.3Å; K147-A220 HydrophobicContact CB-CB 4.31Å; K147-A220 HydrophobicContact CD-CB 4.46Å; K147-A220 PolarHBondContact O-N 3.25Å; K147-W321 HydrophobicContact CD-CH2 4.38Å; K147-W321 HydrophobicContact CD-CZ2 4.02Å; K147-W321 HydrophobicContact CG-CZ2 3.93Å
148	L	98.9	Very high	98.4	Very high	15 Å²	15	35 Å²	35	8%	0.079	19%	0.19	C	C	.	.			trans	-107.5	171.1	176.6	71.1	146.5	0	0	0	111.4	C95 F106 K145 D146 F159 F160 G161	C95-L148 HydrophobicContact CB-CD1 4.27Å; C95-L148 HydrophobicContact CB-CD2 3.8Å; C95-L148 HydrophobicContact CB-CG 3.76Å; F106-L148 HydrophobicContact CD1-CD1 3.85Å; F106-L148 HydrophobicContact CD1-CD2 4.19Å; F106-L148 HydrophobicContact CE1-CD1 3.89Å; F106-L148 HydrophobicContact CE1-CD2 4.29Å; K145-L148 HydrophobicContact CG-CD2 4.29Å; D146-L148 VanDerWaalsContact C-N 3.28Å; D146-L148 PolarHBondContact O-N 2.58Å; L148-F159 HydrophobicContact CD1-CB 3.84Å; L148-F159 HydrophobicContact CD1-CD1 3.68Å; L148-F159 HydrophobicContact CD1-CG 4.18Å; L148-F160 WeakPolarHBondContact CB-O 3.32Å; L148-G161 WeakPolarHBondContact CB-O 3.17Å
149	G	98.8	Very high	98.4	Very high	5 Å²	5	29.1 Å²	29.1	5%	0.052	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	167.4	172.9	0	0	0	0	0	113.1	F159 F160 H221	G149-F159 WeakPolarHBondContact O-CA 3.33Å; G149-F160 PolarHBondContact N-O 3.43Å; G149-F160 PolarHBondContact O-N 2.94Å; G149-H221 PolarHBondContact N-NE2 2.9Å
150	V	98.9	Very high	98.5	Very high	19 Å²	19	26.8 Å²	26.8	12%	0.115	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	143.4	178.8	60.4	0	0	0	0	110.6	C95 V97 L157 I158 F159	C95-V150 WeakPolarHBondContact SG-CG1 3.46Å; V97-V150 HydrophobicContact CG1-CB 4.37Å; V97-V150 HydrophobicContact CG1-CG1 3.31Å; V97-V150 HydrophobicContact CG1-CG2 4.13Å; V150-L157 HydrophobicContact CG2-CB 4.4Å; V150-I158 CarbonylContact C-O 3.52Å; V150-I158 VanDerWaalsContact CA-O 3.26Å; V150-I158 WeakPolarHBondContact CA-O 3.16Å; V150-F159 HydrophobicContact CB-CD1 3.73Å; V150-F159 HydrophobicContact CB-CE1 3.85Å; V150-F159 HydrophobicContact CB-CG 4.47Å; V150-F159 HydrophobicContact CG2-CD1 3.75Å; V150-F159 HydrophobicContact CG2-CD2 4.48Å; V150-F159 HydrophobicContact CG2-CE1 3.62Å; V150-F159 HydrophobicContact CG2-CE2 4.39Å; V150-F159 HydrophobicContact CG2-CG 4.21Å; V150-F159 HydrophobicContact CG2-CZ 3.97Å
151	W	98.9	Very high	98.7	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	143.9	168.3	-51.4	-67.4	0	0	0	109.7	I158 F160 T225 G230 F231 V232 L248 L250 W255	W151-I158 HydrophobicContact CB-CB 4.46Å; W151-I158 HydrophobicContact CE3-CB 3.99Å; W151-I158 HydrophobicContact CE3-CG2 3.7Å; W151-I158 HydrophobicContact CZ3-CG2 4.04Å; W151-I158 PolarHBondContact N-O 3.14Å; W151-I158 WeakPolarHBondContact O-CD1 3.42Å; W151-I158 PolarHBondContact O-N 3.15Å; W151-F160 HydrophobicContact CH2-CB 3.4Å; W151-F160 HydrophobicContact CH2-CD1 4.09Å; W151-F160 HydrophobicContact CH2-CD2 4.28Å; W151-F160 AromaticContact CH2-CG 3.67Å; W151-F160 HydrophobicContact CH2-CG 3.67Å; W151-F160 HydrophobicContact CZ2-CB 4.18Å; W151-F160 HydrophobicContact CZ2-CD1 4.45Å; W151-F160 HydrophobicContact CZ2-CG 4.43Å; W151-F160 HydrophobicContact CZ3-CB 3.62Å; W151-F160 HydrophobicContact CZ3-CG 4.29Å; W151-T225 WeakPolarHBondContact CA-OG1 3.36Å; W151-T225 HydrophobicContact CB-CG2 4.44Å; W151-T225 WeakPolarHBondContact CB-OG1 3.42Å; W151-G230 VanDerWaalsContact CE2-C 3.48Å; W151-G230 WeakPolarHBondContact CZ2-O 3.48Å; W151-G230 VanDerWaalsContact NE1-CA 3.27Å; W151-F231 PolarHBondContact NE1-O 3.49Å; W151-V232 HydrophobicContact CZ2-CB 4.19Å; W151-V232 HydrophobicContact CZ2-CG1 4.47Å; W151-L248 HydrophobicContact CE3-CD2 4.49Å; W151-L248 HydrophobicContact CH2-CB 4.33Å; W151-L248 HydrophobicContact CH2-CD2 4.39Å; W151-L248 HydrophobicContact CZ3-CB 4.41Å; W151-L248 HydrophobicContact CZ3-CD2 3.83Å; W151-L250 HydrophobicContact CB-CD1 4.05Å; W151-L250 HydrophobicContact CE3-CD2 4.17Å; W151-W255 AromaticContact CH2-CH2 3.57Å; W151-W255 HydrophobicContact CH2-CH2 3.57Å; W151-W255 HydrophobicContact CH2-CZ2 4.1Å; W151-W255 HydrophobicContact CH2-CZ3 4.44Å; W151-W255 HydrophobicContact CZ2-CH2 4.17Å
152	V	98.8	Very high	98.7	Very high	48 Å²	48	20 Å²	20	29%	0.291	10%	0.1	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	122	175.5	-179.1	0	0	0	0	107.9	V97 V99 L157 T225	V97-V152 HydrophobicContact CB-CG2 3.92Å; V97-V152 HydrophobicContact CG1-CG2 3.68Å; V97-V152 HydrophobicContact CG2-CG2 4.17Å; V99-V152 HydrophobicContact CG2-CG1 3.73Å; V99-V152 HydrophobicContact CG2-CG2 4.17Å; V152-L157 HydrophobicContact CG1-CD2 4.33Å; V152-L157 HydrophobicContact CG2-CD2 4.03Å; V152-T225 PolarHBondContact N-OG1 2.89Å
153	Y	98.8	Very high	98.8	Very high	32 Å²	32	20.8 Å²	20.8	13%	0.125	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	113.3	178.6	-175.2	-119	0	0	0	111.8	N155 K156 N228 L250 D251	Y153-N155 PolarHBondContact O-N 3.05Å; Y153-K156 PolarHBondContact N-O 2.79Å; Y153-K156 VanDerWaalsContact O-CB 3.32Å; Y153-K156 WeakPolarHBondContact O-CB 3.44Å; Y153-K156 PolarHBondContact O-N 2.85Å; Y153-N228 HydrophobicContact CE2-CB 3.8Å; Y153-L250 HydrophobicContact CD1-CB 3.56Å; Y153-L250 HydrophobicContact CD2-CD1 4.41Å; Y153-L250 HydrophobicContact CE1-CB 4Å; Y153-L250 WeakPolarHBondContact CE1-O 3.25Å; Y153-L250 HydrophobicContact CG-CB 3.85Å; Y153-L250 HydrophobicContact CG-CD1 3.97Å; Y153-D251 WeakPolarHBondContact CE1-OD1 3.47Å; Y153-D251 VanDerWaalsContact CZ-OD1 3.28Å; Y153-D251 PolarHBondContact OH-OD1 2.69Å; Y153-D251 PolarHBondContact OH-OD2 3.3Å
154	K	98	Very high	98.8	Very high	139 Å²	139	20.2 Å²	20.2	60%	0.604	10%	0.099	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.8	-129.5	-172.9	-56.3	168.9	176.1	161	0	109.2	K156 D251	K154-K156 PolarHBondContact O-N 2.84Å; K154-D251 IonicContact NZ-OD1 3.47Å; K154-D251 PolarHBondContact NZ-OD1 3.01Å; K154-D251 VanDerWaalsContact NZ-OD1 3.17Å
155	N	98.1	Very high	98.7	Very high	29 Å²	29	21.8 Å²	21.8	16%	0.155	10%	0.102	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81	14.3	176.3	68	-53.6	0	0	0	114.7	Y153 D199 T200 E201	Y153-N155 PolarHBondContact O-N 3.05Å; N155-D199 PolarHBondContact ND2-OD1 2.79Å; N155-D199 PolarHBondContact ND2-OD2 2.89Å; N155-D199 VanDerWaalsContact ND2-OD2 3.09Å; N155-T200 PolarHBondContact O-N 2.77Å; N155-T200 PolarHBondContact O-OG1 2.84Å; N155-E201 HydrophobicContact CB-CG 3.93Å
156	K	98.9	Very high	98.6	Very high	50 Å²	50	26.3 Å²	26.3	22%	0.217	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	131.7	-170.6	-61.1	172.7	-173.2	62.7	0	111	Y153 K154 I158 I197	Y153-K156 PolarHBondContact N-O 2.79Å; Y153-K156 VanDerWaalsContact O-CB 3.32Å; Y153-K156 WeakPolarHBondContact O-CB 3.44Å; Y153-K156 PolarHBondContact O-N 2.85Å; K154-K156 PolarHBondContact O-N 2.84Å; K156-I158 HydrophobicContact CB-CD1 3.63Å; K156-I158 HydrophobicContact CB-CG1 4.08Å; K156-I158 WeakPolarHBondContact O-CD1 3.43Å; K156-I197 HydrophobicContact CB-CG2 3.95Å; K156-I197 HydrophobicContact CD-CG2 4.08Å; K156-I197 HydrophobicContact CG-CG2 3.84Å
157	L	98.9	Very high	98.4	Very high	2 Å²	2	27.4 Å²	27.4	1%	0.01	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	113.5	161.7	-52.2	-174.1	0	0	0	107.8	V97 V99 Y104 F118 V150 V152 F159 I197 L198 T200	V97-L157 HydrophobicContact CG2-CD1 4.13Å; V97-L157 HydrophobicContact CG2-CD2 3.86Å; V99-L157 HydrophobicContact CG2-CD2 4.23Å; Y104-L157 HydrophobicContact CD1-CD1 4.35Å; Y104-L157 HydrophobicContact CD2-CD1 4.02Å; Y104-L157 HydrophobicContact CG-CD1 3.8Å; F118-L157 HydrophobicContact CE2-CD1 4Å; F118-L157 HydrophobicContact CZ-CD1 3.84Å; V150-L157 HydrophobicContact CG2-CB 4.4Å; V152-L157 HydrophobicContact CG1-CD2 4.33Å; V152-L157 HydrophobicContact CG2-CD2 4.03Å; L157-F159 HydrophobicContact CB-CD2 4.49Å; L157-F159 HydrophobicContact CB-CE2 3.68Å; L157-F159 HydrophobicContact CB-CZ 4.08Å; L157-F159 HydrophobicContact CD1-CZ 4.46Å; L157-I197 WeakPolarHBondContact O-CA 3.34Å; L157-L198 HydrophobicContact CB-CB 4.36Å; L157-L198 PolarHBondContact N-O 3.36Å; L157-L198 PolarHBondContact O-N 3.12Å; L157-T200 HydrophobicContact CD1-CG2 4.1Å; L157-T200 HydrophobicContact CD2-CG2 4.38Å; L157-T200 HydrophobicContact CG-CG2 3.78Å
158	I	98.9	Very high	97.5	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	107.2	-174.4	-52.1	94.2	0	0	0	109.4	V150 W151 K156 V195 H196 I197 W253	V150-I158 CarbonylContact C-O 3.52Å; V150-I158 VanDerWaalsContact CA-O 3.26Å; V150-I158 WeakPolarHBondContact CA-O 3.16Å; W151-I158 HydrophobicContact CB-CB 4.46Å; W151-I158 HydrophobicContact CE3-CB 3.99Å; W151-I158 HydrophobicContact CE3-CG2 3.7Å; W151-I158 HydrophobicContact CZ3-CG2 4.04Å; W151-I158 PolarHBondContact N-O 3.14Å; W151-I158 WeakPolarHBondContact O-CD1 3.42Å; W151-I158 PolarHBondContact O-N 3.15Å; K156-I158 HydrophobicContact CB-CD1 3.63Å; K156-I158 HydrophobicContact CB-CG1 4.08Å; K156-I158 WeakPolarHBondContact O-CD1 3.43Å; I158-V195 HydrophobicContact CG2-CG1 3.64Å; I158-H196 CarbonylContact C-O 3.58Å; I158-H196 VanDerWaalsContact CA-O 3.27Å; I158-H196 WeakPolarHBondContact CA-O 3.3Å; I158-I197 HydrophobicContact CG1-CG1 4.08Å; I158-I197 HydrophobicContact CG2-CG1 4.37Å; I158-W253 HydrophobicContact CG1-CH2 4.11Å; I158-W253 HydrophobicContact CG1-CZ3 4.3Å; I158-W253 HydrophobicContact CG2-CZ3 4.18Å
159	F	98.9	Very high	96.4	Very high	4 Å²	4	38.8 Å²	38.8	2%	0.018	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	139.8	-177.6	-62.9	-87.1	0	0	0	111.4	C95 F106 F118 L148 G149 V150 L157 V195 H196 L198 W205	C95-F159 HydrophobicContact CB-CE1 4.34Å; F106-F159 HydrophobicContact CB-CD1 4.3Å; F106-F159 HydrophobicContact CB-CE1 3.51Å; F106-F159 HydrophobicContact CB-CZ 3.66Å; F106-F159 AromaticContact CD1-CD1 3.91Å; F106-F159 HydrophobicContact CD1-CD1 3.91Å; F106-F159 AromaticContact CD1-CE1 3.99Å; F106-F159 HydrophobicContact CD1-CE1 3.99Å; F106-F159 HydrophobicContact CD1-CG 4.41Å; F106-F159 HydrophobicContact CG-CD1 4.29Å; F106-F159 AromaticContact CG-CE1 3.94Å; F106-F159 HydrophobicContact CG-CE1 3.94Å; F106-F159 HydrophobicContact CG-CZ 4.12Å; F118-F159 HydrophobicContact CE2-CZ 4.23Å; L148-F159 HydrophobicContact CD1-CB 3.84Å; L148-F159 HydrophobicContact CD1-CD1 3.68Å; L148-F159 HydrophobicContact CD1-CG 4.18Å; G149-F159 WeakPolarHBondContact O-CA 3.33Å; V150-F159 HydrophobicContact CB-CD1 3.73Å; V150-F159 HydrophobicContact CB-CE1 3.85Å; V150-F159 HydrophobicContact CB-CG 4.47Å; V150-F159 HydrophobicContact CG2-CD1 3.75Å; V150-F159 HydrophobicContact CG2-CD2 4.48Å; V150-F159 HydrophobicContact CG2-CE1 3.62Å; V150-F159 HydrophobicContact CG2-CE2 4.39Å; V150-F159 HydrophobicContact CG2-CG 4.21Å; V150-F159 HydrophobicContact CG2-CZ 3.97Å; L157-F159 HydrophobicContact CB-CD2 4.49Å; L157-F159 HydrophobicContact CB-CE2 3.68Å; L157-F159 HydrophobicContact CB-CZ 4.08Å; L157-F159 HydrophobicContact CD1-CZ 4.46Å; F159-V195 WeakPolarHBondContact O-CA 3.37Å; F159-H196 PolarHBondContact N-O 3.38Å; F159-H196 PolarHBondContact O-N 3.35Å; F159-L198 HydrophobicContact CE2-CB 4.29Å; F159-W205 AromaticContact CD2-CH2 3.61Å; F159-W205 HydrophobicContact CD2-CH2 3.61Å; F159-W205 AromaticContact CD2-CZ3 3.54Å; F159-W205 HydrophobicContact CD2-CZ3 3.54Å; F159-W205 AromaticContact CE2-CH2 3.49Å; F159-W205 HydrophobicContact CE2-CH2 3.49Å; F159-W205 VanDerWaalsContact CE2-CH2 3.49Å; F159-W205 AromaticContact CE2-CZ3 3.83Å; F159-W205 HydrophobicContact CE2-CZ3 3.83Å; F159-W205 HydrophobicContact CZ-CH2 4.35Å
160	F	98.9	Very high	95.5	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	134.5	-179.3	175.4	-110.1	0	0	0	112.9	L148 G149 W151 D193 H194 V195 T214 P215 R218 H221 V232 W255	L148-F160 WeakPolarHBondContact CB-O 3.32Å; G149-F160 PolarHBondContact N-O 3.43Å; G149-F160 PolarHBondContact O-N 2.94Å; W151-F160 HydrophobicContact CH2-CB 3.4Å; W151-F160 HydrophobicContact CH2-CD1 4.09Å; W151-F160 HydrophobicContact CH2-CD2 4.28Å; W151-F160 AromaticContact CH2-CG 3.67Å; W151-F160 HydrophobicContact CH2-CG 3.67Å; W151-F160 HydrophobicContact CZ2-CB 4.18Å; W151-F160 HydrophobicContact CZ2-CD1 4.45Å; W151-F160 HydrophobicContact CZ2-CG 4.43Å; W151-F160 HydrophobicContact CZ3-CB 3.62Å; W151-F160 HydrophobicContact CZ3-CG 4.29Å; F160-D193 HydrophobicContact CE2-CB 4.24Å; F160-D193 VanDerWaalsContact CE2-O 3.22Å; F160-D193 WeakPolarHBondContact CE2-O 3.31Å; F160-H194 WeakPolarHBondContact CA-O 3.26Å; F160-V195 HydrophobicContact CD2-CG2 3.82Å; F160-V195 HydrophobicContact CE2-CG2 4.42Å; F160-T214 HydrophobicContact CE2-CG2 4.38Å; F160-P215 HydrophobicContact CZ-CB 4.07Å; F160-P215 HydrophobicContact CZ-CG 3.97Å; F160-R218 HydrophobicContact CE1-CG 4.05Å; F160-R218 HydrophobicContact CZ-CG 4.46Å; F160-H221 AromaticContact CD1-NE2 3.54Å; F160-H221 PolarHBondContact O-CE1 2.99Å; F160-H221 VanDerWaalsContact O-CE1 3.27Å; F160-H221 PolarHBondContact O-NE2 3.1Å; F160-H221 VanDerWaalsContact O-NE2 3.15Å; F160-V232 HydrophobicContact CD1-CB 4.46Å; F160-V232 HydrophobicContact CD1-CG2 4.14Å; F160-V232 HydrophobicContact CE1-CB 4.41Å; F160-V232 HydrophobicContact CE1-CG1 4.15Å; F160-V232 HydrophobicContact CE1-CG2 3.94Å; F160-W255 HydrophobicContact CD1-CH2 4.44Å; F160-W255 HydrophobicContact CD2-CH2 4.09Å; F160-W255 AromaticContact CD2-CZ2 3.79Å; F160-W255 HydrophobicContact CD2-CZ2 3.79Å; F160-W255 HydrophobicContact CE1-CH2 4.27Å; F160-W255 AromaticContact CE2-CH2 3.89Å; F160-W255 HydrophobicContact CE2-CH2 3.89Å; F160-W255 AromaticContact CE2-CZ2 3.58Å; F160-W255 HydrophobicContact CE2-CZ2 3.58Å; F160-W255 HydrophobicContact CG-CH2 4.36Å; F160-W255 HydrophobicContact CG-CZ2 4.46Å; F160-W255 AromaticContact CZ-CH2 3.99Å; F160-W255 HydrophobicContact CZ-CH2 3.99Å; F160-W255 HydrophobicContact CZ-CZ2 4.12Å
161	G	98.9	Very high	95.2	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	62.2	-151.1	172	0	0	0	0	0	114.7	K145 L148 N192 H194	K145-G161 VanDerWaalsContact CD-O 3.31Å; K145-G161 WeakPolarHBondContact CD-O 3.47Å; K145-G161 VanDerWaalsContact CE-O 3.26Å; K145-G161 WeakPolarHBondContact CE-O 3.4Å; K145-G161 PolarHBondContact NZ-O 3.45Å; L148-G161 WeakPolarHBondContact CB-O 3.17Å; G161-N192 WeakPolarHBondContact CA-O 3.33Å; G161-N192 WeakPolarHBondContact CA-OD1 3.21Å; G161-N192 PolarHBondContact O-OD1 3.08Å; G161-H194 PolarHBondContact N-O 3.43Å; G161-H194 VanDerWaalsContact N-O 3.11Å
162	G	98.9	Very high	95.1	Very high	0 Å²	0	53 Å²	53	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	118.5	176.2	179.9	0	0	0	0	0	113.7	D146 W191 N192 R218	D146-G162 WeakPolarHBondContact O-CA 3.28Å; G162-W191 WeakPolarHBondContact O-CA 3.43Å; G162-N192 PolarHBondContact O-N 3.38Å; G162-N192 PolarHBondContact O-ND2 2.84Å; G162-N192 VanDerWaalsContact O-ND2 3.08Å; G162-R218 PolarHBondContact N-O 3.01Å
163	Y	98.8	Very high	95	Very high	16 Å²	16	53.2 Å²	53.2	6%	0.063	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	128	179.1	-172.1	-99.8	0	0	0	110.4	K145 D146 D178 R189 G190 W191	K145-Y163 CarbonylContact C-O 3.49Å; K145-Y163 VanDerWaalsContact CA-O 3.24Å; K145-Y163 WeakPolarHBondContact CA-O 3.5Å; K145-Y163 WeakPolarHBondContact CB-O 3.38Å; D146-Y163 PolarHBondContact N-O 3.11Å; D146-Y163 PolarHBondContact O-N 3.15Å; Y163-D178 HydrophobicContact CE2-CB 3.71Å; Y163-D178 WeakPolarHBondContact OH-CB 3.39Å; Y163-D178 PolarHBondContact OH-OD2 2.89Å; Y163-R189 HydrophobicContact CD1-CB 4.24Å; Y163-R189 HydrophobicContact CE1-CB 3.6Å; Y163-R189 HydrophobicContact CE1-CG 4.42Å; Y163-R189 HydrophobicContact CE2-CB 4.45Å; Y163-G190 CarbonylContact C-O 3.5Å; Y163-G190 VanDerWaalsContact CA-O 3.29Å; Y163-G190 WeakPolarHBondContact CA-O 3.48Å; Y163-G190 WeakPolarHBondContact CD2-O 3.45Å; Y163-W191 AromaticContact CD2-CD1 3.71Å; Y163-W191 HydrophobicContact CD2-CD2 4.23Å; Y163-W191 AromaticContact CD2-CE2 3.9Å; Y163-W191 HydrophobicContact CD2-CG 4.12Å; Y163-W191 AromaticContact CD2-NE1 3.56Å; Y163-W191 HydrophobicContact CE2-CD2 4.35Å; Y163-W191 AromaticContact CE2-CE2 3.93Å; Y163-W191 HydrophobicContact CE2-CZ2 4.16Å
164	G	98.4	Very high	94.9	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-176.9	-166.4	-171	0	0	0	0	0	113.7	S144 R189 G190	S144-G164 VanDerWaalsContact O-CA 3.23Å; S144-G164 WeakPolarHBondContact O-CA 3.44Å; G164-R189 CarbonylContact O-C 3.45Å; G164-R189 WeakPolarHBondContact O-CA 3.43Å; G164-R189 VanDerWaalsContact O-CB 3.27Å; G164-R189 WeakPolarHBondContact O-CB 3.27Å; G164-G190 PolarHBondContact N-O 3.18Å; G164-G190 PolarHBondContact O-N 2.75Å
165	Y	97.8	Very high	94.9	Very high	59 Å²	59	50.5 Å²	50.5	23%	0.231	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	159.7	178.9	-54	-56.1	0	0	0	111.6	G113 N114 S144 F175 H187 R189	G113-Y165 VanDerWaalsContact CA-OH 3.27Å; G113-Y165 WeakPolarHBondContact CA-OH 3.32Å; N114-Y165 HydrophobicContact CB-CD2 4.24Å; N114-Y165 HydrophobicContact CB-CE2 3.78Å; N114-Y165 PolarHBondContact N-OH 3.28Å; S144-Y165 PolarHBondContact O-N 2.85Å; S144-Y165 VanDerWaalsContact O-N 3.14Å; Y165-F175 WeakPolarHBondContact O-CE2 3.45Å; Y165-H187 HydrophobicContact CD1-CB 3.93Å; Y165-H187 HydrophobicContact CE1-CB 3.67Å; Y165-R189 HydrophobicContact CD1-CG 3.61Å; Y165-R189 HydrophobicContact CE1-CG 3.69Å
166	L	96.8	Very high	94.9	Very high	95 Å²	95	51.4 Å²	51.4	50%	0.497	26%	0.264	S	S	.	.	P	Polyproline II helix	trans	-53.4	131.4	170.2	-175.9	75.5	0	0	0	109.3	F175 F177	L166-F175 HydrophobicContact CB-CE1 4.33Å; L166-F175 HydrophobicContact CB-CZ 4.41Å; L166-F175 HydrophobicContact CD1-CD1 3.57Å; L166-F175 HydrophobicContact CD1-CE1 3.77Å; L166-F175 HydrophobicContact CD1-CG 4.23Å; L166-F177 HydrophobicContact CB-CE1 4.39Å; L166-F177 HydrophobicContact CB-CZ 4.09Å; L166-F177 HydrophobicContact CD1-CE2 4.09Å; L166-F177 HydrophobicContact CD1-CZ 3.82Å; L166-F177 HydrophobicContact CD2-CZ 4.26Å; L166-F177 HydrophobicContact CG-CZ 4.28Å
167	P	94.9	Very high	94.9	Very high	25 Å²	25	52.6 Å²	52.6	16%	0.162	27%	0.269	C	S	.	.	P	Polyproline II helix	trans	-62.1	136.6	173.7	27.3	-36.2	0	0	0	111.1	V171 F175	P167-V171 HydrophobicContact CB-CB 4.18Å; P167-V171 HydrophobicContact CB-CG2 3.88Å; P167-F175 HydrophobicContact CG-CB 4.39Å
168	E	78.7	Confident	94.8	Very high	195 Å²	195	53 Å²	53	91%	0.911	27%	0.271	S	S	*	.	S	Bend	trans	-79	-31.7	-178.8	-65.4	179.3	-172.7	0	0	112.5
169	D	76.3	Confident	94.6	Very high	97 Å²	97	60.2 Å²	60.2	52%	0.519	31%	0.305	S	S	.	.	S	Bend	trans	-104.2	171.4	-177	-74.3	-42.8	0	0	0	113	I140 V171	I140-D169 HydrophobicContact CG2-CB 4.15Å; D169-V171 PolarHBondContact O-N 3.48Å
170	K	79.8	Confident	94.4	Very high	213 Å²	213	63.5 Å²	63.5	93%	0.926	33%	0.326	S	S	*	.			trans	-67.8	64.4	170.2	-68.6	-174.8	-179.8	-179.7	0	111.5
171	V	93.1	Very high	94.1	Very high	22 Å²	22	63.5 Å²	63.5	13%	0.133	33%	0.326	C	S	.	.			trans	-69.4	132.6	170.6	178.7	0	0	0	0	108.4	P167 D169 H194 H196	P167-V171 HydrophobicContact CB-CB 4.18Å; P167-V171 HydrophobicContact CB-CG2 3.88Å; D169-V171 PolarHBondContact O-N 3.48Å; V171-H194 HydrophobicContact CG1-CB 4.23Å; V171-H194 WeakPolarHBondContact CG1-ND1 3.39Å; V171-H196 VanDerWaalsContact CG1-CE1 3.44Å; V171-H196 WeakPolarHBondContact CG1-CE1 3.31Å
172	L	95.4	Very high	93.8	Very high	87 Å²	87	68.5 Å²	68.5	46%	0.455	35%	0.348	S	S	.	.	S	Bend	trans	-71.5	140.8	174.2	-63.7	174.7	0	0	0	110.8	H194 Q207 I209	L172-H194 PolarHBondContact O-CD2 2.64Å; L172-Q207 HydrophobicContact CD1-CB 4.28Å; L172-Q207 PolarHBondContact O-NE2 3.48Å; L172-I209 HydrophobicContact CD1-CD1 3.54Å
173	G	96.7	Very high	93.3	Very high	53 Å²	53	79.4 Å²	79.4	55%	0.546	39%	0.389	S	S	.	.	S	Bend	trans	112.1	-164.9	-175.9	0	0	0	0	0	111.4	D193	G173-D193 WeakPolarHBondContact CA-OD1 3.49Å
174	T	97.8	Very high	92.4	Very high	73 Å²	73	83.8 Å²	83.8	45%	0.448	41%	0.413	S	S	.	.			trans	-123.4	143.7	-178.1	73.1	0	0	0	0	111.1	N192 D193 H194 P217	T174-N192 VanDerWaalsContact O-CA 3.26Å; T174-N192 WeakPolarHBondContact O-CA 3.48Å; T174-D193 PolarHBondContact N-OD1 2.83Å; T174-D193 PolarHBondContact O-N 3.42Å; T174-D193 VanDerWaalsContact OG1-CG 3.3Å; T174-D193 PolarHBondContact OG1-OD2 2.79Å; T174-H194 PolarHBondContact O-NE2 2.99Å; T174-P217 WeakPolarHBondContact OG1-CG 3.46Å
175	F	98.3	Very high	91.5	Very high	40 Å²	40	85.3 Å²	85.3	18%	0.175	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	136.8	172.2	177.2	-84.5	0	0	0	108.6	Y165 L166 P167 F177 G190 W191 N192	Y165-F175 WeakPolarHBondContact O-CE2 3.45Å; L166-F175 HydrophobicContact CB-CE1 4.33Å; L166-F175 HydrophobicContact CB-CZ 4.41Å; L166-F175 HydrophobicContact CD1-CD1 3.57Å; L166-F175 HydrophobicContact CD1-CE1 3.77Å; L166-F175 HydrophobicContact CD1-CG 4.23Å; P167-F175 HydrophobicContact CG-CB 4.39Å; F175-F177 AromaticContact CE1-CD1 3.68Å; F175-F177 HydrophobicContact CE1-CD1 3.68Å; F175-F177 HydrophobicContact CE1-CD2 4.11Å; F175-F177 AromaticContact CE1-CE1 3.68Å; F175-F177 HydrophobicContact CE1-CE1 3.68Å; F175-F177 HydrophobicContact CE1-CE2 4.13Å; F175-F177 AromaticContact CE1-CG 3.89Å; F175-F177 HydrophobicContact CE1-CG 3.89Å; F175-F177 AromaticContact CE1-CZ 3.92Å; F175-F177 HydrophobicContact CE1-CZ 3.92Å; F175-F177 HydrophobicContact CZ-CD1 4.2Å; F175-F177 HydrophobicContact CZ-CE1 4.18Å; F175-G190 VanDerWaalsContact CZ-CA 3.43Å; F175-W191 CarbonylContact C-O 3.37Å; F175-W191 WeakPolarHBondContact CA-O 3.23Å; F175-N192 HydrophobicContact CD2-CB 4.24Å
176	E	98.3	Very high	90.7	Very high	49 Å²	49	88.3 Å²	88.3	23%	0.229	45%	0.453	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	126.6	177	-167.5	176	107	0	0	111.2	G190 W191 Y237 R238	E176-G190 CarbonylContact O-C 3.6Å; E176-G190 WeakPolarHBondContact O-CA 3.17Å; E176-W191 PolarHBondContact N-O 3.09Å; E176-W191 PolarHBondContact O-N 2.89Å; E176-Y237 HydrophobicContact CB-CE2 4.34Å; E176-Y237 VanDerWaalsContact CD-OH 3.29Å; E176-Y237 WeakPolarHBondContact OE1-CE2 3.18Å; E176-Y237 PolarHBondContact OE1-OH 2.83Å; E176-Y237 PolarHBondContact OE2-OH 3.46Å; E176-R238 WeakPolarHBondContact OE1-CG 3.42Å; E176-R238 IonicContact OE1-CZ 3.27Å; E176-R238 VanDerWaalsContact OE1-CZ 3.27Å; E176-R238 IonicContact OE1-NE 2.62Å; E176-R238 PolarHBondContact OE1-NE 2.88Å; E176-R238 IonicContact OE1-NH2 3.16Å; E176-R238 PolarHBondContact OE1-NH2 3.38Å; E176-R238 VanDerWaalsContact OE1-NH2 3.16Å; E176-R238 IonicContact OE2-CZ 3.58Å; E176-R238 IonicContact OE2-NE 3.63Å; E176-R238 IonicContact OE2-NH2 2.7Å; E176-R238 PolarHBondContact OE2-NH2 3.07Å
177	F	98.1	Very high	90.5	Very high	75 Å²	75	89.7 Å²	89.7	33%	0.329	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.6	143.2	178	-76	-73	0	0	0	112.3	L166 F175 F182 P188	L166-F177 HydrophobicContact CB-CE1 4.39Å; L166-F177 HydrophobicContact CB-CZ 4.09Å; L166-F177 HydrophobicContact CD1-CE2 4.09Å; L166-F177 HydrophobicContact CD1-CZ 3.82Å; L166-F177 HydrophobicContact CD2-CZ 4.26Å; L166-F177 HydrophobicContact CG-CZ 4.28Å; F175-F177 AromaticContact CE1-CD1 3.68Å; F175-F177 HydrophobicContact CE1-CD1 3.68Å; F175-F177 HydrophobicContact CE1-CD2 4.11Å; F175-F177 AromaticContact CE1-CE1 3.68Å; F175-F177 HydrophobicContact CE1-CE1 3.68Å; F175-F177 HydrophobicContact CE1-CE2 4.13Å; F175-F177 AromaticContact CE1-CG 3.89Å; F175-F177 HydrophobicContact CE1-CG 3.89Å; F175-F177 AromaticContact CE1-CZ 3.92Å; F175-F177 HydrophobicContact CE1-CZ 3.92Å; F175-F177 HydrophobicContact CZ-CD1 4.2Å; F175-F177 HydrophobicContact CZ-CE1 4.18Å; F177-F182 HydrophobicContact CB-CE2 3.8Å; F177-F182 HydrophobicContact CB-CZ 4.22Å; F177-F182 HydrophobicContact CD1-CE2 4.02Å; F177-F182 AromaticContact CD1-CZ 3.83Å; F177-F182 HydrophobicContact CD1-CZ 3.83Å; F177-F182 HydrophobicContact CD2-CZ 4.19Å; F177-F182 HydrophobicContact CE1-CZ 4.23Å; F177-F182 AromaticContact CG-CE2 3.91Å; F177-F182 HydrophobicContact CG-CE2 3.91Å; F177-F182 AromaticContact CG-CZ 3.82Å; F177-F182 HydrophobicContact CG-CZ 3.82Å; F177-P188 HydrophobicContact CD1-CB 3.92Å; F177-P188 HydrophobicContact CE1-CB 3.78Å
178	D	97.7	Very high	90.5	Very high	9 Å²	9	90.6 Å²	90.6	5%	0.048	46%	0.463	C	S	.	.			trans	-85.2	108.1	159.5	177.4	-4.1	0	0	0	107.9	Y163 T180 S181 R189 W191	Y163-D178 HydrophobicContact CE2-CB 3.71Å; Y163-D178 WeakPolarHBondContact OH-CB 3.39Å; Y163-D178 PolarHBondContact OH-OD2 2.89Å; D178-T180 VanDerWaalsContact CG-OG1 3.25Å; D178-T180 PolarHBondContact O-N 3.14Å; D178-T180 VanDerWaalsContact O-N 3.07Å; D178-T180 WeakPolarHBondContact OD1-CB 3.34Å; D178-T180 PolarHBondContact OD1-N 3.5Å; D178-T180 PolarHBondContact OD1-OG1 2.89Å; D178-T180 PolarHBondContact OD2-OG1 2.84Å; D178-S181 VanDerWaalsContact O-CB 3.26Å; D178-S181 WeakPolarHBondContact O-CB 3.26Å; D178-S181 PolarHBondContact O-N 2.78Å; D178-S181 PolarHBondContact O-OG 3.43Å; D178-R189 PolarHBondContact N-O 2.74Å; D178-W191 HydrophobicContact CB-CE3 4.33Å; D178-W191 HydrophobicContact CB-CH2 3.54Å; D178-W191 HydrophobicContact CB-CZ2 4.15Å; D178-W191 HydrophobicContact CB-CZ3 3.65Å
179	E	94.9	Very high	91.5	Very high	153 Å²	153	83 Å²	83	72%	0.715	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.5	-28.9	-178	-65.7	-175.5	-177.4	0	0	112.7	S181 F182 W183	E179-S181 PolarHBondContact O-N 3.45Å; E179-F182 PolarHBondContact O-N 2.89Å; E179-W183 PolarHBondContact O-NE1 2.87Å; E179-W183 VanDerWaalsContact O-NE1 3.09Å
180	T	93.8	Very high	92.5	Very high	73 Å²	73	78.4 Å²	78.4	45%	0.448	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-24.5	178.1	72	0	0	0	0	112.5	D178 F182 W183 N184	D178-T180 VanDerWaalsContact CG-OG1 3.25Å; D178-T180 PolarHBondContact O-N 3.14Å; D178-T180 VanDerWaalsContact O-N 3.07Å; D178-T180 WeakPolarHBondContact OD1-CB 3.34Å; D178-T180 PolarHBondContact OD1-N 3.5Å; D178-T180 PolarHBondContact OD1-OG1 2.89Å; D178-T180 PolarHBondContact OD2-OG1 2.84Å; T180-F182 VanDerWaalsContact C-N 3.32Å; T180-F182 PolarHBondContact O-N 2.88Å; T180-W183 PolarHBondContact O-N 2.77Å; T180-N184 PolarHBondContact O-N 2.96Å; T180-N184 PolarHBondContact O-ND2 2.85Å; T180-N184 VanDerWaalsContact O-ND2 3.12Å
181	S	93.7	Very high	93.4	Very high	0 Å²	0	68.6 Å²	68.6	0%	0	36%	0.359	C	S	.	.	H	α-helix	trans	-70	-25.1	-177.6	74.4	0	0	0	0	114	D178 E179 W183 N184 S185 P188 R189	D178-S181 VanDerWaalsContact O-CB 3.26Å; D178-S181 WeakPolarHBondContact O-CB 3.26Å; D178-S181 PolarHBondContact O-N 2.78Å; D178-S181 PolarHBondContact O-OG 3.43Å; E179-S181 PolarHBondContact O-N 3.45Å; S181-W183 PolarHBondContact O-N 2.93Å; S181-N184 WeakPolarHBondContact CA-OD1 3.36Å; S181-S185 WeakPolarHBondContact O-CB 3.21Å; S181-S185 PolarHBondContact O-N 3.1Å; S181-S185 VanDerWaalsContact O-N 3.11Å; S181-P188 WeakPolarHBondContact OG-CA 3.4Å; S181-R189 PolarHBondContact OG-N 2.91Å; S181-R189 PolarHBondContact OG-O 2.75Å; S181-R189 VanDerWaalsContact OG-O 3.04Å
182	F	92.1	Very high	93.7	Very high	105 Å²	105	67.6 Å²	67.6	46%	0.461	35%	0.352	S	S	.	.	H	α-helix	trans	-64	-23.4	176.6	-72.4	-90.1	0	0	0	113	F177 E179 T180 P188	F177-F182 HydrophobicContact CB-CE2 3.8Å; F177-F182 HydrophobicContact CB-CZ 4.22Å; F177-F182 HydrophobicContact CD1-CE2 4.02Å; F177-F182 AromaticContact CD1-CZ 3.83Å; F177-F182 HydrophobicContact CD1-CZ 3.83Å; F177-F182 HydrophobicContact CD2-CZ 4.19Å; F177-F182 HydrophobicContact CE1-CZ 4.23Å; F177-F182 AromaticContact CG-CE2 3.91Å; F177-F182 HydrophobicContact CG-CE2 3.91Å; F177-F182 AromaticContact CG-CZ 3.82Å; F177-F182 HydrophobicContact CG-CZ 3.82Å; E179-F182 PolarHBondContact O-N 2.89Å; T180-F182 VanDerWaalsContact C-N 3.32Å; T180-F182 PolarHBondContact O-N 2.88Å; F182-P188 HydrophobicContact CD1-CB 3.8Å; F182-P188 HydrophobicContact CD1-CG 3.37Å; F182-P188 HydrophobicContact CD2-CB 4.29Å; F182-P188 HydrophobicContact CE1-CB 3.64Å; F182-P188 HydrophobicContact CE1-CG 3.44Å; F182-P188 VanDerWaalsContact CE1-CG 3.44Å; F182-P188 HydrophobicContact CE2-CB 4.17Å; F182-P188 HydrophobicContact CG-CB 4.12Å; F182-P188 HydrophobicContact CG-CG 4.04Å; F182-P188 HydrophobicContact CZ-CB 3.83Å; F182-P188 HydrophobicContact CZ-CG 4.17Å
183	W	88.1	Confident	93.9	Very high	229 Å²	229	64.2 Å²	64.2	87%	0.867	34%	0.335	S	S	*	.	H	α-helix	trans	-105.2	-23.9	-174.6	-41.9	88.9	0	0	0	112.6	E179 T180 S181	E179-W183 PolarHBondContact O-NE1 2.87Å; E179-W183 VanDerWaalsContact O-NE1 3.09Å; T180-W183 PolarHBondContact O-N 2.77Å; S181-W183 PolarHBondContact O-N 2.93Å
184	N	80.8	Confident	94	Very high	107 Å²	107	61.8 Å²	61.8	57%	0.572	31%	0.309	S	S	*	.	H	α-helix	trans	-114.3	-6.2	-171.2	72.7	24.6	0	0	0	114.5	T180 S181	T180-N184 PolarHBondContact O-N 2.96Å; T180-N184 PolarHBondContact O-ND2 2.85Å; T180-N184 VanDerWaalsContact O-ND2 3.12Å; S181-N184 WeakPolarHBondContact CA-OD1 3.36Å
185	S	78.4	Confident	94	Very high	32 Å²	32	58.7 Å²	58.7	22%	0.224	29%	0.29	C	S	.	.	S	Bend	trans	-130.8	144.3	-178.2	-60.8	0	0	0	0	109.7	S181 H187	S181-S185 WeakPolarHBondContact O-CB 3.21Å; S181-S185 PolarHBondContact O-N 3.1Å; S181-S185 VanDerWaalsContact O-N 3.11Å; S185-H187 WeakPolarHBondContact CB-O 3.34Å; S185-H187 PolarHBondContact O-N 3.04Å
186	S	81.7	Confident	94	Very high	122 Å²	122	56.9 Å²	56.9	85%	0.853	28%	0.282	S	S	*	.	S	Bend	trans	-64	-26.1	177.1	-49.8	0	0	0	0	112.9
187	H	92.2	Very high	94.1	Very high	124 Å²	124	55.1 Å²	55.1	57%	0.574	27%	0.274	S	S	*	.	S	Bend	trans	-128.1	126.3	175.5	-65.4	84.9	0	0	0	108.4	Y165 S185	Y165-H187 HydrophobicContact CD1-CB 3.93Å; Y165-H187 HydrophobicContact CE1-CB 3.67Å; S185-H187 WeakPolarHBondContact CB-O 3.34Å; S185-H187 PolarHBondContact O-N 3.04Å
188	P	95.8	Very high	94.1	Very high	44 Å²	44	51.5 Å²	51.5	29%	0.286	26%	0.259	S	S	.	.			trans	-58.7	143.7	177.1	-23.9	33.9	0	0	0	111.7	F177 S181 F182	F177-P188 HydrophobicContact CD1-CB 3.92Å; F177-P188 HydrophobicContact CE1-CB 3.78Å; S181-P188 WeakPolarHBondContact OG-CA 3.4Å; F182-P188 HydrophobicContact CD1-CB 3.8Å; F182-P188 HydrophobicContact CD1-CG 3.37Å; F182-P188 HydrophobicContact CD2-CB 4.29Å; F182-P188 HydrophobicContact CE1-CB 3.64Å; F182-P188 HydrophobicContact CE1-CG 3.44Å; F182-P188 VanDerWaalsContact CE1-CG 3.44Å; F182-P188 HydrophobicContact CE2-CB 4.17Å; F182-P188 HydrophobicContact CG-CB 4.12Å; F182-P188 HydrophobicContact CG-CG 4.04Å; F182-P188 HydrophobicContact CZ-CB 3.83Å; F182-P188 HydrophobicContact CZ-CG 4.17Å
189	R	98.1	Very high	94.2	Very high	36 Å²	36	52.9 Å²	52.9	14%	0.136	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	165.9	-178.6	-69.3	-170.5	-66.7	168.9	-1.8	110.7	H109 N114 Y163 G164 Y165 D178 S181	H109-R189 PolarHBondContact CD2-NH1 2.93Å; H109-R189 VanDerWaalsContact CD2-NH1 3.3Å; N114-R189 WeakPolarHBondContact OD1-CD 3.49Å; N114-R189 PolarHBondContact OD1-NH1 3.47Å; Y163-R189 HydrophobicContact CD1-CB 4.24Å; Y163-R189 HydrophobicContact CE1-CB 3.6Å; Y163-R189 HydrophobicContact CE1-CG 4.42Å; Y163-R189 HydrophobicContact CE2-CB 4.45Å; G164-R189 CarbonylContact O-C 3.45Å; G164-R189 WeakPolarHBondContact O-CA 3.43Å; G164-R189 VanDerWaalsContact O-CB 3.27Å; G164-R189 WeakPolarHBondContact O-CB 3.27Å; Y165-R189 HydrophobicContact CD1-CG 3.61Å; Y165-R189 HydrophobicContact CE1-CG 3.69Å; D178-R189 PolarHBondContact N-O 2.74Å; S181-R189 PolarHBondContact OG-N 2.91Å; S181-R189 PolarHBondContact OG-O 2.75Å; S181-R189 VanDerWaalsContact OG-O 3.04Å
190	G	98.4	Very high	94.3	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.1	175.2	-175.6	0	0	0	0	0	112.9	Y163 G164 F175 E176	Y163-G190 CarbonylContact C-O 3.5Å; Y163-G190 VanDerWaalsContact CA-O 3.29Å; Y163-G190 WeakPolarHBondContact CA-O 3.48Å; Y163-G190 WeakPolarHBondContact CD2-O 3.45Å; G164-G190 PolarHBondContact N-O 3.18Å; G164-G190 PolarHBondContact O-N 2.75Å; F175-G190 VanDerWaalsContact CZ-CA 3.43Å; E176-G190 CarbonylContact O-C 3.6Å; E176-G190 WeakPolarHBondContact O-CA 3.17Å
191	W	98.8	Very high	94.5	Very high	8 Å²	8	51 Å²	51	3%	0.03	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	152.6	175.2	-56.6	-81.1	0	0	0	110.4	G162 Y163 F175 E176 D178 P217 R236 Y237	G162-W191 WeakPolarHBondContact O-CA 3.43Å; Y163-W191 AromaticContact CD2-CD1 3.71Å; Y163-W191 HydrophobicContact CD2-CD2 4.23Å; Y163-W191 AromaticContact CD2-CE2 3.9Å; Y163-W191 HydrophobicContact CD2-CG 4.12Å; Y163-W191 AromaticContact CD2-NE1 3.56Å; Y163-W191 HydrophobicContact CE2-CD2 4.35Å; Y163-W191 AromaticContact CE2-CE2 3.93Å; Y163-W191 HydrophobicContact CE2-CZ2 4.16Å; F175-W191 CarbonylContact C-O 3.37Å; F175-W191 WeakPolarHBondContact CA-O 3.23Å; E176-W191 PolarHBondContact N-O 3.09Å; E176-W191 PolarHBondContact O-N 2.89Å; D178-W191 HydrophobicContact CB-CE3 4.33Å; D178-W191 HydrophobicContact CB-CH2 3.54Å; D178-W191 HydrophobicContact CB-CZ2 4.15Å; D178-W191 HydrophobicContact CB-CZ3 3.65Å; W191-P217 HydrophobicContact CB-CB 3.73Å; W191-R236 HydrophobicContact CZ2-CG 4.41Å; W191-R236 PolarHBondContact NE1-O 3.21Å; W191-Y237 HydrophobicContact CB-CD2 4.45Å; W191-Y237 HydrophobicContact CD2-CD2 4.38Å; W191-Y237 HydrophobicContact CE3-CD2 4.22Å; W191-Y237 HydrophobicContact CG-CD2 4.49Å
192	N	98.8	Very high	94.7	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	163.2	168.5	64	99.6	0	0	0	111.4	K145 G161 G162 T174 F175 H194 P217 R218	K145-N192 PolarHBondContact NZ-OD1 2.82Å; G161-N192 WeakPolarHBondContact CA-O 3.33Å; G161-N192 WeakPolarHBondContact CA-OD1 3.21Å; G161-N192 PolarHBondContact O-OD1 3.08Å; G162-N192 PolarHBondContact O-N 3.38Å; G162-N192 PolarHBondContact O-ND2 2.84Å; G162-N192 VanDerWaalsContact O-ND2 3.08Å; T174-N192 VanDerWaalsContact O-CA 3.26Å; T174-N192 WeakPolarHBondContact O-CA 3.48Å; F175-N192 HydrophobicContact CD2-CB 4.24Å; N192-H194 WeakPolarHBondContact OD1-CB 3.43Å; N192-H194 PolarHBondContact OD1-N 2.97Å; N192-H194 PolarHBondContact OD1-ND1 3.48Å; N192-P217 VanDerWaalsContact C-CA 3.48Å; N192-P217 WeakPolarHBondContact O-CA 3.39Å; N192-R218 PolarHBondContact O-N 3.01Å
193	D	98.8	Very high	95	Very high	16 Å²	16	51.7 Å²	51.7	9%	0.086	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	16.1	169.9	62.3	15.3	0	0	0	112	F160 G173 T174 V195 T214 P215 P217	F160-D193 HydrophobicContact CE2-CB 4.24Å; F160-D193 VanDerWaalsContact CE2-O 3.22Å; F160-D193 WeakPolarHBondContact CE2-O 3.31Å; G173-D193 WeakPolarHBondContact CA-OD1 3.49Å; T174-D193 PolarHBondContact N-OD1 2.83Å; T174-D193 PolarHBondContact O-N 3.42Å; T174-D193 VanDerWaalsContact OG1-CG 3.3Å; T174-D193 PolarHBondContact OG1-OD2 2.79Å; D193-V195 PolarHBondContact O-N 2.9Å; D193-T214 HydrophobicContact CB-CG2 4.06Å; D193-P215 WeakPolarHBondContact CB-O 3.27Å; D193-P217 HydrophobicContact CB-CG 4.2Å
194	H	98.8	Very high	95.5	Very high	2 Å²	2	42.6 Å²	42.6	1%	0.009	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	134.2	-170.6	-50.3	158.1	0	0	0	111.5	F160 G161 V171 L172 T174 N192	F160-H194 WeakPolarHBondContact CA-O 3.26Å; G161-H194 PolarHBondContact N-O 3.43Å; G161-H194 VanDerWaalsContact N-O 3.11Å; V171-H194 HydrophobicContact CG1-CB 4.23Å; V171-H194 WeakPolarHBondContact CG1-ND1 3.39Å; L172-H194 PolarHBondContact O-CD2 2.64Å; T174-H194 PolarHBondContact O-NE2 2.99Å; N192-H194 WeakPolarHBondContact OD1-CB 3.43Å; N192-H194 PolarHBondContact OD1-N 2.97Å; N192-H194 PolarHBondContact OD1-ND1 3.48Å
195	V	98.9	Very high	96.4	Very high	9 Å²	9	38.1 Å²	38.1	6%	0.055	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	126.1	167.9	-177.2	0	0	0	0	108.7	I158 F159 F160 D193 Q207 P208 T210 L248 W255	I158-V195 HydrophobicContact CG2-CG1 3.64Å; F159-V195 WeakPolarHBondContact O-CA 3.37Å; F160-V195 HydrophobicContact CD2-CG2 3.82Å; F160-V195 HydrophobicContact CE2-CG2 4.42Å; D193-V195 PolarHBondContact O-N 2.9Å; V195-Q207 WeakPolarHBondContact O-CG 3.21Å; V195-Q207 PolarHBondContact O-NE2 2.87Å; V195-Q207 VanDerWaalsContact O-NE2 3.13Å; V195-P208 HydrophobicContact CB-CG 4.22Å; V195-P208 HydrophobicContact CG1-CG 3.59Å; V195-T210 HydrophobicContact CG2-CG2 4.4Å; V195-L248 HydrophobicContact CG1-CD2 4.07Å; V195-L248 HydrophobicContact CG2-CD2 4.28Å; V195-W255 HydrophobicContact CG2-CZ2 4Å
196	H	98.8	Very high	97.3	Very high	1 Å²	1	39.3 Å²	39.3	1%	0.005	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	141.9	174.8	-73.3	67.9	0	0	0	110.5	P142 I158 F159 V171 W205 S206 Q207	P142-H196 WeakPolarHBondContact CA-NE2 3.48Å; P142-H196 HydrophobicContact CG-CB 3.82Å; I158-H196 CarbonylContact C-O 3.58Å; I158-H196 VanDerWaalsContact CA-O 3.27Å; I158-H196 WeakPolarHBondContact CA-O 3.3Å; F159-H196 PolarHBondContact N-O 3.38Å; F159-H196 PolarHBondContact O-N 3.35Å; V171-H196 VanDerWaalsContact CG1-CE1 3.44Å; V171-H196 WeakPolarHBondContact CG1-CE1 3.31Å; H196-W205 HydrophobicContact CB-CE3 4.04Å; H196-W205 HydrophobicContact CB-CZ3 3.99Å; H196-S206 WeakPolarHBondContact CA-O 3.35Å; H196-Q207 PolarHBondContact CE1-NE2 3.45Å
197	I	98.9	Very high	98.1	Very high	12 Å²	12	35.8 Å²	35.8	6%	0.062	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	128	173.8	-61.8	160.5	0	0	0	107.4	K156 L157 I158 W205 S206 P208 W253	K156-I197 HydrophobicContact CB-CG2 3.95Å; K156-I197 HydrophobicContact CD-CG2 4.08Å; K156-I197 HydrophobicContact CG-CG2 3.84Å; L157-I197 WeakPolarHBondContact O-CA 3.34Å; I158-I197 HydrophobicContact CG1-CG1 4.08Å; I158-I197 HydrophobicContact CG2-CG1 4.37Å; I197-W205 CarbonylContact O-C 3.56Å; I197-W205 WeakPolarHBondContact O-CA 3.26Å; I197-S206 PolarHBondContact N-O 2.89Å; I197-S206 PolarHBondContact O-N 3.28Å; I197-P208 HydrophobicContact CD1-CB 3.92Å; I197-P208 HydrophobicContact CD1-CG 3.88Å; I197-P208 HydrophobicContact CG1-CG 4.35Å; I197-W253 HydrophobicContact CD1-CH2 3.36Å; I197-W253 HydrophobicContact CD1-CZ2 3.52Å; I197-W253 HydrophobicContact CD1-CZ3 4.06Å; I197-W253 HydrophobicContact CG1-CH2 3.85Å; I197-W253 HydrophobicContact CG1-CZ2 4.47Å; I197-W253 HydrophobicContact CG1-CZ3 4.36Å
198	L	98.9	Very high	98.4	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	116	157.1	-178	65.7	0	0	0	108.1	F118 C137 L157 F159 W205	F118-L198 HydrophobicContact CD1-CD2 3.9Å; F118-L198 HydrophobicContact CD2-CD2 3.6Å; F118-L198 HydrophobicContact CE1-CD2 3.55Å; F118-L198 HydrophobicContact CE2-CD2 3.24Å; F118-L198 HydrophobicContact CG-CD2 3.91Å; F118-L198 HydrophobicContact CZ-CD2 3.19Å; C137-L198 HydrophobicContact CB-CD1 4.28Å; L157-L198 HydrophobicContact CB-CB 4.36Å; L157-L198 PolarHBondContact N-O 3.36Å; L157-L198 PolarHBondContact O-N 3.12Å; F159-L198 HydrophobicContact CE2-CB 4.29Å; L198-W205 HydrophobicContact CB-CD2 4.21Å; L198-W205 HydrophobicContact CB-CE3 3.87Å; L198-W205 HydrophobicContact CB-CH2 3.9Å; L198-W205 HydrophobicContact CB-CZ2 4.2Å; L198-W205 HydrophobicContact CB-CZ3 3.73Å; L198-W205 HydrophobicContact CD1-CD2 3.93Å; L198-W205 HydrophobicContact CD1-CE3 4.45Å; L198-W205 HydrophobicContact CD1-CG 4.18Å; L198-W205 HydrophobicContact CD1-CZ2 4.25Å; L198-W205 HydrophobicContact CD2-CH2 4.37Å; L198-W205 HydrophobicContact CD2-CZ2 4.08Å; L198-W205 HydrophobicContact CG-CZ2 4.42Å
199	D	98.7	Very high	98.5	Very high	37 Å²	37	34.7 Å²	34.7	20%	0.198	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	116.6	171	-171.6	-32.5	0	0	0	109.1	N155 E201 T202 F203 T204	N155-D199 PolarHBondContact ND2-OD1 2.79Å; N155-D199 PolarHBondContact ND2-OD2 2.89Å; N155-D199 VanDerWaalsContact ND2-OD2 3.09Å; D199-E201 VanDerWaalsContact C-N 3.27Å; D199-E201 PolarHBondContact O-N 2.81Å; D199-E201 WeakPolarHBondContact OD1-CB 3.25Å; D199-E201 PolarHBondContact OD1-N 2.85Å; D199-T202 PolarHBondContact O-N 2.94Å; D199-F203 WeakPolarHBondContact O-CA 3.49Å; D199-F203 PolarHBondContact O-N 2.79Å; D199-T204 PolarHBondContact N-O 3.14Å; D199-T204 VanDerWaalsContact N-O 3.1Å; D199-T204 PolarHBondContact O-N 3.02Å
200	T	98.3	Very high	98.6	Very high	34 Å²	34	35 Å²	35	21%	0.209	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-11.7	-177.1	60.1	0	0	0	0	113.7	N155 L157	N155-T200 PolarHBondContact O-N 2.77Å; N155-T200 PolarHBondContact O-OG1 2.84Å; L157-T200 HydrophobicContact CD1-CG2 4.1Å; L157-T200 HydrophobicContact CD2-CG2 4.38Å; L157-T200 HydrophobicContact CG-CG2 3.78Å
201	E	97.5	Very high	98.6	Very high	152 Å²	152	38.7 Å²	38.7	71%	0.71	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.3	-31	174.5	-66.4	175.8	-172.9	0	0	111.4	N155 D199	N155-E201 HydrophobicContact CB-CG 3.93Å; D199-E201 VanDerWaalsContact C-N 3.27Å; D199-E201 PolarHBondContact O-N 2.81Å; D199-E201 WeakPolarHBondContact OD1-CB 3.25Å; D199-E201 PolarHBondContact OD1-N 2.85Å
202	T	98.1	Very high	98.5	Very high	71 Å²	71	40.9 Å²	40.9	44%	0.436	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-121.5	-8.3	-175.5	62.2	0	0	0	0	114	D199 T204	D199-T202 PolarHBondContact O-N 2.94Å; T202-T204 WeakPolarHBondContact CB-OG1 3.22Å; T202-T204 PolarHBondContact O-N 3.18Å; T202-T204 PolarHBondContact O-OG1 2.75Å; T202-T204 WeakPolarHBondContact OG1-CB 3.42Å; T202-T204 PolarHBondContact OG1-OG1 3.29Å
203	F	98.6	Very high	98.5	Very high	50 Å²	50	47.5 Å²	47.5	22%	0.219	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	49.6	45.2	-168.2	-64.8	-78	0	0	0	112.7	Y104 F118 M120 I135 C137 Q138 D199	Y104-F203 HydrophobicContact CE1-CE1 4.15Å; F118-F203 HydrophobicContact CE1-CD1 4.24Å; F118-F203 HydrophobicContact CE1-CE1 4.12Å; M120-F203 HydrophobicContact SD-CZ 4.24Å; I135-F203 HydrophobicContact CB-CD1 4.5Å; I135-F203 HydrophobicContact CG1-CD1 4.46Å; I135-F203 HydrophobicContact CG1-CE1 4.3Å; I135-F203 HydrophobicContact CG2-CB 3.84Å; I135-F203 HydrophobicContact CG2-CD1 3.78Å; I135-F203 HydrophobicContact CG2-CD2 4.22Å; I135-F203 HydrophobicContact CG2-CE1 4.36Å; I135-F203 HydrophobicContact CG2-CG 3.69Å; C137-F203 CarbonylContact C-O 3.48Å; C137-F203 VanDerWaalsContact CA-O 3.23Å; C137-F203 WeakPolarHBondContact CA-O 3.37Å; C137-F203 VanDerWaalsContact CB-O 3.23Å; C137-F203 WeakPolarHBondContact CB-O 3.16Å; Q138-F203 PolarHBondContact N-O 2.81Å; D199-F203 WeakPolarHBondContact O-CA 3.49Å; D199-F203 PolarHBondContact O-N 2.79Å
204	T	98.8	Very high	98.4	Very high	38 Å²	38	48.9 Å²	48.9	23%	0.233	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	128.2	-179.3	-53.3	0	0	0	0	111.3	Q138 D199 T202	Q138-T204 HydrophobicContact CB-CG2 4.1Å; Q138-T204 WeakPolarHBondContact O-CA 3.47Å; D199-T204 PolarHBondContact N-O 3.14Å; D199-T204 VanDerWaalsContact N-O 3.1Å; D199-T204 PolarHBondContact O-N 3.02Å; T202-T204 WeakPolarHBondContact CB-OG1 3.22Å; T202-T204 PolarHBondContact O-N 3.18Å; T202-T204 PolarHBondContact O-OG1 2.75Å; T202-T204 WeakPolarHBondContact OG1-CB 3.42Å; T202-T204 PolarHBondContact OG1-OG1 3.29Å
205	W	98.7	Very high	98.4	Very high	12 Å²	12	48.9 Å²	48.9	5%	0.045	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	137.8	171.7	-69.5	104.5	0	0	0	111.9	F106 F118 C137 Q138 I140 P141 P142 F159 H196 I197 L198	F106-W205 AromaticContact CD2-CH2 3.73Å; F106-W205 HydrophobicContact CD2-CH2 3.73Å; F106-W205 AromaticContact CD2-CZ2 3.7Å; F106-W205 HydrophobicContact CD2-CZ2 3.7Å; F106-W205 AromaticContact CE2-CH2 3.82Å; F106-W205 HydrophobicContact CE2-CH2 3.82Å; F106-W205 AromaticContact CE2-CZ2 3.75Å; F106-W205 HydrophobicContact CE2-CZ2 3.75Å; F106-W205 HydrophobicContact CG-CH2 4.33Å; F118-W205 HydrophobicContact CD2-CZ2 4.24Å; C137-W205 VanDerWaalsContact CB-CD1 3.43Å; C137-W205 VanDerWaalsContact CB-NE1 3.3Å; Q138-W205 PolarHBondContact O-N 3.4Å; I140-W205 WeakPolarHBondContact O-CB 3.41Å; P141-W205 HydrophobicContact CB-CG 4.35Å; P142-W205 HydrophobicContact CG-CD2 4.48Å; P142-W205 HydrophobicContact CG-CE3 3.97Å; P142-W205 HydrophobicContact CG-CH2 3.93Å; P142-W205 HydrophobicContact CG-CZ2 4.46Å; P142-W205 HydrophobicContact CG-CZ3 3.65Å; F159-W205 AromaticContact CD2-CH2 3.61Å; F159-W205 HydrophobicContact CD2-CH2 3.61Å; F159-W205 AromaticContact CD2-CZ3 3.54Å; F159-W205 HydrophobicContact CD2-CZ3 3.54Å; F159-W205 AromaticContact CE2-CH2 3.49Å; F159-W205 HydrophobicContact CE2-CH2 3.49Å; F159-W205 VanDerWaalsContact CE2-CH2 3.49Å; F159-W205 AromaticContact CE2-CZ3 3.83Å; F159-W205 HydrophobicContact CE2-CZ3 3.83Å; F159-W205 HydrophobicContact CZ-CH2 4.35Å; H196-W205 HydrophobicContact CB-CE3 4.04Å; H196-W205 HydrophobicContact CB-CZ3 3.99Å; I197-W205 CarbonylContact O-C 3.56Å; I197-W205 WeakPolarHBondContact O-CA 3.26Å; L198-W205 HydrophobicContact CB-CD2 4.21Å; L198-W205 HydrophobicContact CB-CE3 3.87Å; L198-W205 HydrophobicContact CB-CH2 3.9Å; L198-W205 HydrophobicContact CB-CZ2 4.2Å; L198-W205 HydrophobicContact CB-CZ3 3.73Å; L198-W205 HydrophobicContact CD1-CD2 3.93Å; L198-W205 HydrophobicContact CD1-CE3 4.45Å; L198-W205 HydrophobicContact CD1-CG 4.18Å; L198-W205 HydrophobicContact CD1-CZ2 4.25Å; L198-W205 HydrophobicContact CD2-CH2 4.37Å; L198-W205 HydrophobicContact CD2-CZ2 4.08Å; L198-W205 HydrophobicContact CG-CZ2 4.42Å
206	S	98.3	Very high	98.4	Very high	57 Å²	57	50.1 Å²	50.1	40%	0.399	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	170	171.7	59.8	0	0	0	0	110.8	H196 I197	H196-S206 WeakPolarHBondContact CA-O 3.35Å; I197-S206 PolarHBondContact N-O 2.89Å; I197-S206 PolarHBondContact O-N 3.28Å
207	Q	98.5	Very high	98.4	Very high	48 Å²	48	50.3 Å²	50.3	22%	0.224	28%	0.284	C	S	.	.			trans	-122.3	132.5	171.5	-63.4	-167.2	-91.7	0	0	109.8	L172 V195 H196	L172-Q207 HydrophobicContact CD1-CB 4.28Å; L172-Q207 PolarHBondContact O-NE2 3.48Å; V195-Q207 WeakPolarHBondContact O-CG 3.21Å; V195-Q207 PolarHBondContact O-NE2 2.87Å; V195-Q207 VanDerWaalsContact O-NE2 3.13Å; H196-Q207 PolarHBondContact CE1-NE2 3.45Å
208	P	98.3	Very high	98.4	Very high	16 Å²	16	49.8 Å²	49.8	10%	0.104	28%	0.282	C	S	.	.			trans	-74.7	150.6	171.8	30.9	-30.7	0	0	0	110.3	V195 I197 T210 W253	V195-P208 HydrophobicContact CB-CG 4.22Å; V195-P208 HydrophobicContact CG1-CG 3.59Å; I197-P208 HydrophobicContact CD1-CB 3.92Å; I197-P208 HydrophobicContact CD1-CG 3.88Å; I197-P208 HydrophobicContact CG1-CG 4.35Å; P208-T210 HydrophobicContact CG-CG2 4.2Å; P208-T210 PolarHBondContact O-N 3.39Å; P208-W253 HydrophobicContact CB-CB 4.31Å; P208-W253 HydrophobicContact CB-CD2 3.38Å; P208-W253 HydrophobicContact CB-CE3 3.62Å; P208-W253 HydrophobicContact CB-CG 3.69Å; P208-W253 HydrophobicContact CB-CH2 4.46Å; P208-W253 HydrophobicContact CB-CZ2 4.26Å; P208-W253 HydrophobicContact CB-CZ3 4.15Å; P208-W253 HydrophobicContact CG-CD2 3.95Å; P208-W253 HydrophobicContact CG-CE3 3.6Å; P208-W253 HydrophobicContact CG-CH2 4.47Å; P208-W253 HydrophobicContact CG-CZ3 3.89Å
209	I	98.4	Very high	98.4	Very high	129 Å²	129	50 Å²	50	66%	0.662	28%	0.283	S	S	*	.			trans	-81.2	111.3	164	-56.4	-55.5	0	0	0	107.3	L172 W253	L172-I209 HydrophobicContact CD1-CD1 3.54Å; I209-W253 WeakPolarHBondContact O-CB 3.32Å
210	T	98.6	Very high	98.4	Very high	44 Å²	44	48.7 Å²	48.7	27%	0.27	28%	0.277	S	S	.	.			trans	-93.5	150.1	179.6	60	0	0	0	0	111.8	V195 P208 L248 W253	V195-T210 HydrophobicContact CG2-CG2 4.4Å; P208-T210 HydrophobicContact CG-CG2 4.2Å; P208-T210 PolarHBondContact O-N 3.39Å; T210-L248 HydrophobicContact CG2-CD1 4.22Å; T210-W253 CarbonylContact C-O 3.59Å; T210-W253 WeakPolarHBondContact CA-O 3.22Å; T210-W253 VanDerWaalsContact CB-O 3.29Å; T210-W253 WeakPolarHBondContact CB-O 3.35Å; T210-W253 HydrophobicContact CG2-CB 4.27Å
211	T	98.8	Very high	98.5	Very high	77 Å²	77	47.6 Å²	47.6	47%	0.472	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	173.8	170.4	57.9	0	0	0	0	110.4	W253 W255	T211-W253 PolarHBondContact N-O 2.8Å; T211-W255 PolarHBondContact O-N 3.06Å
212	G	98	Very high	98.5	Very high	54 Å²	54	40.8 Å²	40.8	56%	0.557	24%	0.239	S	C	*	.	E	Extended strand (participates in β ladder)	trans	77.2	-176.9	-175.5	0	0	0	0	0	113	T214	G212-T214 PolarHBondContact O-N 3.47Å
213	K	97.4	Very high	98.6	Very high	139 Å²	139	38.5 Å²	38.5	60%	0.604	23%	0.226	S	C	*	.			trans	-87.8	104.6	-177	-177.4	-177.4	165.2	-152.9	0	109.4	W255 E257	K213-W255 WeakPolarHBondContact O-CB 3.24Å; K213-E257 IonicContact NZ-OE2 2.73Å; K213-E257 PolarHBondContact NZ-OE2 3.04Å
214	T	97.9	Very high	98.6	Very high	44 Å²	44	36.2 Å²	36.2	27%	0.27	22%	0.217	S	C	.	.	P	Polyproline II helix	trans	-64.9	140.8	176.7	-56.6	0	0	0	0	110	F160 D193 G212 W255	F160-T214 HydrophobicContact CE2-CG2 4.38Å; D193-T214 HydrophobicContact CB-CG2 4.06Å; G212-T214 PolarHBondContact O-N 3.47Å; T214-W255 HydrophobicContact CG2-CZ2 4.41Å; T214-W255 PolarHBondContact OG1-NE1 3.03Å
215	P	98.6	Very high	98.6	Very high	2 Å²	2	36.1 Å²	36.1	1%	0.013	22%	0.216	C	C	.	.	P	Polyproline II helix	trans	-60.5	147	172.2	-14.1	25.4	0	0	0	110.2	F160 D193 R218 V232 H246 W255	F160-P215 HydrophobicContact CZ-CB 4.07Å; F160-P215 HydrophobicContact CZ-CG 3.97Å; D193-P215 WeakPolarHBondContact CB-O 3.27Å; P215-R218 VanDerWaalsContact CB-NH2 3.28Å; P215-V232 HydrophobicContact CG-CG1 4.06Å; P215-H246 HydrophobicContact CG-CB 3.81Å; P215-W255 HydrophobicContact CG-CD2 4.39Å; P215-W255 HydrophobicContact CG-CE3 3.88Å; P215-W255 HydrophobicContact CG-CH2 3.79Å; P215-W255 HydrophobicContact CG-CZ2 4.35Å; P215-W255 HydrophobicContact CG-CZ3 3.57Å
216	S	98.8	Very high	98.6	Very high	35 Å²	35	36.7 Å²	36.7	25%	0.245	22%	0.221	C	C	.	.	P	Polyproline II helix	trans	-53.9	156.1	176.9	62.6	0	0	0	0	112.7	R218	S216-R218 VanDerWaalsContact N-NH2 3.16Å; S216-R218 WeakPolarHBondContact O-CG 3.38Å; S216-R218 PolarHBondContact O-N 2.87Å; S216-R218 PolarHBondContact O-NE 3.03Å; S216-R218 PolarHBondContact OG-NH2 3.31Å
217	P	98.9	Very high	98.6	Very high	6 Å²	6	36.9 Å²	36.9	4%	0.039	23%	0.232	C	C	.	.	S	Bend	trans	-46.7	132.9	171.6	-33	38.6	0	0	0	112.1	T174 W191 N192 D193 Y237	T174-P217 WeakPolarHBondContact OG1-CG 3.46Å; W191-P217 HydrophobicContact CB-CB 3.73Å; N192-P217 VanDerWaalsContact C-CA 3.48Å; N192-P217 WeakPolarHBondContact O-CA 3.39Å; D193-P217 HydrophobicContact CB-CG 4.2Å; P217-Y237 HydrophobicContact CB-CD2 4.17Å; P217-Y237 HydrophobicContact CB-CE2 3.94Å; P217-Y237 HydrophobicContact CG-CE2 4.33Å; P217-Y237 WeakPolarHBondContact O-CB 3.35Å; P217-Y237 WeakPolarHBondContact O-CD2 3.29Å
218	R	98.9	Very high	98.6	Very high	1 Å²	1	37 Å²	37	0%	0.004	23%	0.234	C	C	.	.			trans	-159.2	152.8	-174	59.2	-173.1	71.3	-163.4	-1.4	113.7	F160 G162 N192 P215 S216 H221 G234 R236 M242 D244	F160-R218 HydrophobicContact CE1-CG 4.05Å; F160-R218 HydrophobicContact CZ-CG 4.46Å; G162-R218 PolarHBondContact N-O 3.01Å; N192-R218 PolarHBondContact O-N 3.01Å; P215-R218 VanDerWaalsContact CB-NH2 3.28Å; S216-R218 VanDerWaalsContact N-NH2 3.16Å; S216-R218 WeakPolarHBondContact O-CG 3.38Å; S216-R218 PolarHBondContact O-N 2.87Å; S216-R218 PolarHBondContact O-NE 3.03Å; S216-R218 PolarHBondContact OG-NH2 3.31Å; R218-H221 HydrophobicContact CG-CB 4.36Å; R218-H221 PolarHBondContact O-CE1 2.97Å; R218-H221 PolarHBondContact O-ND1 2.79Å; R218-G234 WeakPolarHBondContact CD-O 3.46Å; R218-G234 PolarHBondContact NH1-O 3.44Å; R218-G234 VanDerWaalsContact NH1-O 3.08Å; R218-R236 WeakPolarHBondContact CA-O 3.35Å; R218-M242 HydrophobicContact CB-CE 3.71Å; R218-M242 VanDerWaalsContact CZ-CE 3.4Å; R218-D244 IonicContact CZ-OD1 3.03Å; R218-D244 IonicContact CZ-OD2 3.43Å; R218-D244 IonicContact NH1-OD1 2.98Å; R218-D244 PolarHBondContact NH1-OD1 2.85Å; R218-D244 IonicContact NH1-OD2 3.46Å; R218-D244 PolarHBondContact NH1-OD2 2.62Å; R218-D244 IonicContact NH2-OD1 2.69Å; R218-D244 IonicContact NH2-OD2 3.01Å; R218-D244 PolarHBondContact NH2-OD2 3.36Å
219	A	98.9	Very high	98.6	Very high	3 Å²	3	40.7 Å²	40.7	3%	0.025	25%	0.246	C	C	.	.	B	Isolated β-bridge	trans	-134.1	164	171.5	0	0	0	0	0	110.8	K147 H221 R236	K147-A219 HydrophobicContact CB-CB 4.19Å; K147-A219 CarbonylContact O-C 3.54Å; K147-A219 WeakPolarHBondContact O-CA 3.3Å; A219-H221 PolarHBondContact O-N 3.13Å; A219-H221 VanDerWaalsContact O-N 3.09Å; A219-R236 PolarHBondContact N-O 2.83Å; A219-R236 VanDerWaalsContact N-O 3.12Å; A219-R236 PolarHBondContact O-N 2.86Å
220	A	98.9	Very high	98.7	Very high	10 Å²	10	34.5 Å²	34.5	8%	0.083	21%	0.214	C	C	.	.	S	Bend	trans	53.2	28.1	-175.4	0	0	0	0	0	113	K147 S269 W270	K147-A220 HydrophobicContact CB-CB 4.31Å; K147-A220 HydrophobicContact CD-CB 4.46Å; K147-A220 PolarHBondContact O-N 3.25Å; A220-S269 CarbonylContact O-C 3.27Å; A220-S269 VanDerWaalsContact O-CA 3.27Å; A220-S269 WeakPolarHBondContact O-CA 3.47Å; A220-S269 WeakPolarHBondContact O-CB 3.42Å; A220-W270 VanDerWaalsContact CB-CD1 3.44Å; A220-W270 HydrophobicContact CB-CD2 4.5Å; A220-W270 HydrophobicContact CB-CG 3.94Å; A220-W270 PolarHBondContact O-N 3.21Å
221	H	98.9	Very high	98.7	Very high	11 Å²	11	32.5 Å²	32.5	5%	0.051	20%	0.202	C	C	.	.			trans	-77.2	164.9	161.6	56.8	-86.8	0	0	0	108.8	G149 F160 R218 A219 V232	G149-H221 PolarHBondContact N-NE2 2.9Å; F160-H221 AromaticContact CD1-NE2 3.54Å; F160-H221 PolarHBondContact O-CE1 2.99Å; F160-H221 VanDerWaalsContact O-CE1 3.27Å; F160-H221 PolarHBondContact O-NE2 3.1Å; F160-H221 VanDerWaalsContact O-NE2 3.15Å; R218-H221 HydrophobicContact CG-CB 4.36Å; R218-H221 PolarHBondContact O-CE1 2.97Å; R218-H221 PolarHBondContact O-ND1 2.79Å; A219-H221 PolarHBondContact O-N 3.13Å; A219-H221 VanDerWaalsContact O-N 3.09Å; H221-V232 HydrophobicContact CB-CG2 3.85Å; H221-V232 VanDerWaalsContact CD2-CG2 3.42Å; H221-V232 WeakPolarHBondContact CD2-CG2 3.25Å
222	A	98.9	Very high	98.7	Very high	9 Å²	9	28.8 Å²	28.8	7%	0.074	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	135.9	172.3	0	0	0	0	0	110.5	V232 F233 H271 L273	A222-V232 WeakPolarHBondContact O-CA 3.44Å; A222-F233 PolarHBondContact N-O 2.78Å; A222-F233 PolarHBondContact O-N 2.81Å; A222-H271 VanDerWaalsContact CB-CD2 3.46Å; A222-H271 WeakPolarHBondContact CB-CD2 3.35Å; A222-H271 VanDerWaalsContact CB-NE2 3.34Å; A222-H271 WeakPolarHBondContact CB-NE2 3.12Å; A222-L273 HydrophobicContact CB-CB 3.5Å
223	C	98.9	Very high	98.7	Very high	23 Å²	23	26.2 Å²	26.2	16%	0.155	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	145	174.3	-75.8	0	0	0	0	110.7	F231	C223-F231 CarbonylContact C-O 3.49Å; C223-F231 WeakPolarHBondContact CA-O 3.18Å
224	A	98.9	Very high	98.8	Very high	3 Å²	3	19.6 Å²	19.6	3%	0.025	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	144.8	176.5	0	0	0	0	0	109.8	F231 L273 P275 L281	A224-F231 PolarHBondContact N-O 3.4Å; A224-F231 WeakPolarHBondContact O-CB 3.28Å; A224-F231 PolarHBondContact O-N 2.81Å; A224-L273 HydrophobicContact CB-CB 4.44Å; A224-L273 HydrophobicContact CB-CD2 3.84Å; A224-L273 HydrophobicContact CB-CG 3.87Å; A224-P275 HydrophobicContact CB-CG 3.97Å; A224-L281 HydrophobicContact CB-CD1 4.37Å; A224-L281 HydrophobicContact CB-CD2 3.91Å
225	T	98.9	Very high	98.9	Very high	35 Å²	35	17.5 Å²	17.5	22%	0.215	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	129.7	-178.7	-44.3	0	0	0	0	110.6	W151 V152 L250 P275	W151-T225 WeakPolarHBondContact CA-OG1 3.36Å; W151-T225 HydrophobicContact CB-CG2 4.44Å; W151-T225 WeakPolarHBondContact CB-OG1 3.42Å; V152-T225 PolarHBondContact N-OG1 2.89Å; T225-L250 HydrophobicContact CG2-CD1 4.01Å; T225-P275 VanDerWaalsContact O-CG 3.3Å; T225-P275 WeakPolarHBondContact O-CG 3.31Å
226	V	98.8	Very high	98.9	Very high	24 Å²	24	20.9 Å²	20.9	15%	0.145	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	117.7	170	176.9	0	0	0	0	108.7	N228 R229 F231 P275 S278 L281 I302	V226-N228 PolarHBondContact O-N 3.09Å; V226-R229 PolarHBondContact N-O 3.02Å; V226-R229 PolarHBondContact O-N 3.15Å; V226-F231 HydrophobicContact CB-CE2 4.1Å; V226-P275 HydrophobicContact CG2-CB 4Å; V226-P275 HydrophobicContact CG2-CG 4.41Å; V226-S278 VanDerWaalsContact CG1-O 3.24Å; V226-S278 WeakPolarHBondContact CG1-O 3.48Å; V226-L281 HydrophobicContact CG2-CD2 3.6Å; V226-I302 HydrophobicContact CB-CD1 4.04Å; V226-I302 HydrophobicContact CG1-CD1 3.98Å; V226-I302 HydrophobicContact CG2-CD1 3.94Å
227	G	98.4	Very high	98.9	Very high	61 Å²	61	21.2 Å²	21.2	63%	0.629	12%	0.119	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.9	-126.1	-173	0	0	0	0	0	111.3
228	N	98.6	Very high	98.8	Very high	51 Å²	51	27.1 Å²	27.1	27%	0.273	14%	0.141	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.5	16.1	175.8	69.3	-11.3	0	0	0	113.5	Y153 V226 L250 D251	Y153-N228 HydrophobicContact CE2-CB 3.8Å; V226-N228 PolarHBondContact O-N 3.09Å; N228-L250 WeakPolarHBondContact O-CB 3.44Å; N228-L250 WeakPolarHBondContact O-CG 3.26Å; N228-L250 PolarHBondContact O-N 3.08Å; N228-D251 VanDerWaalsContact CB-OD2 3.28Å; N228-D251 WeakPolarHBondContact CB-OD2 3.45Å; N228-D251 PolarHBondContact ND2-OD2 3.46Å
229	R	98.9	Very high	98.8	Very high	93 Å²	93	33.9 Å²	33.9	35%	0.351	18%	0.177	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	115.8	179	-61.8	-174.2	179.9	172.7	-1.6	110.3	V226 F231 Y247	V226-R229 PolarHBondContact N-O 3.02Å; V226-R229 PolarHBondContact O-N 3.15Å; R229-F231 HydrophobicContact CB-CD2 4.14Å; R229-F231 HydrophobicContact CB-CE2 3.53Å; R229-F231 HydrophobicContact CB-CZ 3.99Å; R229-Y247 HydrophobicContact CB-CD2 3.74Å; R229-Y247 HydrophobicContact CB-CE2 4.39Å; R229-Y247 HydrophobicContact CB-CG 4.23Å; R229-Y247 HydrophobicContact CG-CD2 3.57Å; R229-Y247 HydrophobicContact CG-CE2 3.71Å; R229-Y247 HydrophobicContact CG-CG 4.36Å
230	G	98.9	Very high	98.8	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	97.4	170	0	0	0	0	0	110.6	W151 Y247 L248	W151-G230 VanDerWaalsContact CE2-C 3.48Å; W151-G230 WeakPolarHBondContact CZ2-O 3.48Å; W151-G230 VanDerWaalsContact NE1-CA 3.27Å; G230-Y247 CarbonylContact O-C 3.56Å; G230-Y247 VanDerWaalsContact O-CA 3.22Å; G230-Y247 WeakPolarHBondContact O-CA 3.48Å; G230-L248 PolarHBondContact N-O 3.03Å; G230-L248 PolarHBondContact O-N 3Å
231	F	98.9	Very high	98.8	Very high	1 Å²	1	36.1 Å²	36.1	0%	0.004	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	146.2	179.1	-65.5	-95.2	0	0	0	111.7	W151 C223 A224 V226 R229 H246 Y247 L258 L281 Y300 I302	W151-F231 PolarHBondContact NE1-O 3.49Å; C223-F231 CarbonylContact C-O 3.49Å; C223-F231 WeakPolarHBondContact CA-O 3.18Å; A224-F231 PolarHBondContact N-O 3.4Å; A224-F231 WeakPolarHBondContact O-CB 3.28Å; A224-F231 PolarHBondContact O-N 2.81Å; V226-F231 HydrophobicContact CB-CE2 4.1Å; R229-F231 HydrophobicContact CB-CD2 4.14Å; R229-F231 HydrophobicContact CB-CE2 3.53Å; R229-F231 HydrophobicContact CB-CZ 3.99Å; F231-H246 CarbonylContact C-O 3.57Å; F231-H246 VanDerWaalsContact CA-O 3.32Å; F231-H246 WeakPolarHBondContact CA-O 3.39Å; F231-Y247 HydrophobicContact CE1-CD1 4.44Å; F231-Y247 HydrophobicContact CE1-CG 4.45Å; F231-L258 HydrophobicContact CD1-CD1 3.96Å; F231-L258 HydrophobicContact CE1-CD1 3.69Å; F231-L281 HydrophobicContact CB-CD1 3.87Å; F231-L281 HydrophobicContact CD1-CD1 3.87Å; F231-L281 HydrophobicContact CD2-CD1 3.89Å; F231-L281 HydrophobicContact CE1-CD1 4.35Å; F231-L281 HydrophobicContact CE2-CD1 4.39Å; F231-L281 HydrophobicContact CG-CD1 3.6Å; F231-Y300 HydrophobicContact CE1-CE1 4.05Å; F231-I302 HydrophobicContact CE1-CG1 4.5Å; F231-I302 HydrophobicContact CE2-CD1 3.99Å; F231-I302 HydrophobicContact CZ-CD1 3.83Å; F231-I302 HydrophobicContact CZ-CG1 3.99Å; F231-I302 HydrophobicContact CZ-CG2 4Å
232	V	98.9	Very high	98.7	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	132.3	168.4	57.1	0	0	0	0	110.4	W151 F160 P215 H221 A222 H246 W255	W151-V232 HydrophobicContact CZ2-CB 4.19Å; W151-V232 HydrophobicContact CZ2-CG1 4.47Å; F160-V232 HydrophobicContact CD1-CB 4.46Å; F160-V232 HydrophobicContact CD1-CG2 4.14Å; F160-V232 HydrophobicContact CE1-CB 4.41Å; F160-V232 HydrophobicContact CE1-CG1 4.15Å; F160-V232 HydrophobicContact CE1-CG2 3.94Å; P215-V232 HydrophobicContact CG-CG1 4.06Å; H221-V232 HydrophobicContact CB-CG2 3.85Å; H221-V232 VanDerWaalsContact CD2-CG2 3.42Å; H221-V232 WeakPolarHBondContact CD2-CG2 3.25Å; A222-V232 WeakPolarHBondContact O-CA 3.44Å; V232-H246 HydrophobicContact CG1-CB 3.93Å; V232-H246 PolarHBondContact N-O 2.97Å; V232-H246 PolarHBondContact O-N 2.99Å; V232-W255 HydrophobicContact CG1-CH2 3.99Å; V232-W255 HydrophobicContact CG1-CZ3 3.78Å
233	F	98.9	Very high	98.7	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	137.2	178.1	-176.7	-112.1	0	0	0	111.9	A222 N243 D244 L245 P265 R268 H271 L273 L283 W307	A222-F233 PolarHBondContact N-O 2.78Å; A222-F233 PolarHBondContact O-N 2.81Å; F233-N243 VanDerWaalsContact CE2-O 3.24Å; F233-N243 WeakPolarHBondContact CE2-O 3.45Å; F233-N243 HydrophobicContact CZ-CB 4.48Å; F233-D244 WeakPolarHBondContact CA-O 3.36Å; F233-D244 WeakPolarHBondContact CD2-O 3.18Å; F233-L245 HydrophobicContact CB-CD1 3.9Å; F233-L245 HydrophobicContact CD2-CB 3.95Å; F233-L245 HydrophobicContact CD2-CD1 3.99Å; F233-L245 HydrophobicContact CG-CD1 4.38Å; F233-P265 HydrophobicContact CZ-CB 4.12Å; F233-P265 HydrophobicContact CZ-CG 4.25Å; F233-R268 HydrophobicContact CE1-CG 3.94Å; F233-H271 AromaticContact CD1-CD2 3.99Å; F233-H271 AromaticContact CD1-NE2 3.47Å; F233-H271 WeakPolarHBondContact CD1-NE2 3.22Å; F233-H271 PolarHBondContact O-CE1 2.82Å; F233-H271 PolarHBondContact O-NE2 2.96Å; F233-H271 VanDerWaalsContact O-NE2 3.1Å; F233-L273 HydrophobicContact CB-CD2 4Å; F233-L283 HydrophobicContact CD1-CD1 3.93Å; F233-L283 HydrophobicContact CD1-CD2 4.14Å; F233-L283 HydrophobicContact CE1-CD1 4.12Å; F233-L283 HydrophobicContact CE1-CD2 3.63Å; F233-L283 HydrophobicContact CZ-CD2 4.28Å; F233-W307 AromaticContact CD2-CZ2 3.9Å; F233-W307 HydrophobicContact CD2-CZ2 3.9Å; F233-W307 AromaticContact CE2-CZ2 3.84Å; F233-W307 HydrophobicContact CE2-CZ2 3.84Å; F233-W307 HydrophobicContact CG-CZ2 4.34Å; F233-W307 HydrophobicContact CZ-CZ2 4.26Å
234	G	98.9	Very high	98.7	Very high	0 Å²	0	41 Å²	41	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	54.8	-133.7	170.5	0	0	0	0	0	114.3	R218 M242 D244	R218-G234 WeakPolarHBondContact CD-O 3.46Å; R218-G234 PolarHBondContact NH1-O 3.44Å; R218-G234 VanDerWaalsContact NH1-O 3.08Å; G234-M242 WeakPolarHBondContact CA-O 3.47Å; G234-D244 PolarHBondContact N-O 3.08Å
235	G	98.9	Very high	98.7	Very high	0 Å²	0	41 Å²	41	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	98.6	172.5	-174.3	0	0	0	0	0	112.9	R241 M242 R268	G235-R241 CarbonylContact O-C 3.57Å; G235-R241 WeakPolarHBondContact O-CA 3.42Å; G235-M242 PolarHBondContact O-N 2.83Å; G235-R268 PolarHBondContact N-O 3.28Å
236	R	98.9	Very high	98.7	Very high	73 Å²	73	39.4 Å²	39.4	28%	0.275	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	133.3	176.6	179.9	161.7	178.1	-118	-6.4	110.8	W191 R218 A219 R238 A240 R241	W191-R236 HydrophobicContact CZ2-CG 4.41Å; W191-R236 PolarHBondContact NE1-O 3.21Å; R218-R236 WeakPolarHBondContact CA-O 3.35Å; A219-R236 PolarHBondContact N-O 2.83Å; A219-R236 VanDerWaalsContact N-O 3.12Å; A219-R236 PolarHBondContact O-N 2.86Å; R236-R238 PolarHBondContact NE-O 2.97Å; R236-R238 VanDerWaalsContact NE-O 3.11Å; R236-R238 PolarHBondContact NH2-O 2.84Å; R236-R238 VanDerWaalsContact NH2-O 3.09Å; R236-A240 WeakPolarHBondContact CA-O 3.5Å; R236-R241 HydrophobicContact CB-CG 4.27Å; R236-R241 HydrophobicContact CG-CG 4.47Å
237	Y	98.8	Very high	98.7	Very high	41 Å²	41	39.5 Å²	39.5	16%	0.161	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	126	169.8	176.2	-129.4	0	0	0	108.7	E176 W191 P217 D239 A240 M242	E176-Y237 HydrophobicContact CB-CE2 4.34Å; E176-Y237 VanDerWaalsContact CD-OH 3.29Å; E176-Y237 WeakPolarHBondContact OE1-CE2 3.18Å; E176-Y237 PolarHBondContact OE1-OH 2.83Å; E176-Y237 PolarHBondContact OE2-OH 3.46Å; W191-Y237 HydrophobicContact CB-CD2 4.45Å; W191-Y237 HydrophobicContact CD2-CD2 4.38Å; W191-Y237 HydrophobicContact CE3-CD2 4.22Å; W191-Y237 HydrophobicContact CG-CD2 4.49Å; P217-Y237 HydrophobicContact CB-CD2 4.17Å; P217-Y237 HydrophobicContact CB-CE2 3.94Å; P217-Y237 HydrophobicContact CG-CE2 4.33Å; P217-Y237 WeakPolarHBondContact O-CB 3.35Å; P217-Y237 WeakPolarHBondContact O-CD2 3.29Å; Y237-D239 PolarHBondContact O-N 3.08Å; Y237-A240 PolarHBondContact N-O 3.03Å; Y237-A240 PolarHBondContact O-N 3.46Å; Y237-A240 VanDerWaalsContact O-O 3.13Å; Y237-M242 HydrophobicContact CD1-SD 4.46Å
238	R	98	Very high	98.8	Very high	131 Å²	131	36.6 Å²	36.6	49%	0.494	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.2	-125.6	-172.3	-56.2	179.8	-179	-166.7	-7.4	111.3	E176 R236	E176-R238 WeakPolarHBondContact OE1-CG 3.42Å; E176-R238 IonicContact OE1-CZ 3.27Å; E176-R238 VanDerWaalsContact OE1-CZ 3.27Å; E176-R238 IonicContact OE1-NE 2.62Å; E176-R238 PolarHBondContact OE1-NE 2.88Å; E176-R238 IonicContact OE1-NH2 3.16Å; E176-R238 PolarHBondContact OE1-NH2 3.38Å; E176-R238 VanDerWaalsContact OE1-NH2 3.16Å; E176-R238 IonicContact OE2-CZ 3.58Å; E176-R238 IonicContact OE2-NE 3.63Å; E176-R238 IonicContact OE2-NH2 2.7Å; E176-R238 PolarHBondContact OE2-NH2 3.07Å; R236-R238 PolarHBondContact NE-O 2.97Å; R236-R238 VanDerWaalsContact NE-O 3.11Å; R236-R238 PolarHBondContact NH2-O 2.84Å; R236-R238 VanDerWaalsContact NH2-O 3.09Å
239	D	97.9	Very high	98.8	Very high	142 Å²	142	35.5 Å²	35.5	76%	0.759	17%	0.167	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.8	-7.5	-178.1	-59.1	-45.8	0	0	0	113.5	Y237 T289	Y237-D239 PolarHBondContact O-N 3.08Å; D239-T289 WeakPolarHBondContact O-CG2 3.32Å
240	A	98.5	Very high	98.8	Very high	44 Å²	44	31.2 Å²	31.2	36%	0.364	15%	0.151	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	145.3	-175.6	0	0	0	0	0	112.6	R236 Y237 M242	R236-A240 WeakPolarHBondContact CA-O 3.5Å; Y237-A240 PolarHBondContact N-O 3.03Å; Y237-A240 PolarHBondContact O-N 3.46Å; Y237-A240 VanDerWaalsContact O-O 3.13Å; A240-M242 HydrophobicContact CB-CG 4.47Å
241	R	98.8	Very high	98.8	Very high	16 Å²	16	34.6 Å²	34.6	6%	0.06	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	115.2	156.9	-61.5	-170.9	179.2	77.9	6.7	107.8	G235 R236 G267 S269 F287 T288 T289	G235-R241 CarbonylContact O-C 3.57Å; G235-R241 WeakPolarHBondContact O-CA 3.42Å; R236-R241 HydrophobicContact CB-CG 4.27Å; R236-R241 HydrophobicContact CG-CG 4.47Å; R241-G267 CarbonylContact O-C 3.59Å; R241-G267 VanDerWaalsContact O-C 3.27Å; R241-G267 VanDerWaalsContact O-CA 3.28Å; R241-G267 WeakPolarHBondContact O-CA 3.46Å; R241-S269 WeakPolarHBondContact CD-OG 3.3Å; R241-S269 PolarHBondContact NE-OG 3.18Å; R241-F287 WeakPolarHBondContact CD-O 3.29Å; R241-T288 WeakPolarHBondContact CD-O 3.33Å; R241-T288 PolarHBondContact NH1-O 3.27Å; R241-T289 PolarHBondContact N-OG1 2.87Å; R241-T289 PolarHBondContact NH1-O 3.03Å; R241-T289 PolarHBondContact O-OG1 2.83Å
242	M	98.8	Very high	98.7	Very high	24 Å²	24	38.1 Å²	38.1	12%	0.118	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	161.9	-162.5	-57.2	172.1	-68.6	0	0	111.9	R218 G234 G235 Y237 A240 D244 G267 R268	R218-M242 HydrophobicContact CB-CE 3.71Å; R218-M242 VanDerWaalsContact CZ-CE 3.4Å; G234-M242 WeakPolarHBondContact CA-O 3.47Å; G235-M242 PolarHBondContact O-N 2.83Å; Y237-M242 HydrophobicContact CD1-SD 4.46Å; A240-M242 HydrophobicContact CB-CG 4.47Å; M242-D244 VanDerWaalsContact CB-OD1 3.28Å; M242-D244 WeakPolarHBondContact CB-OD1 3.42Å; M242-G267 VanDerWaalsContact C-CA 3.45Å; M242-G267 CarbonylContact O-C 3.6Å; M242-G267 WeakPolarHBondContact O-CA 3.25Å; M242-R268 PolarHBondContact O-N 2.86Å
243	N	98.8	Very high	98.7	Very high	90 Å²	90	40.3 Å²	40.3	48%	0.481	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	14.9	175.4	67.7	-29	0	0	0	112.9	F233	F233-N243 VanDerWaalsContact CE2-O 3.24Å; F233-N243 WeakPolarHBondContact CE2-O 3.45Å; F233-N243 HydrophobicContact CZ-CB 4.48Å
244	D	98.8	Very high	98.7	Very high	33 Å²	33	44.4 Å²	44.4	18%	0.176	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	145.8	178.4	62	-29	0	0	0	111	R218 F233 G234 M242 H246	R218-D244 IonicContact CZ-OD1 3.03Å; R218-D244 IonicContact CZ-OD2 3.43Å; R218-D244 IonicContact NH1-OD1 2.98Å; R218-D244 PolarHBondContact NH1-OD1 2.85Å; R218-D244 IonicContact NH1-OD2 3.46Å; R218-D244 PolarHBondContact NH1-OD2 2.62Å; R218-D244 IonicContact NH2-OD1 2.69Å; R218-D244 IonicContact NH2-OD2 3.01Å; R218-D244 PolarHBondContact NH2-OD2 3.36Å; F233-D244 WeakPolarHBondContact CA-O 3.36Å; F233-D244 WeakPolarHBondContact CD2-O 3.18Å; G234-D244 PolarHBondContact N-O 3.08Å; M242-D244 VanDerWaalsContact CB-OD1 3.28Å; M242-D244 WeakPolarHBondContact CB-OD1 3.42Å; D244-H246 IonicContact OD2-CD2 2.86Å; D244-H246 PolarHBondContact OD2-CD2 2.87Å; D244-H246 IonicContact OD2-NE2 2.99Å; D244-H246 PolarHBondContact OD2-NE2 2.89Å
245	L	98.9	Very high	98.7	Very high	2 Å²	2	44.7 Å²	44.7	1%	0.01	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	128.2	178.2	-178.4	64.4	0	0	0	108.6	F233 L258 P260 Y300 W307	F233-L245 HydrophobicContact CB-CD1 3.9Å; F233-L245 HydrophobicContact CD2-CB 3.95Å; F233-L245 HydrophobicContact CD2-CD1 3.99Å; F233-L245 HydrophobicContact CG-CD1 4.38Å; L245-L258 HydrophobicContact CB-CB 4.28Å; L245-L258 HydrophobicContact CD2-CB 4.09Å; L245-L258 HydrophobicContact CD2-CD1 3.84Å; L245-L258 HydrophobicContact CG-CB 4.09Å; L245-L258 HydrophobicContact CG-CD1 3.88Å; L245-L258 PolarHBondContact O-N 2.94Å; L245-P260 HydrophobicContact CD2-CG 4.35Å; L245-Y300 HydrophobicContact CD2-CD1 4.04Å; L245-Y300 HydrophobicContact CD2-CD2 3.81Å; L245-Y300 HydrophobicContact CD2-CE1 3.75Å; L245-Y300 HydrophobicContact CD2-CE2 3.51Å; L245-Y300 HydrophobicContact CD2-CG 4.06Å; L245-Y300 VanDerWaalsContact CD2-CZ 3.47Å; L245-W307 HydrophobicContact CD2-CZ2 4.17Å
246	H	98.9	Very high	98.7	Very high	2 Å²	2	46.8 Å²	46.8	1%	0.009	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	162.6	175.8	-60.1	-105.5	0	0	0	109.9	P215 F231 V232 D244 W255 N256 E257	P215-H246 HydrophobicContact CG-CB 3.81Å; F231-H246 CarbonylContact C-O 3.57Å; F231-H246 VanDerWaalsContact CA-O 3.32Å; F231-H246 WeakPolarHBondContact CA-O 3.39Å; V232-H246 HydrophobicContact CG1-CB 3.93Å; V232-H246 PolarHBondContact N-O 2.97Å; V232-H246 PolarHBondContact O-N 2.99Å; D244-H246 IonicContact OD2-CD2 2.86Å; D244-H246 PolarHBondContact OD2-CD2 2.87Å; D244-H246 IonicContact OD2-NE2 2.99Å; D244-H246 PolarHBondContact OD2-NE2 2.89Å; H246-W255 HydrophobicContact CB-CE3 4.12Å; H246-W255 HydrophobicContact CB-CZ3 4Å; H246-N256 CarbonylContact C-O 3.59Å; H246-N256 VanDerWaalsContact CA-O 3.25Å; H246-N256 WeakPolarHBondContact CA-O 3.43Å; H246-E257 VanDerWaalsContact CE1-CG 3.45Å; H246-E257 WeakPolarHBondContact CE1-CG 3.5Å; H246-E257 IonicContact CE1-OE2 3.24Å; H246-E257 WeakPolarHBondContact ND1-CA 3.48Å
247	Y	98.9	Very high	98.7	Very high	26 Å²	26	47.2 Å²	47.2	10%	0.102	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	146.2	158.8	75.6	-84.7	0	0	0	111.5	R229 G230 F231 N249 N256 L258	R229-Y247 HydrophobicContact CB-CD2 3.74Å; R229-Y247 HydrophobicContact CB-CE2 4.39Å; R229-Y247 HydrophobicContact CB-CG 4.23Å; R229-Y247 HydrophobicContact CG-CD2 3.57Å; R229-Y247 HydrophobicContact CG-CE2 3.71Å; R229-Y247 HydrophobicContact CG-CG 4.36Å; G230-Y247 CarbonylContact O-C 3.56Å; G230-Y247 VanDerWaalsContact O-CA 3.22Å; G230-Y247 WeakPolarHBondContact O-CA 3.48Å; F231-Y247 HydrophobicContact CE1-CD1 4.44Å; F231-Y247 HydrophobicContact CE1-CG 4.45Å; Y247-N249 HydrophobicContact CE2-CB 4.4Å; Y247-N256 HydrophobicContact CD1-CB 3.72Å; Y247-N256 HydrophobicContact CD2-CB 4.48Å; Y247-N256 HydrophobicContact CE1-CB 3.27Å; Y247-N256 HydrophobicContact CE2-CB 4.1Å; Y247-N256 HydrophobicContact CG-CB 4.31Å; Y247-N256 VanDerWaalsContact CZ-CB 3.48Å; Y247-N256 PolarHBondContact N-O 3.27Å; Y247-N256 PolarHBondContact O-N 2.86Å; Y247-L258 HydrophobicContact CD1-CD1 3.69Å; Y247-L258 HydrophobicContact CD1-CD2 4.12Å; Y247-L258 HydrophobicContact CD1-CG 3.88Å; Y247-L258 HydrophobicContact CE1-CD1 4.38Å; Y247-L258 HydrophobicContact CE1-CD2 3.97Å; Y247-L258 HydrophobicContact CE1-CG 4.22Å
248	L	98.9	Very high	98.7	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	126	166.5	-178.8	59.3	0	0	0	108.3	W151 V195 T210 G230 L250 W253 W255	W151-L248 HydrophobicContact CE3-CD2 4.49Å; W151-L248 HydrophobicContact CH2-CB 4.33Å; W151-L248 HydrophobicContact CH2-CD2 4.39Å; W151-L248 HydrophobicContact CZ3-CB 4.41Å; W151-L248 HydrophobicContact CZ3-CD2 3.83Å; V195-L248 HydrophobicContact CG1-CD2 4.07Å; V195-L248 HydrophobicContact CG2-CD2 4.28Å; T210-L248 HydrophobicContact CG2-CD1 4.22Å; G230-L248 PolarHBondContact N-O 3.03Å; G230-L248 PolarHBondContact O-N 3Å; L248-L250 HydrophobicContact CB-CD2 4.35Å; L248-L250 HydrophobicContact CD2-CD2 4.16Å; L248-L250 HydrophobicContact CG-CD2 4.13Å; L248-L250 PolarHBondContact O-N 2.95Å; L248-W253 VanDerWaalsContact CD1-C 3.5Å; L248-W253 HydrophobicContact CD2-CE3 4.05Å; L248-W253 HydrophobicContact CD2-CZ3 4.31Å; L248-W253 HydrophobicContact CG-CE3 4.44Å; L248-W255 HydrophobicContact CB-CD2 4.05Å; L248-W255 HydrophobicContact CB-CE3 3.89Å; L248-W255 HydrophobicContact CB-CH2 4Å; L248-W255 HydrophobicContact CB-CZ2 4.1Å; L248-W255 HydrophobicContact CB-CZ3 3.87Å; L248-W255 HydrophobicContact CD1-CD2 3.92Å; L248-W255 HydrophobicContact CD1-CG 3.99Å; L248-W255 HydrophobicContact CD2-CZ2 4.17Å; L248-W255 HydrophobicContact CG-CD2 4.5Å
249	N	98.9	Very high	98.7	Very high	27 Å²	27	46 Å²	46	14%	0.144	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	117.6	167.2	-176.2	-35.8	0	0	0	108.8	Y247 D251 T252 W253 E254	Y247-N249 HydrophobicContact CE2-CB 4.4Å; N249-D251 VanDerWaalsContact C-N 3.29Å; N249-D251 PolarHBondContact O-N 3.37Å; N249-D251 PolarHBondContact OD1-N 3.41Å; N249-T252 VanDerWaalsContact CB-OG1 3.28Å; N249-T252 WeakPolarHBondContact CB-OG1 3.48Å; N249-T252 PolarHBondContact ND2-OG1 2.89Å; N249-T252 PolarHBondContact OD1-N 2.91Å; N249-T252 VanDerWaalsContact OD1-N 3.12Å; N249-W253 WeakPolarHBondContact O-CA 3.26Å; N249-W253 PolarHBondContact O-N 2.81Å; N249-E254 PolarHBondContact N-O 2.83Å
250	L	98.8	Very high	98.7	Very high	4 Å²	4	40.2 Å²	40.2	2%	0.021	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.3	-3	-172.3	-54.2	177.8	0	0	0	113.4	W151 Y153 T225 N228 L248 W253	W151-L250 HydrophobicContact CB-CD1 4.05Å; W151-L250 HydrophobicContact CE3-CD2 4.17Å; Y153-L250 HydrophobicContact CD1-CB 3.56Å; Y153-L250 HydrophobicContact CD2-CD1 4.41Å; Y153-L250 HydrophobicContact CE1-CB 4Å; Y153-L250 WeakPolarHBondContact CE1-O 3.25Å; Y153-L250 HydrophobicContact CG-CB 3.85Å; Y153-L250 HydrophobicContact CG-CD1 3.97Å; T225-L250 HydrophobicContact CG2-CD1 4.01Å; N228-L250 WeakPolarHBondContact O-CB 3.44Å; N228-L250 WeakPolarHBondContact O-CG 3.26Å; N228-L250 PolarHBondContact O-N 3.08Å; L248-L250 HydrophobicContact CB-CD2 4.35Å; L248-L250 HydrophobicContact CD2-CD2 4.16Å; L248-L250 HydrophobicContact CG-CD2 4.13Å; L248-L250 PolarHBondContact O-N 2.95Å; L250-W253 HydrophobicContact CD2-CZ3 4.33Å
251	D	98.6	Very high	98.3	Very high	70 Å²	70	45 Å²	45	37%	0.374	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.6	-45.1	167	-67.8	-52.8	0	0	0	111.8	Y153 K154 N228 N249	Y153-D251 WeakPolarHBondContact CE1-OD1 3.47Å; Y153-D251 VanDerWaalsContact CZ-OD1 3.28Å; Y153-D251 PolarHBondContact OH-OD1 2.69Å; Y153-D251 PolarHBondContact OH-OD2 3.3Å; K154-D251 IonicContact NZ-OD1 3.47Å; K154-D251 PolarHBondContact NZ-OD1 3.01Å; K154-D251 VanDerWaalsContact NZ-OD1 3.17Å; N228-D251 VanDerWaalsContact CB-OD2 3.28Å; N228-D251 WeakPolarHBondContact CB-OD2 3.45Å; N228-D251 PolarHBondContact ND2-OD2 3.46Å; N249-D251 VanDerWaalsContact C-N 3.29Å; N249-D251 PolarHBondContact O-N 3.37Å; N249-D251 PolarHBondContact OD1-N 3.41Å
252	T	98.7	Very high	98	Very high	76 Å²	76	47.7 Å²	47.7	47%	0.466	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.8	-13.1	-173.7	67	0	0	0	0	114.2	N249 E254	N249-T252 VanDerWaalsContact CB-OG1 3.28Å; N249-T252 WeakPolarHBondContact CB-OG1 3.48Å; N249-T252 PolarHBondContact ND2-OG1 2.89Å; N249-T252 PolarHBondContact OD1-N 2.91Å; N249-T252 VanDerWaalsContact OD1-N 3.12Å; T252-E254 PolarHBondContact O-N 2.8Å; T252-E254 WeakPolarHBondContact OG1-CB 3.26Å; T252-E254 PolarHBondContact OG1-N 2.65Å
253	W	98.8	Very high	98	Very high	46 Å²	46	52.9 Å²	52.9	17%	0.174	29%	0.286	C	S	.	.			trans	60.1	26.8	-173	-51.3	107	0	0	0	114.1	I158 I197 P208 I209 T210 T211 L248 N249 L250	I158-W253 HydrophobicContact CG1-CH2 4.11Å; I158-W253 HydrophobicContact CG1-CZ3 4.3Å; I158-W253 HydrophobicContact CG2-CZ3 4.18Å; I197-W253 HydrophobicContact CD1-CH2 3.36Å; I197-W253 HydrophobicContact CD1-CZ2 3.52Å; I197-W253 HydrophobicContact CD1-CZ3 4.06Å; I197-W253 HydrophobicContact CG1-CH2 3.85Å; I197-W253 HydrophobicContact CG1-CZ2 4.47Å; I197-W253 HydrophobicContact CG1-CZ3 4.36Å; P208-W253 HydrophobicContact CB-CB 4.31Å; P208-W253 HydrophobicContact CB-CD2 3.38Å; P208-W253 HydrophobicContact CB-CE3 3.62Å; P208-W253 HydrophobicContact CB-CG 3.69Å; P208-W253 HydrophobicContact CB-CH2 4.46Å; P208-W253 HydrophobicContact CB-CZ2 4.26Å; P208-W253 HydrophobicContact CB-CZ3 4.15Å; P208-W253 HydrophobicContact CG-CD2 3.95Å; P208-W253 HydrophobicContact CG-CE3 3.6Å; P208-W253 HydrophobicContact CG-CH2 4.47Å; P208-W253 HydrophobicContact CG-CZ3 3.89Å; I209-W253 WeakPolarHBondContact O-CB 3.32Å; T210-W253 CarbonylContact C-O 3.59Å; T210-W253 WeakPolarHBondContact CA-O 3.22Å; T210-W253 VanDerWaalsContact CB-O 3.29Å; T210-W253 WeakPolarHBondContact CB-O 3.35Å; T210-W253 HydrophobicContact CG2-CB 4.27Å; T211-W253 PolarHBondContact N-O 2.8Å; L248-W253 VanDerWaalsContact CD1-C 3.5Å; L248-W253 HydrophobicContact CD2-CE3 4.05Å; L248-W253 HydrophobicContact CD2-CZ3 4.31Å; L248-W253 HydrophobicContact CG-CE3 4.44Å; N249-W253 WeakPolarHBondContact O-CA 3.26Å; N249-W253 PolarHBondContact O-N 2.81Å; L250-W253 HydrophobicContact CD2-CZ3 4.33Å
254	E	98.9	Very high	97.9	Very high	86 Å²	86	50.7 Å²	50.7	40%	0.402	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	125.4	177.9	-174.3	178.6	-169.5	0	0	111.9	N249 T252 N256	N249-E254 PolarHBondContact N-O 2.83Å; T252-E254 PolarHBondContact O-N 2.8Å; T252-E254 WeakPolarHBondContact OG1-CB 3.26Å; T252-E254 PolarHBondContact OG1-N 2.65Å; E254-N256 PolarHBondContact O-ND2 3.38Å; E254-N256 VanDerWaalsContact O-ND2 3.08Å
255	W	98.9	Very high	97.9	Very high	6 Å²	6	49.1 Å²	49.1	2%	0.023	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	132.8	172.3	-80.5	109.4	0	0	0	112.2	W151 F160 V195 T211 K213 T214 P215 V232 H246 L248	W151-W255 AromaticContact CH2-CH2 3.57Å; W151-W255 HydrophobicContact CH2-CH2 3.57Å; W151-W255 HydrophobicContact CH2-CZ2 4.1Å; W151-W255 HydrophobicContact CH2-CZ3 4.44Å; W151-W255 HydrophobicContact CZ2-CH2 4.17Å; F160-W255 HydrophobicContact CD1-CH2 4.44Å; F160-W255 HydrophobicContact CD2-CH2 4.09Å; F160-W255 AromaticContact CD2-CZ2 3.79Å; F160-W255 HydrophobicContact CD2-CZ2 3.79Å; F160-W255 HydrophobicContact CE1-CH2 4.27Å; F160-W255 AromaticContact CE2-CH2 3.89Å; F160-W255 HydrophobicContact CE2-CH2 3.89Å; F160-W255 AromaticContact CE2-CZ2 3.58Å; F160-W255 HydrophobicContact CE2-CZ2 3.58Å; F160-W255 HydrophobicContact CG-CH2 4.36Å; F160-W255 HydrophobicContact CG-CZ2 4.46Å; F160-W255 AromaticContact CZ-CH2 3.99Å; F160-W255 HydrophobicContact CZ-CH2 3.99Å; F160-W255 HydrophobicContact CZ-CZ2 4.12Å; V195-W255 HydrophobicContact CG2-CZ2 4Å; T211-W255 PolarHBondContact O-N 3.06Å; K213-W255 WeakPolarHBondContact O-CB 3.24Å; T214-W255 HydrophobicContact CG2-CZ2 4.41Å; T214-W255 PolarHBondContact OG1-NE1 3.03Å; P215-W255 HydrophobicContact CG-CD2 4.39Å; P215-W255 HydrophobicContact CG-CE3 3.88Å; P215-W255 HydrophobicContact CG-CH2 3.79Å; P215-W255 HydrophobicContact CG-CZ2 4.35Å; P215-W255 HydrophobicContact CG-CZ3 3.57Å; V232-W255 HydrophobicContact CG1-CH2 3.99Å; V232-W255 HydrophobicContact CG1-CZ3 3.78Å; H246-W255 HydrophobicContact CB-CE3 4.12Å; H246-W255 HydrophobicContact CB-CZ3 4Å; L248-W255 HydrophobicContact CB-CD2 4.05Å; L248-W255 HydrophobicContact CB-CE3 3.89Å; L248-W255 HydrophobicContact CB-CH2 4Å; L248-W255 HydrophobicContact CB-CZ2 4.1Å; L248-W255 HydrophobicContact CB-CZ3 3.87Å; L248-W255 HydrophobicContact CD1-CD2 3.92Å; L248-W255 HydrophobicContact CD1-CG 3.99Å; L248-W255 HydrophobicContact CD2-CZ2 4.17Å; L248-W255 HydrophobicContact CG-CD2 4.5Å
256	N	98.8	Very high	97.9	Very high	43 Å²	43	52.7 Å²	52.7	23%	0.23	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	117.7	-179.6	-71.5	-98.5	0	0	0	109.9	H246 Y247 E254	H246-N256 CarbonylContact C-O 3.59Å; H246-N256 VanDerWaalsContact CA-O 3.25Å; H246-N256 WeakPolarHBondContact CA-O 3.43Å; Y247-N256 HydrophobicContact CD1-CB 3.72Å; Y247-N256 HydrophobicContact CD2-CB 4.48Å; Y247-N256 HydrophobicContact CE1-CB 3.27Å; Y247-N256 HydrophobicContact CE2-CB 4.1Å; Y247-N256 HydrophobicContact CG-CB 4.31Å; Y247-N256 VanDerWaalsContact CZ-CB 3.48Å; Y247-N256 PolarHBondContact N-O 3.27Å; Y247-N256 PolarHBondContact O-N 2.86Å; E254-N256 PolarHBondContact O-ND2 3.38Å; E254-N256 VanDerWaalsContact O-ND2 3.08Å
257	E	98.6	Very high	97.9	Very high	83 Å²	83	53 Å²	53	39%	0.388	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	127	170.1	-174.2	167	-174.9	0	0	108.9	K213 H246 I259	K213-E257 IonicContact NZ-OE2 2.73Å; K213-E257 PolarHBondContact NZ-OE2 3.04Å; H246-E257 VanDerWaalsContact CE1-CG 3.45Å; H246-E257 WeakPolarHBondContact CE1-CG 3.5Å; H246-E257 IonicContact CE1-OE2 3.24Å; H246-E257 WeakPolarHBondContact ND1-CA 3.48Å; E257-I259 HydrophobicContact CG-CD1 3.91Å
258	L	98.6	Very high	97.9	Very high	27 Å²	27	51.8 Å²	51.8	14%	0.141	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	128	176.6	-69.2	165.3	0	0	0	108.3	F231 L245 Y247 P260 Y300	F231-L258 HydrophobicContact CD1-CD1 3.96Å; F231-L258 HydrophobicContact CE1-CD1 3.69Å; L245-L258 HydrophobicContact CB-CB 4.28Å; L245-L258 HydrophobicContact CD2-CB 4.09Å; L245-L258 HydrophobicContact CD2-CD1 3.84Å; L245-L258 HydrophobicContact CG-CB 4.09Å; L245-L258 HydrophobicContact CG-CD1 3.88Å; L245-L258 PolarHBondContact O-N 2.94Å; Y247-L258 HydrophobicContact CD1-CD1 3.69Å; Y247-L258 HydrophobicContact CD1-CD2 4.12Å; Y247-L258 HydrophobicContact CD1-CG 3.88Å; Y247-L258 HydrophobicContact CE1-CD1 4.38Å; Y247-L258 HydrophobicContact CE1-CD2 3.97Å; Y247-L258 HydrophobicContact CE1-CG 4.22Å; L258-P260 WeakPolarHBondContact O-CD 3.3Å; L258-Y300 HydrophobicContact CD1-CE1 4.29Å; L258-Y300 WeakPolarHBondContact CD1-OH 3.48Å
259	I	98.1	Very high	97.9	Very high	120 Å²	120	51.9 Å²	51.9	62%	0.615	29%	0.29	S	S	*	.			trans	-112.3	90.8	174.4	-51.5	-60.2	0	0	0	107	E257 N305	E257-I259 HydrophobicContact CG-CD1 3.91Å; I259-N305 PolarHBondContact O-ND2 2.85Å
260	P	96.9	Very high	97.9	Very high	20 Å²	20	52 Å²	52	13%	0.13	29%	0.288	C	S	.	.			trans	-65.2	149.4	-178.8	-20.1	33.9	0	0	0	111.3	L245 L258 Y300 N305	L245-P260 HydrophobicContact CD2-CG 4.35Å; L258-P260 WeakPolarHBondContact O-CD 3.3Å; P260-Y300 HydrophobicContact CB-CE2 4.26Å; P260-Y300 HydrophobicContact CG-CE2 3.94Å; P260-N305 WeakPolarHBondContact CA-O 3.26Å; P260-N305 WeakPolarHBondContact CA-OD1 3.24Å; P260-N305 WeakPolarHBondContact CB-O 3.37Å
261	Q	91.3	Very high	97.9	Very high	144 Å²	144	52.4 Å²	52.4	67%	0.673	29%	0.29	S	S	*	.	B	Isolated β-bridge	trans	-79.5	146.3	174.7	-59.6	-178.3	17.7	0	0	110.2	N305	Q261-N305 PolarHBondContact N-O 2.97Å; Q261-N305 VanDerWaalsContact N-O 3.1Å
262	G	92.8	Very high	97.9	Very high	73 Å²	73	49.5 Å²	49.5	75%	0.753	28%	0.275	S	S	*	.	S	Bend	trans	78.8	-146.8	173.3	0	0	0	0	0	114.6
263	I	97.1	Very high	97.9	Very high	133 Å²	133	46.5 Å²	46.5	68%	0.682	26%	0.256	S	S	*	.			trans	-78	126.4	-173.8	-59.1	175.9	0	0	0	109.2	W298	I263-W298 HydrophobicContact CG2-CH2 3.83Å; I263-W298 HydrophobicContact CG2-CZ3 4.31Å
264	C	98.4	Very high	98	Very high	44 Å²	44	44.8 Å²	44.8	30%	0.297	25%	0.251	S	S	.	.			trans	-104.4	151	174.7	-67.5	0	0	0	0	111.2
265	P	98.7	Very high	97.9	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	25%	0.246	C	C	.	.	P	Polyproline II helix	trans	-58.2	144.8	172	-16.5	26	0	0	0	111.3	F233 R268 L283 W298 W307	F233-P265 HydrophobicContact CZ-CB 4.12Å; F233-P265 HydrophobicContact CZ-CG 4.25Å; P265-R268 VanDerWaalsContact CB-NH2 3.3Å; P265-L283 HydrophobicContact CB-CD2 3.65Å; P265-L283 HydrophobicContact CG-CD2 3.58Å; P265-W298 HydrophobicContact CB-CD2 4.21Å; P265-W298 HydrophobicContact CB-CG 4.25Å; P265-W298 HydrophobicContact CG-CB 4.26Å; P265-W298 HydrophobicContact CG-CD2 3.73Å; P265-W298 HydrophobicContact CG-CE3 4.14Å; P265-W298 HydrophobicContact CG-CG 3.76Å; P265-W307 VanDerWaalsContact CD-CG 3.43Å; P265-W307 HydrophobicContact CG-CD2 3.61Å; P265-W307 HydrophobicContact CG-CE3 3.73Å; P265-W307 HydrophobicContact CG-CG 4Å; P265-W307 HydrophobicContact CG-CH2 4.39Å; P265-W307 HydrophobicContact CG-CZ2 4.3Å; P265-W307 HydrophobicContact CG-CZ3 4.12Å
266	V	98.8	Very high	97.9	Very high	76 Å²	76	43.6 Å²	43.6	46%	0.461	25%	0.251	S	S	.	.	P	Polyproline II helix	trans	-59.3	150.7	175.1	65.6	0	0	0	0	111.8	R268 T288 L294	V266-R268 PolarHBondContact O-NE 2.88Å; V266-R268 PolarHBondContact O-NH2 3Å; V266-T288 HydrophobicContact CG1-CG2 4Å; V266-T288 HydrophobicContact CG2-CG2 4.35Å; V266-L294 HydrophobicContact CG1-CD1 4.04Å; V266-L294 HydrophobicContact CG1-CD2 4.01Å
267	G	98.8	Very high	97.8	Very high	10 Å²	10	43.3 Å²	43.3	10%	0.103	25%	0.253	C	S	.	.	P	Polyproline II helix	trans	-61.4	134.8	179.5	0	0	0	0	0	113.3	R241 M242 T288	R241-G267 CarbonylContact O-C 3.59Å; R241-G267 VanDerWaalsContact O-C 3.27Å; R241-G267 VanDerWaalsContact O-CA 3.28Å; R241-G267 WeakPolarHBondContact O-CA 3.46Å; M242-G267 VanDerWaalsContact C-CA 3.45Å; M242-G267 CarbonylContact O-C 3.6Å; M242-G267 WeakPolarHBondContact O-CA 3.25Å; G267-T288 WeakPolarHBondContact O-CA 3.38Å
268	R	98.9	Very high	97.7	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	27%	0.269	C	S	.	.			trans	-155.8	150.5	-166.1	60.4	-175	80	-160	0.3	114.2	F233 G235 M242 P265 V266 H271 G285 F287 L294 D296	F233-R268 HydrophobicContact CE1-CG 3.94Å; G235-R268 PolarHBondContact N-O 3.28Å; M242-R268 PolarHBondContact O-N 2.86Å; P265-R268 VanDerWaalsContact CB-NH2 3.3Å; V266-R268 PolarHBondContact O-NE 2.88Å; V266-R268 PolarHBondContact O-NH2 3Å; R268-H271 HydrophobicContact CG-CB 4.19Å; R268-H271 PolarHBondContact O-CE1 3.35Å; R268-H271 PolarHBondContact O-ND1 2.97Å; R268-G285 WeakPolarHBondContact CD-O 3.4Å; R268-G285 PolarHBondContact NH1-O 2.82Å; R268-F287 VanDerWaalsContact CA-O 3.22Å; R268-F287 WeakPolarHBondContact CA-O 3.12Å; R268-L294 HydrophobicContact CB-CD1 3.75Å; R268-D296 IonicContact CZ-OD1 2.76Å; R268-D296 IonicContact CZ-OD2 2.78Å; R268-D296 VanDerWaalsContact NH1-CG 3.35Å; R268-D296 IonicContact NH1-OD1 3.04Å; R268-D296 PolarHBondContact NH1-OD1 3.1Å; R268-D296 IonicContact NH1-OD2 2.77Å; R268-D296 PolarHBondContact NH1-OD2 3.41Å; R268-D296 IonicContact NH2-OD1 2.9Å; R268-D296 IonicContact NH2-OD2 2.86Å; R268-D296 PolarHBondContact NH2-OD2 3.31Å
269	S	98.9	Very high	97.7	Very high	1 Å²	1	45 Å²	45	1%	0.007	27%	0.273	C	S	.	.	B	Isolated β-bridge	trans	-122	170.8	165.1	78.1	0	0	0	0	109.8	A220 R241 H271 G286 F287	A220-S269 CarbonylContact O-C 3.27Å; A220-S269 VanDerWaalsContact O-CA 3.27Å; A220-S269 WeakPolarHBondContact O-CA 3.47Å; A220-S269 WeakPolarHBondContact O-CB 3.42Å; R241-S269 WeakPolarHBondContact CD-OG 3.3Å; R241-S269 PolarHBondContact NE-OG 3.18Å; S269-H271 PolarHBondContact O-N 2.75Å; S269-H271 VanDerWaalsContact O-N 3.13Å; S269-G286 CarbonylContact O-C 3.48Å; S269-G286 VanDerWaalsContact O-CA 3.3Å; S269-G286 WeakPolarHBondContact O-CA 3.49Å; S269-F287 PolarHBondContact N-O 3.22Å; S269-F287 PolarHBondContact O-N 3.01Å
270	W	98.9	Very high	97.7	Very high	30 Å²	30	42 Å²	42	11%	0.114	26%	0.256	C	S	.	.	S	Bend	trans	56.7	26.8	178.4	-68	-50.1	0	0	0	114.1	A220 F287 L320 W321 L342 L343	A220-W270 VanDerWaalsContact CB-CD1 3.44Å; A220-W270 HydrophobicContact CB-CD2 4.5Å; A220-W270 HydrophobicContact CB-CG 3.94Å; A220-W270 PolarHBondContact O-N 3.21Å; W270-F287 HydrophobicContact CE3-CB 4.01Å; W270-F287 AromaticContact CE3-CD1 3.85Å; W270-F287 HydrophobicContact CE3-CD1 3.85Å; W270-F287 HydrophobicContact CE3-CG 4.23Å; W270-F287 AromaticContact CZ3-CD1 3.67Å; W270-F287 HydrophobicContact CZ3-CD1 3.67Å; W270-F287 HydrophobicContact CZ3-CE1 4.13Å; W270-F287 HydrophobicContact CZ3-CG 4.43Å; W270-L320 HydrophobicContact CB-CB 4.02Å; W270-L320 HydrophobicContact CD2-CD1 4.39Å; W270-L320 HydrophobicContact CE3-CD1 3.61Å; W270-L320 HydrophobicContact CZ3-CD1 4.03Å; W270-L320 WeakPolarHBondContact O-CA 3.32Å; W270-W321 HydrophobicContact CB-CB 4.09Å; W270-W321 AromaticContact CD1-CD1 3.69Å; W270-W321 AromaticContact CD1-CD2 3.76Å; W270-W321 AromaticContact CD1-CG 3.49Å; W270-W321 VanDerWaalsContact CD1-CG 3.49Å; W270-W321 HydrophobicContact CG-CB 4Å; W270-W321 HydrophobicContact CG-CG 4.14Å; W270-W321 HydrophobicContact CZ2-CE3 4.37Å; W270-W321 HydrophobicContact CZ2-CZ3 4.48Å; W270-W321 AromaticContact NE1-CD2 3.54Å; W270-W321 AromaticContact NE1-CE2 3.82Å; W270-W321 AromaticContact NE1-CE3 3.82Å; W270-W321 AromaticContact NE1-CG 3.82Å; W270-W321 PolarHBondContact O-N 2.71Å; W270-L342 HydrophobicContact CE3-CD2 4.5Å; W270-L342 HydrophobicContact CH2-CD1 3.65Å; W270-L342 HydrophobicContact CH2-CG 4.28Å; W270-L342 HydrophobicContact CZ2-CD1 4.13Å; W270-L342 HydrophobicContact CZ3-CD1 4.06Å; W270-L342 HydrophobicContact CZ3-CD2 4.41Å; W270-L342 HydrophobicContact CZ3-CG 4.19Å; W270-L343 HydrophobicContact CH2-CD2 3.94Å; W270-L343 HydrophobicContact CH2-CG 4.43Å
271	H	98.9	Very high	97.8	Very high	12 Å²	12	41 Å²	41	6%	0.056	25%	0.25	C	C	.	.			trans	-93.3	169.9	173.1	58.5	-82.3	0	0	0	109.8	A222 F233 R268 S269 L283 G285	A222-H271 VanDerWaalsContact CB-CD2 3.46Å; A222-H271 WeakPolarHBondContact CB-CD2 3.35Å; A222-H271 VanDerWaalsContact CB-NE2 3.34Å; A222-H271 WeakPolarHBondContact CB-NE2 3.12Å; F233-H271 AromaticContact CD1-CD2 3.99Å; F233-H271 AromaticContact CD1-NE2 3.47Å; F233-H271 WeakPolarHBondContact CD1-NE2 3.22Å; F233-H271 PolarHBondContact O-CE1 2.82Å; F233-H271 PolarHBondContact O-NE2 2.96Å; F233-H271 VanDerWaalsContact O-NE2 3.1Å; R268-H271 HydrophobicContact CG-CB 4.19Å; R268-H271 PolarHBondContact O-CE1 3.35Å; R268-H271 PolarHBondContact O-ND1 2.97Å; S269-H271 PolarHBondContact O-N 2.75Å; S269-H271 VanDerWaalsContact O-N 3.13Å; H271-L283 HydrophobicContact CB-CD1 4.1Å; H271-L283 WeakPolarHBondContact CD2-CD1 3.29Å; H271-G285 WeakPolarHBondContact CB-O 3.2Å
272	S	98.9	Very high	98.2	Very high	10 Å²	10	34.2 Å²	34.2	7%	0.07	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	140.6	172.2	57.5	0	0	0	0	111.1	L283 F284 H322	S272-L283 WeakPolarHBondContact O-CA 3.42Å; S272-L283 WeakPolarHBondContact O-CD1 3.33Å; S272-F284 PolarHBondContact N-O 3.27Å; S272-F284 PolarHBondContact O-N 2.95Å; S272-F284 VanDerWaalsContact O-N 3.08Å; S272-F284 PolarHBondContact OG-O 2.93Å; S272-H322 PolarHBondContact OG-NE2 3.09Å
273	L	98.9	Very high	98.5	Very high	12 Å²	12	30.7 Å²	30.7	6%	0.063	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	117.1	172.5	-173.4	70.3	0	0	0	108.3	A222 A224 F233 L281 F282 L283 W307	A222-L273 HydrophobicContact CB-CB 3.5Å; A224-L273 HydrophobicContact CB-CB 4.44Å; A224-L273 HydrophobicContact CB-CD2 3.84Å; A224-L273 HydrophobicContact CB-CG 3.87Å; F233-L273 HydrophobicContact CB-CD2 4Å; L273-L281 HydrophobicContact CD1-CB 3.82Å; L273-L281 HydrophobicContact CD1-CD1 4.47Å; L273-L281 HydrophobicContact CD2-CD1 4.12Å; L273-L281 HydrophobicContact CG-CB 4.23Å; L273-L281 HydrophobicContact CG-CD1 4.39Å; L273-F282 CarbonylContact C-O 3.58Å; L273-F282 WeakPolarHBondContact CA-O 3.25Å; L273-L283 HydrophobicContact CD1-CB 4.07Å; L273-L283 HydrophobicContact CD1-CD1 4.43Å; L273-W307 HydrophobicContact CD1-CH2 4.12Å
274	T	98.9	Very high	98.5	Very high	10 Å²	10	24.4 Å²	24.4	6%	0.061	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	124.1	-168.1	-48.2	0	0	0	0	110.2	V276 L281 F282 A324 A326 V332	T274-V276 PolarHBondContact O-N 2.83Å; T274-L281 CarbonylContact O-C 3.55Å; T274-L281 WeakPolarHBondContact O-CA 3.35Å; T274-F282 PolarHBondContact N-O 3.14Å; T274-F282 PolarHBondContact O-N 3.24Å; T274-A324 WeakPolarHBondContact OG1-CB 3.43Å; T274-A326 HydrophobicContact CG2-CB 3.95Å; T274-V332 HydrophobicContact CG2-CG1 4.45Å; T274-V332 HydrophobicContact CG2-CG2 4.47Å
275	P	98.6	Very high	98.6	Very high	46 Å²	46	22.3 Å²	22.3	30%	0.299	14%	0.135	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.2	128.6	168.1	-18.4	30.6	0	0	0	110.4	A224 T225 V226 L281	A224-P275 HydrophobicContact CB-CG 3.97Å; T225-P275 VanDerWaalsContact O-CG 3.3Å; T225-P275 WeakPolarHBondContact O-CG 3.31Å; V226-P275 HydrophobicContact CG2-CB 4Å; V226-P275 HydrophobicContact CG2-CG 4.41Å; P275-L281 HydrophobicContact CB-CD2 4.2Å; P275-L281 HydrophobicContact CG-CD2 4.24Å
276	V	97.7	Very high	98.6	Very high	21 Å²	21	22.3 Å²	22.3	13%	0.127	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	-8.8	178.7	-61.7	0	0	0	0	112.8	T274 H280 F282 V332 V359 Q360	T274-V276 PolarHBondContact O-N 2.83Å; V276-H280 HydrophobicContact CG2-CB 3.76Å; V276-H280 WeakPolarHBondContact CG2-O 3.49Å; V276-H280 PolarHBondContact N-O 3.39Å; V276-F282 HydrophobicContact CG1-CB 3.66Å; V276-F282 HydrophobicContact CG2-CB 4.28Å; V276-V332 HydrophobicContact CG1-CG2 3.38Å; V276-V359 HydrophobicContact CB-CG2 3.79Å; V276-V359 HydrophobicContact CG1-CG2 3.81Å; V276-V359 HydrophobicContact CG2-CG2 4.22Å; V276-Q360 PolarHBondContact O-NE2 2.84Å
277	S	96.6	Very high	98.6	Very high	38 Å²	38	18.7 Å²	18.7	27%	0.266	11%	0.113	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.2	-179.6	166.9	68.3	0	0	0	0	109	D279 H280	S277-D279 PolarHBondContact O-N 2.98Å; S277-D279 VanDerWaalsContact O-N 3.15Å; S277-D279 PolarHBondContact OG-N 2.73Å; S277-D279 VanDerWaalsContact OG-N 3.14Å; S277-H280 PolarHBondContact N-O 3.11Å; S277-H280 WeakPolarHBondContact OG-CB 3.42Å; S277-H280 PolarHBondContact OG-N 2.85Å; S277-H280 PolarHBondContact OG-ND1 2.97Å; S277-H280 VanDerWaalsContact OG-ND1 3.1Å
278	S	97.3	Very high	98.6	Very high	106 Å²	106	18.7 Å²	18.7	74%	0.741	11%	0.111	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65	-9	170.3	59.2	0	0	0	0	114.2	V226	V226-S278 VanDerWaalsContact CG1-O 3.24Å; V226-S278 WeakPolarHBondContact CG1-O 3.48Å
279	D	98	Very high	98.6	Very high	40 Å²	40	21.3 Å²	21.3	21%	0.214	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-131.9	0.8	-174.4	-162.9	42.6	0	0	0	114	S277 C301 I302 S303	S277-D279 PolarHBondContact O-N 2.98Å; S277-D279 VanDerWaalsContact O-N 3.15Å; S277-D279 PolarHBondContact OG-N 2.73Å; S277-D279 VanDerWaalsContact OG-N 3.14Å; D279-C301 CarbonylContact O-C 3.57Å; D279-C301 WeakPolarHBondContact O-CA 3.48Å; D279-C301 PolarHBondContact OD2-SG 3.13Å; D279-I302 PolarHBondContact O-N 3.41Å; D279-I302 WeakPolarHBondContact OD1-CB 3.34Å; D279-S303 WeakPolarHBondContact OD1-CA 3.47Å; D279-S303 WeakPolarHBondContact OD1-CB 3.46Å; D279-S303 PolarHBondContact OD1-N 3.02Å; D279-S303 PolarHBondContact OD1-OG 2.91Å; D279-S303 WeakPolarHBondContact OD2-CB 3.33Å; D279-S303 PolarHBondContact OD2-OG 2.94Å
280	H	98.5	Very high	98.6	Very high	56 Å²	56	27.6 Å²	27.6	26%	0.259	16%	0.161	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	132.9	-174.3	-62.4	77.3	0	0	0	112.8	V276 S277 Y300	V276-H280 HydrophobicContact CG2-CB 3.76Å; V276-H280 WeakPolarHBondContact CG2-O 3.49Å; V276-H280 PolarHBondContact N-O 3.39Å; S277-H280 PolarHBondContact N-O 3.11Å; S277-H280 WeakPolarHBondContact OG-CB 3.42Å; S277-H280 PolarHBondContact OG-N 2.85Å; S277-H280 PolarHBondContact OG-ND1 2.97Å; S277-H280 VanDerWaalsContact OG-ND1 3.1Å; H280-Y300 VanDerWaalsContact CA-O 3.31Å; H280-Y300 WeakPolarHBondContact CA-O 3.41Å
281	L	98.9	Very high	98.5	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	129.3	168.4	-51.8	177.2	0	0	0	109.2	A224 V226 F231 L273 T274 P275 T299 Y300 I302	A224-L281 HydrophobicContact CB-CD1 4.37Å; A224-L281 HydrophobicContact CB-CD2 3.91Å; V226-L281 HydrophobicContact CG2-CD2 3.6Å; F231-L281 HydrophobicContact CB-CD1 3.87Å; F231-L281 HydrophobicContact CD1-CD1 3.87Å; F231-L281 HydrophobicContact CD2-CD1 3.89Å; F231-L281 HydrophobicContact CE1-CD1 4.35Å; F231-L281 HydrophobicContact CE2-CD1 4.39Å; F231-L281 HydrophobicContact CG-CD1 3.6Å; L273-L281 HydrophobicContact CD1-CB 3.82Å; L273-L281 HydrophobicContact CD1-CD1 4.47Å; L273-L281 HydrophobicContact CD2-CD1 4.12Å; L273-L281 HydrophobicContact CG-CB 4.23Å; L273-L281 HydrophobicContact CG-CD1 4.39Å; T274-L281 CarbonylContact O-C 3.55Å; T274-L281 WeakPolarHBondContact O-CA 3.35Å; P275-L281 HydrophobicContact CB-CD2 4.2Å; P275-L281 HydrophobicContact CG-CD2 4.24Å; L281-T299 CarbonylContact O-C 3.6Å; L281-T299 VanDerWaalsContact O-CA 3.27Å; L281-T299 WeakPolarHBondContact O-CA 3.44Å; L281-Y300 HydrophobicContact CD1-CD1 4.08Å; L281-Y300 HydrophobicContact CG-CD1 4.44Å; L281-Y300 PolarHBondContact N-O 3.15Å; L281-Y300 PolarHBondContact O-N 3.27Å; L281-I302 HydrophobicContact CD2-CD1 4.46Å; L281-I302 HydrophobicContact CG-CD1 4.31Å
282	F	98.9	Very high	98.5	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	122.8	176.5	-177.7	-97.4	0	0	0	110.9	L273 T274 V276 F284 A297 W298 T299 F310 V332 F357 V359	L273-F282 CarbonylContact C-O 3.58Å; L273-F282 WeakPolarHBondContact CA-O 3.25Å; T274-F282 PolarHBondContact N-O 3.14Å; T274-F282 PolarHBondContact O-N 3.24Å; V276-F282 HydrophobicContact CG1-CB 3.66Å; V276-F282 HydrophobicContact CG2-CB 4.28Å; F282-F284 HydrophobicContact CD1-CB 4.48Å; F282-F284 HydrophobicContact CE1-CB 3.77Å; F282-F284 HydrophobicContact CZ-CB 4.38Å; F282-A297 HydrophobicContact CE2-CB 3.95Å; F282-A297 HydrophobicContact CZ-CB 3.71Å; F282-W298 CarbonylContact C-O 3.56Å; F282-W298 WeakPolarHBondContact CA-O 3.33Å; F282-T299 HydrophobicContact CD2-CG2 3.91Å; F282-F310 HydrophobicContact CE2-CB 4.21Å; F282-F310 AromaticContact CE2-CD1 3.76Å; F282-F310 HydrophobicContact CE2-CD1 3.76Å; F282-F310 HydrophobicContact CE2-CD2 4.4Å; F282-F310 HydrophobicContact CE2-CE1 4.21Å; F282-F310 AromaticContact CE2-CG 3.86Å; F282-F310 HydrophobicContact CE2-CG 3.86Å; F282-F310 HydrophobicContact CZ-CD1 4.34Å; F282-V332 HydrophobicContact CB-CG2 4.16Å; F282-V332 HydrophobicContact CD1-CB 4.02Å; F282-V332 HydrophobicContact CD1-CG1 3.89Å; F282-V332 HydrophobicContact CD1-CG2 3.82Å; F282-V332 HydrophobicContact CE1-CB 4.21Å; F282-V332 HydrophobicContact CE1-CG1 4.14Å; F282-V332 HydrophobicContact CE1-CG2 4.43Å; F282-V332 HydrophobicContact CG-CG2 4.04Å; F282-F357 HydrophobicContact CE1-CB 4.22Å; F282-F357 HydrophobicContact CE1-CD1 4.26Å; F282-F357 HydrophobicContact CE1-CD2 4.22Å; F282-F357 AromaticContact CE1-CG 4Å; F282-F357 HydrophobicContact CE1-CG 4Å; F282-F357 HydrophobicContact CE2-CB 4.39Å; F282-F357 HydrophobicContact CE2-CD1 4.38Å; F282-F357 HydrophobicContact CZ-CB 3.79Å; F282-F357 AromaticContact CZ-CD1 3.5Å; F282-F357 HydrophobicContact CZ-CD1 3.5Å; F282-F357 HydrophobicContact CZ-CD2 4.24Å; F282-F357 HydrophobicContact CZ-CE1 4.07Å; F282-F357 AromaticContact CZ-CG 3.6Å; F282-F357 HydrophobicContact CZ-CG 3.6Å; F282-V359 HydrophobicContact CD2-CG1 3.41Å; F282-V359 VanDerWaalsContact CD2-CG1 3.41Å; F282-V359 HydrophobicContact CE2-CG1 3.66Å; F282-V359 HydrophobicContact CG-CG1 3.99Å; F282-V359 HydrophobicContact CZ-CG1 4.43Å
283	L	98.9	Very high	98.5	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	135.3	177.5	173.3	68.9	0	0	0	109.6	F233 P265 H271 S272 L273 A297 W298 W307	F233-L283 HydrophobicContact CD1-CD1 3.93Å; F233-L283 HydrophobicContact CD1-CD2 4.14Å; F233-L283 HydrophobicContact CE1-CD1 4.12Å; F233-L283 HydrophobicContact CE1-CD2 3.63Å; F233-L283 HydrophobicContact CZ-CD2 4.28Å; P265-L283 HydrophobicContact CB-CD2 3.65Å; P265-L283 HydrophobicContact CG-CD2 3.58Å; H271-L283 HydrophobicContact CB-CD1 4.1Å; H271-L283 WeakPolarHBondContact CD2-CD1 3.29Å; S272-L283 WeakPolarHBondContact O-CA 3.42Å; S272-L283 WeakPolarHBondContact O-CD1 3.33Å; L273-L283 HydrophobicContact CD1-CB 4.07Å; L273-L283 HydrophobicContact CD1-CD1 4.43Å; L283-A297 CarbonylContact O-C 3.56Å; L283-A297 VanDerWaalsContact O-CA 3.28Å; L283-A297 WeakPolarHBondContact O-CA 3.42Å; L283-W298 HydrophobicContact CB-CB 4.21Å; L283-W298 HydrophobicContact CD2-CB 4.36Å; L283-W298 HydrophobicContact CD2-CG 4.44Å; L283-W298 PolarHBondContact N-O 2.95Å; L283-W298 PolarHBondContact O-N 2.74Å; L283-W307 HydrophobicContact CB-CH2 4.02Å; L283-W307 HydrophobicContact CB-CZ3 3.67Å; L283-W307 HydrophobicContact CD2-CH2 3.85Å; L283-W307 HydrophobicContact CD2-CZ3 3.82Å; L283-W307 HydrophobicContact CG-CH2 4.48Å; L283-W307 HydrophobicContact CG-CZ3 4.38Å
284	F	98.9	Very high	98.5	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	138.6	172.9	177.7	-111.2	0	0	0	113.3	S272 F282 S295 A297 R319 H322 V334 L355 F357	S272-F284 PolarHBondContact N-O 3.27Å; S272-F284 PolarHBondContact O-N 2.95Å; S272-F284 VanDerWaalsContact O-N 3.08Å; S272-F284 PolarHBondContact OG-O 2.93Å; F282-F284 HydrophobicContact CD1-CB 4.48Å; F282-F284 HydrophobicContact CE1-CB 3.77Å; F282-F284 HydrophobicContact CZ-CB 4.38Å; F284-S295 VanDerWaalsContact CE2-O 3.31Å; F284-S295 WeakPolarHBondContact CE2-O 3.45Å; F284-A297 HydrophobicContact CD2-CB 4.05Å; F284-R319 HydrophobicContact CE1-CB 3.9Å; F284-R319 HydrophobicContact CE1-CG 4.05Å; F284-H322 AromaticContact CD1-NE2 3.55Å; F284-H322 PolarHBondContact O-CE1 2.66Å; F284-H322 PolarHBondContact O-NE2 3.02Å; F284-V334 HydrophobicContact CD1-CG1 4.16Å; F284-V334 HydrophobicContact CD1-CG2 3.79Å; F284-V334 HydrophobicContact CE1-CG1 4.03Å; F284-V334 HydrophobicContact CE1-CG2 4.32Å; F284-L355 HydrophobicContact CE1-CD1 4.02Å; F284-L355 HydrophobicContact CZ-CD1 4Å; F284-F357 HydrophobicContact CD1-CE2 4.27Å; F284-F357 HydrophobicContact CD1-CZ 4.13Å; F284-F357 AromaticContact CD2-CE1 3.88Å; F284-F357 HydrophobicContact CD2-CE1 3.88Å; F284-F357 HydrophobicContact CD2-CE2 4.36Å; F284-F357 AromaticContact CD2-CZ 3.52Å; F284-F357 HydrophobicContact CD2-CZ 3.52Å; F284-F357 HydrophobicContact CE1-CE2 4.31Å; F284-F357 HydrophobicContact CE1-CZ 4.01Å; F284-F357 AromaticContact CE2-CE1 3.92Å; F284-F357 HydrophobicContact CE2-CE1 3.92Å; F284-F357 HydrophobicContact CE2-CE2 4.4Å; F284-F357 AromaticContact CE2-CZ 3.39Å; F284-F357 HydrophobicContact CE2-CZ 3.39Å; F284-F357 HydrophobicContact CG-CE2 4.3Å; F284-F357 AromaticContact CG-CZ 3.9Å; F284-F357 HydrophobicContact CG-CZ 3.9Å; F284-F357 HydrophobicContact CZ-CE2 4.38Å; F284-F357 AromaticContact CZ-CZ 3.66Å; F284-F357 HydrophobicContact CZ-CZ 3.66Å
285	G	98.9	Very high	98.5	Very high	0 Å²	0	39 Å²	39	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	64.3	-147.3	167.2	0	0	0	0	0	113.7	R268 H271 L294 D296	R268-G285 WeakPolarHBondContact CD-O 3.4Å; R268-G285 PolarHBondContact NH1-O 2.82Å; H271-G285 WeakPolarHBondContact CB-O 3.2Å; G285-L294 VanDerWaalsContact CA-O 3.29Å; G285-L294 WeakPolarHBondContact CA-O 3.33Å; G285-D296 PolarHBondContact N-O 3.38Å; G285-D296 VanDerWaalsContact N-O 3.09Å
286	G	98.9	Very high	98.5	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	105.7	-160.6	-176	0	0	0	0	0	113.6	S269 L294 R319	S269-G286 CarbonylContact O-C 3.48Å; S269-G286 VanDerWaalsContact O-CA 3.3Å; S269-G286 WeakPolarHBondContact O-CA 3.49Å; G286-L294 WeakPolarHBondContact O-CB 3.24Å; G286-L294 PolarHBondContact O-N 3.39Å; G286-R319 PolarHBondContact N-O 3.2Å
287	F	98.9	Very high	98.6	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	130	-172.1	-165.6	-128.7	0	0	0	109.7	R241 R268 S269 W270 K291 Q292 P293 L320 N341 L343	R241-F287 WeakPolarHBondContact CD-O 3.29Å; R268-F287 VanDerWaalsContact CA-O 3.22Å; R268-F287 WeakPolarHBondContact CA-O 3.12Å; S269-F287 PolarHBondContact N-O 3.22Å; S269-F287 PolarHBondContact O-N 3.01Å; W270-F287 HydrophobicContact CE3-CB 4.01Å; W270-F287 AromaticContact CE3-CD1 3.85Å; W270-F287 HydrophobicContact CE3-CD1 3.85Å; W270-F287 HydrophobicContact CE3-CG 4.23Å; W270-F287 AromaticContact CZ3-CD1 3.67Å; W270-F287 HydrophobicContact CZ3-CD1 3.67Å; W270-F287 HydrophobicContact CZ3-CE1 4.13Å; W270-F287 HydrophobicContact CZ3-CG 4.43Å; F287-K291 HydrophobicContact CE1-CB 4.1Å; F287-K291 HydrophobicContact CE1-CG 4.19Å; F287-K291 HydrophobicContact CE2-CB 4.07Å; F287-K291 WeakPolarHBondContact CE2-O 3.16Å; F287-K291 HydrophobicContact CZ-CB 3.45Å; F287-K291 VanDerWaalsContact CZ-CB 3.45Å; F287-K291 HydrophobicContact CZ-CG 4Å; F287-Q292 WeakPolarHBondContact CA-O 3.41Å; F287-Q292 WeakPolarHBondContact CD2-O 3.3Å; F287-P293 HydrophobicContact CE2-CG 4.49Å; F287-L320 HydrophobicContact CB-CB 4.17Å; F287-L320 HydrophobicContact CB-CD1 4.1Å; F287-L320 HydrophobicContact CB-CD2 4.48Å; F287-L320 HydrophobicContact CD2-CD1 4.19Å; F287-L320 HydrophobicContact CD2-CD2 3.95Å; F287-L320 HydrophobicContact CG-CD1 4.07Å; F287-L320 HydrophobicContact CG-CD2 4.49Å; F287-N341 HydrophobicContact CE2-CB 3.97Å; F287-N341 HydrophobicContact CZ-CB 3.91Å; F287-N341 VanDerWaalsContact CZ-CG 3.5Å; F287-N341 VanDerWaalsContact CZ-OD1 3.27Å; F287-N341 WeakPolarHBondContact CZ-OD1 3.27Å; F287-L343 HydrophobicContact CE1-CD1 4.11Å
288	T	98.9	Very high	98.7	Very high	10 Å²	10	36.3 Å²	36.3	6%	0.061	20%	0.197	C	C	.	.			trans	-84.2	166.6	-176.4	69.7	0	0	0	0	112.8	R241 V266 G267 D290 K291 Q292 L294	R241-T288 WeakPolarHBondContact CD-O 3.33Å; R241-T288 PolarHBondContact NH1-O 3.27Å; V266-T288 HydrophobicContact CG1-CG2 4Å; V266-T288 HydrophobicContact CG2-CG2 4.35Å; G267-T288 WeakPolarHBondContact O-CA 3.38Å; T288-D290 PolarHBondContact O-N 2.82Å; T288-D290 PolarHBondContact OG1-N 3.23Å; T288-K291 PolarHBondContact O-N 3.06Å; T288-K291 PolarHBondContact OG1-N 3.47Å; T288-Q292 HydrophobicContact CG2-CB 4.05Å; T288-Q292 PolarHBondContact N-O 2.93Å; T288-Q292 WeakPolarHBondContact OG1-CB 3.26Å; T288-Q292 PolarHBondContact OG1-N 3.36Å; T288-L294 HydrophobicContact CG2-CD1 3.82Å; T288-L294 HydrophobicContact CG2-CD2 3.61Å; T288-L294 HydrophobicContact CG2-CG 3.82Å
289	T	98.7	Very high	98.7	Very high	56 Å²	56	32.2 Å²	32.2	34%	0.344	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-49.2	-47.1	170.4	-60.6	0	0	0	0	111.3	D239 R241 K291	D239-T289 WeakPolarHBondContact O-CG2 3.32Å; R241-T289 PolarHBondContact N-OG1 2.87Å; R241-T289 PolarHBondContact NH1-O 3.03Å; R241-T289 PolarHBondContact O-OG1 2.83Å; T289-K291 PolarHBondContact O-N 3.43Å
290	D	98.4	Very high	98.8	Very high	133 Å²	133	30.3 Å²	30.3	71%	0.711	16%	0.157	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.5	17.7	179.9	-52.7	-46.3	0	0	0	114.2	T288 Q292	T288-D290 PolarHBondContact O-N 2.82Å; T288-D290 PolarHBondContact OG1-N 3.23Å; D290-Q292 VanDerWaalsContact C-N 3.29Å; D290-Q292 PolarHBondContact O-N 3.22Å
291	K	98.4	Very high	98.8	Very high	110 Å²	110	27.8 Å²	27.8	48%	0.478	15%	0.146	S	C	.	.			trans	62.2	32.2	173.9	-54.5	173	-165.2	-80.5	0	113.5	F287 T288 T289	F287-K291 HydrophobicContact CE1-CB 4.1Å; F287-K291 HydrophobicContact CE1-CG 4.19Å; F287-K291 HydrophobicContact CE2-CB 4.07Å; F287-K291 WeakPolarHBondContact CE2-O 3.16Å; F287-K291 HydrophobicContact CZ-CB 3.45Å; F287-K291 VanDerWaalsContact CZ-CB 3.45Å; F287-K291 HydrophobicContact CZ-CG 4Å; T288-K291 PolarHBondContact O-N 3.06Å; T288-K291 PolarHBondContact OG1-N 3.47Å; T289-K291 PolarHBondContact O-N 3.43Å
292	Q	98.6	Very high	98.8	Very high	118 Å²	118	28.8 Å²	28.8	55%	0.551	15%	0.151	S	C	*	.			trans	-88	124.4	171.9	-63.9	-62.6	-28.3	0	0	110.5	F287 T288 D290	F287-Q292 WeakPolarHBondContact CA-O 3.41Å; F287-Q292 WeakPolarHBondContact CD2-O 3.3Å; T288-Q292 HydrophobicContact CG2-CB 4.05Å; T288-Q292 PolarHBondContact N-O 2.93Å; T288-Q292 WeakPolarHBondContact OG1-CB 3.26Å; T288-Q292 PolarHBondContact OG1-N 3.36Å; D290-Q292 VanDerWaalsContact C-N 3.29Å; D290-Q292 PolarHBondContact O-N 3.22Å
293	P	98.8	Very high	98.7	Very high	35 Å²	35	33 Å²	33	23%	0.227	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.9	137.8	164.6	-16.8	31.3	0	0	0	110.3	F287 P318 L320 A339	F287-P293 HydrophobicContact CE2-CG 4.49Å; P293-P318 HydrophobicContact CB-CB 3.76Å; P293-P318 HydrophobicContact CB-CG 4.13Å; P293-L320 HydrophobicContact CB-CD2 3.95Å; P293-L320 HydrophobicContact CG-CD2 4.45Å; P293-A339 WeakPolarHBondContact CB-O 3.33Å
294	L	98.9	Very high	98.7	Very high	21 Å²	21	39 Å²	39	11%	0.11	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	141.4	-176.8	-67.2	174.1	0	0	0	111.4	V266 R268 G285 G286 T288 D296 P318 R319	V266-L294 HydrophobicContact CG1-CD1 4.04Å; V266-L294 HydrophobicContact CG1-CD2 4.01Å; R268-L294 HydrophobicContact CB-CD1 3.75Å; G285-L294 VanDerWaalsContact CA-O 3.29Å; G285-L294 WeakPolarHBondContact CA-O 3.33Å; G286-L294 WeakPolarHBondContact O-CB 3.24Å; G286-L294 PolarHBondContact O-N 3.39Å; T288-L294 HydrophobicContact CG2-CD1 3.82Å; T288-L294 HydrophobicContact CG2-CD2 3.61Å; T288-L294 HydrophobicContact CG2-CG 3.82Å; L294-D296 WeakPolarHBondContact CB-OD1 3.42Å; L294-P318 CarbonylContact O-C 3.54Å; L294-P318 WeakPolarHBondContact O-CA 3.24Å; L294-P318 VanDerWaalsContact O-CB 3.3Å; L294-P318 WeakPolarHBondContact O-CB 3.28Å; L294-R319 PolarHBondContact O-N 2.96Å
295	S	98.8	Very high	98.6	Very high	30 Å²	30	40.9 Å²	40.9	21%	0.21	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	3	173.4	57.3	0	0	0	0	112.4	F284 H312 T315	F284-S295 VanDerWaalsContact CE2-O 3.31Å; F284-S295 WeakPolarHBondContact CE2-O 3.45Å; S295-H312 PolarHBondContact O-CE1 2.96Å; S295-H312 PolarHBondContact O-NE2 2.84Å; S295-T315 WeakPolarHBondContact CB-O 3.44Å; S295-T315 PolarHBondContact OG-O 3.46Å
296	D	98.8	Very high	98.6	Very high	29 Å²	29	44.6 Å²	44.6	16%	0.155	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	144.8	178.7	63.2	-33.7	0	0	0	111.5	R268 G285 L294 W298	R268-D296 IonicContact CZ-OD1 2.76Å; R268-D296 IonicContact CZ-OD2 2.78Å; R268-D296 VanDerWaalsContact NH1-CG 3.35Å; R268-D296 IonicContact NH1-OD1 3.04Å; R268-D296 PolarHBondContact NH1-OD1 3.1Å; R268-D296 IonicContact NH1-OD2 2.77Å; R268-D296 PolarHBondContact NH1-OD2 3.41Å; R268-D296 IonicContact NH2-OD1 2.9Å; R268-D296 IonicContact NH2-OD2 2.86Å; R268-D296 PolarHBondContact NH2-OD2 3.31Å; G285-D296 PolarHBondContact N-O 3.38Å; G285-D296 VanDerWaalsContact N-O 3.09Å; L294-D296 WeakPolarHBondContact CB-OD1 3.42Å; D296-W298 PolarHBondContact OD2-NE1 3.19Å
297	A	98.9	Very high	98.6	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	145.9	174.2	0	0	0	0	0	110.6	F282 L283 F284 F310 F357	F282-A297 HydrophobicContact CE2-CB 3.95Å; F282-A297 HydrophobicContact CZ-CB 3.71Å; L283-A297 CarbonylContact O-C 3.56Å; L283-A297 VanDerWaalsContact O-CA 3.28Å; L283-A297 WeakPolarHBondContact O-CA 3.42Å; F284-A297 HydrophobicContact CD2-CB 4.05Å; A297-F310 HydrophobicContact CB-CB 3.96Å; A297-F310 HydrophobicContact CB-CD1 4.01Å; A297-F310 HydrophobicContact CB-CG 4.44Å; A297-F310 PolarHBondContact O-N 3.1Å; A297-F357 HydrophobicContact CB-CE1 4.25Å
298	W	98.9	Very high	98.6	Very high	19 Å²	19	48.4 Å²	48.4	7%	0.072	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	157.4	178.5	-58.3	75	0	0	0	111	I263 P265 F282 L283 D296 W307 I308 Q309	I263-W298 HydrophobicContact CG2-CH2 3.83Å; I263-W298 HydrophobicContact CG2-CZ3 4.31Å; P265-W298 HydrophobicContact CB-CD2 4.21Å; P265-W298 HydrophobicContact CB-CG 4.25Å; P265-W298 HydrophobicContact CG-CB 4.26Å; P265-W298 HydrophobicContact CG-CD2 3.73Å; P265-W298 HydrophobicContact CG-CE3 4.14Å; P265-W298 HydrophobicContact CG-CG 3.76Å; F282-W298 CarbonylContact C-O 3.56Å; F282-W298 WeakPolarHBondContact CA-O 3.33Å; L283-W298 HydrophobicContact CB-CB 4.21Å; L283-W298 HydrophobicContact CD2-CB 4.36Å; L283-W298 HydrophobicContact CD2-CG 4.44Å; L283-W298 PolarHBondContact N-O 2.95Å; L283-W298 PolarHBondContact O-N 2.74Å; D296-W298 PolarHBondContact OD2-NE1 3.19Å; W298-W307 HydrophobicContact CB-CE3 3.66Å; W298-W307 HydrophobicContact CB-CZ3 3.91Å; W298-W307 HydrophobicContact CE3-CB 3.97Å; W298-W307 HydrophobicContact CG-CE3 4.46Å; W298-W307 HydrophobicContact CZ3-CB 4.36Å; W298-I308 CarbonylContact C-O 3.56Å; W298-I308 WeakPolarHBondContact CA-O 3.17Å; W298-Q309 HydrophobicContact CD2-CB 4.08Å; W298-Q309 HydrophobicContact CD2-CG 4.18Å; W298-Q309 VanDerWaalsContact CE3-CA 3.49Å; W298-Q309 HydrophobicContact CE3-CB 3.78Å; W298-Q309 HydrophobicContact CE3-CG 4.38Å; W298-Q309 VanDerWaalsContact CE3-N 3.35Å; W298-Q309 HydrophobicContact CH2-CB 3.92Å; W298-Q309 HydrophobicContact CH2-CG 4.22Å; W298-Q309 HydrophobicContact CZ2-CB 4.21Å; W298-Q309 HydrophobicContact CZ2-CG 4.01Å; W298-Q309 HydrophobicContact CZ3-CB 3.72Å; W298-Q309 HydrophobicContact CZ3-CG 4.41Å
299	T	98.6	Very high	98.5	Very high	19 Å²	19	53.4 Å²	53.4	12%	0.117	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	130.7	164.6	54.2	0	0	0	0	109.1	L281 F282 W307 I308 F310	L281-T299 CarbonylContact O-C 3.6Å; L281-T299 VanDerWaalsContact O-CA 3.27Å; L281-T299 WeakPolarHBondContact O-CA 3.44Å; F282-T299 HydrophobicContact CD2-CG2 3.91Å; T299-W307 WeakPolarHBondContact O-CA 3.45Å; T299-I308 PolarHBondContact N-O 3.36Å; T299-I308 PolarHBondContact O-N 3.33Å; T299-I308 PolarHBondContact OG1-O 3.36Å; T299-F310 HydrophobicContact CG2-CD2 4.36Å
300	Y	98.8	Very high	98.5	Very high	1 Å²	1	52.8 Å²	52.8	0%	0.004	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	115.6	168.7	177.4	-109.3	0	0	0	108.6	F231 L245 L258 P260 H280 L281 I302 N305 E306 W307	F231-Y300 HydrophobicContact CE1-CE1 4.05Å; L245-Y300 HydrophobicContact CD2-CD1 4.04Å; L245-Y300 HydrophobicContact CD2-CD2 3.81Å; L245-Y300 HydrophobicContact CD2-CE1 3.75Å; L245-Y300 HydrophobicContact CD2-CE2 3.51Å; L245-Y300 HydrophobicContact CD2-CG 4.06Å; L245-Y300 VanDerWaalsContact CD2-CZ 3.47Å; L258-Y300 HydrophobicContact CD1-CE1 4.29Å; L258-Y300 WeakPolarHBondContact CD1-OH 3.48Å; P260-Y300 HydrophobicContact CB-CE2 4.26Å; P260-Y300 HydrophobicContact CG-CE2 3.94Å; H280-Y300 VanDerWaalsContact CA-O 3.31Å; H280-Y300 WeakPolarHBondContact CA-O 3.41Å; L281-Y300 HydrophobicContact CD1-CD1 4.08Å; L281-Y300 HydrophobicContact CG-CD1 4.44Å; L281-Y300 PolarHBondContact N-O 3.15Å; L281-Y300 PolarHBondContact O-N 3.27Å; Y300-I302 HydrophobicContact CD1-CG1 3.98Å; Y300-I302 HydrophobicContact CE1-CB 4.42Å; Y300-I302 HydrophobicContact CE1-CG1 3.97Å; Y300-N305 PolarHBondContact OH-OD1 2.94Å; Y300-E306 WeakPolarHBondContact CA-O 3.48Å; Y300-W307 AromaticContact CD2-CD2 3.93Å; Y300-W307 HydrophobicContact CD2-CD2 3.93Å; Y300-W307 AromaticContact CD2-CE2 3.76Å; Y300-W307 HydrophobicContact CD2-CG 4.15Å; Y300-W307 HydrophobicContact CD2-CZ2 4.24Å; Y300-W307 AromaticContact CD2-NE1 3.83Å; Y300-W307 HydrophobicContact CG-CD2 4.37Å; Y300-W307 HydrophobicContact CG-CH2 4.48Å; Y300-W307 HydrophobicContact CG-CZ2 4.28Å
301	C	98.4	Very high	98.5	Very high	3 Å²	3	53.4 Å²	53.4	2%	0.02	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	112.7	174.4	-178.7	0	0	0	0	109	D279 S303 K304 N305 E306	D279-C301 CarbonylContact O-C 3.57Å; D279-C301 WeakPolarHBondContact O-CA 3.48Å; D279-C301 PolarHBondContact OD2-SG 3.13Å; C301-S303 PolarHBondContact SG-OG 2.99Å; C301-K304 HydrophobicContact CB-CB 4.17Å; C301-K304 PolarHBondContact O-N 2.8Å; C301-N305 WeakPolarHBondContact O-CA 3.31Å; C301-N305 PolarHBondContact O-N 3.2Å; C301-E306 PolarHBondContact N-O 3.43Å; C301-E306 PolarHBondContact O-N 3.13Å
302	I	98.6	Very high	98.4	Very high	21 Å²	21	49.5 Å²	49.5	11%	0.108	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-45.7	-172.1	-60.7	169.8	0	0	0	110.4	V226 F231 D279 L281 Y300 K304 N305	V226-I302 HydrophobicContact CB-CD1 4.04Å; V226-I302 HydrophobicContact CG1-CD1 3.98Å; V226-I302 HydrophobicContact CG2-CD1 3.94Å; F231-I302 HydrophobicContact CE1-CG1 4.5Å; F231-I302 HydrophobicContact CE2-CD1 3.99Å; F231-I302 HydrophobicContact CZ-CD1 3.83Å; F231-I302 HydrophobicContact CZ-CG1 3.99Å; F231-I302 HydrophobicContact CZ-CG2 4Å; D279-I302 PolarHBondContact O-N 3.41Å; D279-I302 WeakPolarHBondContact OD1-CB 3.34Å; L281-I302 HydrophobicContact CD2-CD1 4.46Å; L281-I302 HydrophobicContact CG-CD1 4.31Å; Y300-I302 HydrophobicContact CD1-CG1 3.98Å; Y300-I302 HydrophobicContact CE1-CB 4.42Å; Y300-I302 HydrophobicContact CE1-CG1 3.97Å; I302-K304 VanDerWaalsContact C-N 3.3Å; I302-K304 PolarHBondContact O-N 3.35Å; I302-N305 PolarHBondContact O-N 2.93Å
303	S	97.9	Very high	98.3	Very high	87 Å²	87	49.2 Å²	49.2	61%	0.608	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-35.8	-179.4	61.4	0	0	0	0	113	D279 C301	D279-S303 WeakPolarHBondContact OD1-CA 3.47Å; D279-S303 WeakPolarHBondContact OD1-CB 3.46Å; D279-S303 PolarHBondContact OD1-N 3.02Å; D279-S303 PolarHBondContact OD1-OG 2.91Å; D279-S303 WeakPolarHBondContact OD2-CB 3.33Å; D279-S303 PolarHBondContact OD2-OG 2.94Å; C301-S303 PolarHBondContact SG-OG 2.99Å
304	K	98	Very high	98.3	Very high	127 Å²	127	49.8 Å²	49.8	55%	0.552	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.2	-15.3	178.7	-64.8	-178.1	-179.8	-179.2	0	113.8	C301 I302 E306	C301-K304 HydrophobicContact CB-CB 4.17Å; C301-K304 PolarHBondContact O-N 2.8Å; I302-K304 VanDerWaalsContact C-N 3.3Å; I302-K304 PolarHBondContact O-N 3.35Å; K304-E306 VanDerWaalsContact C-N 3.31Å; K304-E306 HydrophobicContact CB-CB 3.99Å; K304-E306 PolarHBondContact O-N 3.44Å
305	N	98.4	Very high	98.3	Very high	39 Å²	39	52.7 Å²	52.7	21%	0.209	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	48.8	55	-169.3	-178.6	35.6	0	0	0	111.1	I259 P260 Q261 Y300 C301 I302	I259-N305 PolarHBondContact O-ND2 2.85Å; P260-N305 WeakPolarHBondContact CA-O 3.26Å; P260-N305 WeakPolarHBondContact CA-OD1 3.24Å; P260-N305 WeakPolarHBondContact CB-O 3.37Å; Q261-N305 PolarHBondContact N-O 2.97Å; Q261-N305 VanDerWaalsContact N-O 3.1Å; Y300-N305 PolarHBondContact OH-OD1 2.94Å; C301-N305 WeakPolarHBondContact O-CA 3.31Å; C301-N305 PolarHBondContact O-N 3.2Å; I302-N305 PolarHBondContact O-N 2.93Å
306	E	98.5	Very high	98.2	Very high	79 Å²	79	59.3 Å²	59.3	37%	0.369	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	141.4	-172.3	-174.3	-178	179.6	0	0	110.6	Y300 C301 K304	Y300-E306 WeakPolarHBondContact CA-O 3.48Å; C301-E306 PolarHBondContact N-O 3.43Å; C301-E306 PolarHBondContact O-N 3.13Å; K304-E306 VanDerWaalsContact C-N 3.31Å; K304-E306 HydrophobicContact CB-CB 3.99Å; K304-E306 PolarHBondContact O-N 3.44Å
307	W	98.8	Very high	98.2	Very high	11 Å²	11	61.7 Å²	61.7	4%	0.042	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	132.4	170.6	-74.8	104.2	0	0	0	110.8	F233 L245 P265 L273 L283 W298 T299 Y300	F233-W307 AromaticContact CD2-CZ2 3.9Å; F233-W307 HydrophobicContact CD2-CZ2 3.9Å; F233-W307 AromaticContact CE2-CZ2 3.84Å; F233-W307 HydrophobicContact CE2-CZ2 3.84Å; F233-W307 HydrophobicContact CG-CZ2 4.34Å; F233-W307 HydrophobicContact CZ-CZ2 4.26Å; L245-W307 HydrophobicContact CD2-CZ2 4.17Å; P265-W307 VanDerWaalsContact CD-CG 3.43Å; P265-W307 HydrophobicContact CG-CD2 3.61Å; P265-W307 HydrophobicContact CG-CE3 3.73Å; P265-W307 HydrophobicContact CG-CG 4Å; P265-W307 HydrophobicContact CG-CH2 4.39Å; P265-W307 HydrophobicContact CG-CZ2 4.3Å; P265-W307 HydrophobicContact CG-CZ3 4.12Å; L273-W307 HydrophobicContact CD1-CH2 4.12Å; L283-W307 HydrophobicContact CB-CH2 4.02Å; L283-W307 HydrophobicContact CB-CZ3 3.67Å; L283-W307 HydrophobicContact CD2-CH2 3.85Å; L283-W307 HydrophobicContact CD2-CZ3 3.82Å; L283-W307 HydrophobicContact CG-CH2 4.48Å; L283-W307 HydrophobicContact CG-CZ3 4.38Å; W298-W307 HydrophobicContact CB-CE3 3.66Å; W298-W307 HydrophobicContact CB-CZ3 3.91Å; W298-W307 HydrophobicContact CE3-CB 3.97Å; W298-W307 HydrophobicContact CG-CE3 4.46Å; W298-W307 HydrophobicContact CZ3-CB 4.36Å; T299-W307 WeakPolarHBondContact O-CA 3.45Å; Y300-W307 AromaticContact CD2-CD2 3.93Å; Y300-W307 HydrophobicContact CD2-CD2 3.93Å; Y300-W307 AromaticContact CD2-CE2 3.76Å; Y300-W307 HydrophobicContact CD2-CG 4.15Å; Y300-W307 HydrophobicContact CD2-CZ2 4.24Å; Y300-W307 AromaticContact CD2-NE1 3.83Å; Y300-W307 HydrophobicContact CG-CD2 4.37Å; Y300-W307 HydrophobicContact CG-CH2 4.48Å; Y300-W307 HydrophobicContact CG-CZ2 4.28Å
308	I	97.9	Very high	98.2	Very high	69 Å²	69	62.9 Å²	62.9	35%	0.354	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	117.8	177.7	-55.2	168.1	0	0	0	107.6	W298 T299 F310	W298-I308 CarbonylContact C-O 3.56Å; W298-I308 WeakPolarHBondContact CA-O 3.17Å; T299-I308 PolarHBondContact N-O 3.36Å; T299-I308 PolarHBondContact O-N 3.33Å; T299-I308 PolarHBondContact OG1-O 3.36Å; I308-F310 PolarHBondContact O-N 2.84Å
309	Q	98.1	Very high	98.2	Very high	114 Å²	114	62.3 Å²	62.3	53%	0.533	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.7	132.5	176.4	-165.5	173.9	3.8	0	0	109.7	W298	W298-Q309 HydrophobicContact CD2-CB 4.08Å; W298-Q309 HydrophobicContact CD2-CG 4.18Å; W298-Q309 VanDerWaalsContact CE3-CA 3.49Å; W298-Q309 HydrophobicContact CE3-CB 3.78Å; W298-Q309 HydrophobicContact CE3-CG 4.38Å; W298-Q309 VanDerWaalsContact CE3-N 3.35Å; W298-Q309 HydrophobicContact CH2-CB 3.92Å; W298-Q309 HydrophobicContact CH2-CG 4.22Å; W298-Q309 HydrophobicContact CZ2-CB 4.21Å; W298-Q309 HydrophobicContact CZ2-CG 4.01Å; W298-Q309 HydrophobicContact CZ3-CB 3.72Å; W298-Q309 HydrophobicContact CZ3-CG 4.41Å
310	F	97.9	Very high	98.2	Very high	44 Å²	44	61.4 Å²	61.4	19%	0.193	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	125.6	-177	-177.1	-90.6	0	0	0	109.5	F282 A297 T299 I308 H312 F357 S358 V359	F282-F310 HydrophobicContact CE2-CB 4.21Å; F282-F310 AromaticContact CE2-CD1 3.76Å; F282-F310 HydrophobicContact CE2-CD1 3.76Å; F282-F310 HydrophobicContact CE2-CD2 4.4Å; F282-F310 HydrophobicContact CE2-CE1 4.21Å; F282-F310 AromaticContact CE2-CG 3.86Å; F282-F310 HydrophobicContact CE2-CG 3.86Å; F282-F310 HydrophobicContact CZ-CD1 4.34Å; A297-F310 HydrophobicContact CB-CB 3.96Å; A297-F310 HydrophobicContact CB-CD1 4.01Å; A297-F310 HydrophobicContact CB-CG 4.44Å; A297-F310 PolarHBondContact O-N 3.1Å; T299-F310 HydrophobicContact CG2-CD2 4.36Å; I308-F310 PolarHBondContact O-N 2.84Å; F310-H312 HydrophobicContact CD1-CB 4.11Å; F310-H312 HydrophobicContact CE1-CB 3.99Å; F310-H312 PolarHBondContact O-CD2 3.09Å; F310-F357 HydrophobicContact CD1-CD1 4.38Å; F310-F357 HydrophobicContact CE1-CB 4.43Å; F310-F357 HydrophobicContact CE1-CD1 4.11Å; F310-S358 WeakPolarHBondContact CZ-O 3.27Å; F310-V359 HydrophobicContact CE2-CG1 4.19Å; F310-V359 HydrophobicContact CZ-CG1 4.23Å
311	N	97.7	Very high	98.2	Very high	145 Å²	145	63 Å²	63	78%	0.775	32%	0.322	S	S	*	.	P	Polyproline II helix	trans	-83.5	136.1	177.2	-68.6	-34	0	0	0	110.7
312	H	97.7	Very high	98.3	Very high	29 Å²	29	63.5 Å²	63.5	13%	0.134	32%	0.324	C	S	.	.			trans	-154.8	162.5	-177.7	64.8	93.8	0	0	0	111.2	S295 F310 Y314 F357	S295-H312 PolarHBondContact O-CE1 2.96Å; S295-H312 PolarHBondContact O-NE2 2.84Å; F310-H312 HydrophobicContact CD1-CB 4.11Å; F310-H312 HydrophobicContact CE1-CB 3.99Å; F310-H312 PolarHBondContact O-CD2 3.09Å; H312-Y314 HydrophobicContact CB-CD2 4.44Å; H312-Y314 VanDerWaalsContact CE1-C 3.45Å; H312-Y314 WeakPolarHBondContact ND1-CA 3.41Å; H312-Y314 WeakPolarHBondContact ND1-CB 3.49Å; H312-Y314 AromaticContact ND1-CD2 3.84Å; H312-Y314 PolarHBondContact ND1-N 3.26Å; H312-Y314 PolarHBondContact O-N 3.03Å; H312-F357 HydrophobicContact CB-CD1 3.8Å; H312-F357 HydrophobicContact CB-CE1 3.78Å; H312-F357 AromaticContact CG-CE1 3.49Å; H312-F357 VanDerWaalsContact CG-CE1 3.49Å; H312-F357 AromaticContact ND1-CE1 3.51Å
313	P	97.3	Very high	98.3	Very high	111 Å²	111	63.3 Å²	63.3	72%	0.721	32%	0.324	S	S	*	.	S	Bend	trans	-83.5	10.6	-176.5	34.3	-37.4	0	0	0	114.5
314	Y	98.2	Very high	98.3	Very high	47 Å²	47	60.1 Å²	60.1	18%	0.184	30%	0.303	C	S	.	.			trans	-111	25.8	-170.2	-48	-62.5	0	0	0	113.4	H312 E316 K317 L355 I356 F357	H312-Y314 HydrophobicContact CB-CD2 4.44Å; H312-Y314 VanDerWaalsContact CE1-C 3.45Å; H312-Y314 WeakPolarHBondContact ND1-CA 3.41Å; H312-Y314 WeakPolarHBondContact ND1-CB 3.49Å; H312-Y314 AromaticContact ND1-CD2 3.84Å; H312-Y314 PolarHBondContact ND1-N 3.26Å; H312-Y314 PolarHBondContact O-N 3.03Å; Y314-E316 PolarHBondContact O-N 2.79Å; Y314-K317 HydrophobicContact CD1-CD 4.25Å; Y314-K317 PolarHBondContact O-N 2.93Å; Y314-L355 HydrophobicContact CD1-CD2 3.98Å; Y314-L355 HydrophobicContact CD2-CB 4.13Å; Y314-L355 HydrophobicContact CE1-CB 4.5Å; Y314-L355 HydrophobicContact CE1-CD2 4.17Å; Y314-L355 HydrophobicContact CE2-CB 4.05Å; Y314-L355 HydrophobicContact CG-CB 4.38Å; Y314-L355 HydrophobicContact CG-CD2 4.34Å; Y314-I356 VanDerWaalsContact CE2-O 3.32Å; Y314-I356 WeakPolarHBondContact CE2-O 3.28Å; Y314-I356 PolarHBondContact OH-N 2.82Å; Y314-I356 PolarHBondContact OH-O 2.84Å; Y314-F357 HydrophobicContact CD2-CD1 4.17Å; Y314-F357 AromaticContact CD2-CE1 3.66Å; Y314-F357 HydrophobicContact CD2-CE1 3.66Å; Y314-F357 HydrophobicContact CD2-CE2 4.04Å; Y314-F357 AromaticContact CD2-CZ 3.56Å; Y314-F357 HydrophobicContact CD2-CZ 3.56Å; Y314-F357 HydrophobicContact CE2-CD1 4.44Å; Y314-F357 HydrophobicContact CE2-CD2 4.47Å; Y314-F357 HydrophobicContact CE2-CE1 4.34Å; Y314-F357 HydrophobicContact CE2-CE2 4.31Å; Y314-F357 HydrophobicContact CE2-CZ 4.24Å; Y314-F357 HydrophobicContact CG-CZ 4.43Å
315	T	97.6	Very high	98.4	Very high	82 Å²	82	54.5 Å²	54.5	50%	0.503	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-31.3	-178.3	53.5	0	0	0	0	112.8	S295 K317	S295-T315 WeakPolarHBondContact CB-O 3.44Å; S295-T315 PolarHBondContact OG-O 3.46Å; T315-K317 VanDerWaalsContact C-N 3.29Å; T315-K317 PolarHBondContact O-N 2.99Å
316	E	98.3	Very high	98.3	Very high	170 Å²	170	54.2 Å²	54.2	79%	0.794	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.6	4.5	176.1	-59.3	-56.3	130.7	0	0	113.4	Y314 P318	Y314-E316 PolarHBondContact O-N 2.79Å; E316-P318 VanDerWaalsContact O-CD 3.26Å; E316-P318 WeakPolarHBondContact O-CD 3.34Å
317	K	98.5	Very high	98.2	Very high	78 Å²	78	51 Å²	51	34%	0.339	27%	0.269	S	S	.	.			trans	-119.2	64.4	-178.8	-61.7	-169.7	178.1	-167.4	0	111.2	Y314 T315 E353 L355	Y314-K317 HydrophobicContact CD1-CD 4.25Å; Y314-K317 PolarHBondContact O-N 2.93Å; T315-K317 VanDerWaalsContact C-N 3.29Å; T315-K317 PolarHBondContact O-N 2.99Å; K317-E353 WeakPolarHBondContact CD-OE2 3.17Å; K317-E353 WeakPolarHBondContact CE-OE2 3.49Å; K317-E353 IonicContact NZ-OE2 2.98Å; K317-E353 PolarHBondContact NZ-OE2 2.98Å; K317-L355 HydrophobicContact CB-CD1 4.36Å; K317-L355 HydrophobicContact CD-CD2 3.66Å
318	P	98.8	Very high	97.8	Very high	26 Å²	26	55.9 Å²	55.9	17%	0.169	30%	0.296	C	S	.	.			trans	-58.6	149.6	173.5	27.6	-35.6	0	0	0	110.7	P293 L294 E316 A339	P293-P318 HydrophobicContact CB-CB 3.76Å; P293-P318 HydrophobicContact CB-CG 4.13Å; L294-P318 CarbonylContact O-C 3.54Å; L294-P318 WeakPolarHBondContact O-CA 3.24Å; L294-P318 VanDerWaalsContact O-CB 3.3Å; L294-P318 WeakPolarHBondContact O-CB 3.28Å; E316-P318 VanDerWaalsContact O-CD 3.26Å; E316-P318 WeakPolarHBondContact O-CD 3.34Å; P318-A339 VanDerWaalsContact CG-O 3.3Å; P318-A339 WeakPolarHBondContact CG-O 3.47Å; P318-A339 WeakPolarHBondContact O-CA 3.23Å
319	R	98.8	Very high	97.3	Very high	6 Å²	6	55.2 Å²	55.2	2%	0.023	29%	0.291	C	S	.	.			trans	-142.3	135.4	176.8	-67.3	-61.9	-174.9	-89.9	3.9	110.2	F284 G286 L294 H322 G336 C338 S351 E353 L355	F284-R319 HydrophobicContact CE1-CB 3.9Å; F284-R319 HydrophobicContact CE1-CG 4.05Å; G286-R319 PolarHBondContact N-O 3.2Å; L294-R319 PolarHBondContact O-N 2.96Å; R319-H322 HydrophobicContact CB-CB 4.07Å; R319-H322 VanDerWaalsContact CB-ND1 3.35Å; R319-H322 WeakPolarHBondContact CB-ND1 3.24Å; R319-H322 PolarHBondContact O-CE1 3.25Å; R319-H322 PolarHBondContact O-ND1 3.32Å; R319-G336 VanDerWaalsContact CD-O 3.25Å; R319-G336 WeakPolarHBondContact CD-O 3.37Å; R319-G336 PolarHBondContact NE-O 3.35Å; R319-C338 WeakPolarHBondContact CA-O 3.42Å; R319-S351 PolarHBondContact NH2-OG 3.27Å; R319-E353 IonicContact NH2-OE1 3.17Å; R319-E353 PolarHBondContact NH2-OE1 3.49Å; R319-E353 IonicContact NH2-OE2 2.79Å; R319-E353 PolarHBondContact NH2-OE2 2.79Å; R319-L355 HydrophobicContact CG-CD1 4.06Å
320	L	98.9	Very high	96.9	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	27%	0.27	C	S	.	.	B	Isolated β-bridge	trans	-130.6	146.3	163.4	57.2	136.1	0	0	0	111	W270 F287 P293 H322 G337 C338 N340 L342	W270-L320 HydrophobicContact CB-CB 4.02Å; W270-L320 HydrophobicContact CD2-CD1 4.39Å; W270-L320 HydrophobicContact CE3-CD1 3.61Å; W270-L320 HydrophobicContact CZ3-CD1 4.03Å; W270-L320 WeakPolarHBondContact O-CA 3.32Å; F287-L320 HydrophobicContact CB-CB 4.17Å; F287-L320 HydrophobicContact CB-CD1 4.1Å; F287-L320 HydrophobicContact CB-CD2 4.48Å; F287-L320 HydrophobicContact CD2-CD1 4.19Å; F287-L320 HydrophobicContact CD2-CD2 3.95Å; F287-L320 HydrophobicContact CG-CD1 4.07Å; F287-L320 HydrophobicContact CG-CD2 4.49Å; P293-L320 HydrophobicContact CB-CD2 3.95Å; P293-L320 HydrophobicContact CG-CD2 4.45Å; L320-H322 PolarHBondContact O-N 2.73Å; L320-G337 CarbonylContact O-C 3.55Å; L320-G337 WeakPolarHBondContact O-CA 3.45Å; L320-C338 WeakPolarHBondContact CD2-O 3.22Å; L320-C338 HydrophobicContact CG-CB 4.33Å; L320-C338 PolarHBondContact N-O 3.26Å; L320-C338 PolarHBondContact O-N 3.47Å; L320-N340 WeakPolarHBondContact CD2-O 3.42Å; L320-L342 HydrophobicContact CD1-CB 4.38Å; L320-L342 HydrophobicContact CD1-CD2 3.32Å; L320-L342 HydrophobicContact CD1-CG 3.62Å; L320-L342 HydrophobicContact CG-CD2 4.23Å
321	W	98.8	Very high	96.8	Very high	36 Å²	36	48.8 Å²	48.8	14%	0.136	26%	0.264	C	S	.	.	S	Bend	trans	58.5	28.2	-178.1	-147.9	3	0	0	0	112.4	G34 Y50 K147 W270 L342	G34-W321 PolarHBondContact N-O 3.2Å; Y50-W321 HydrophobicContact CD1-CZ3 4.47Å; Y50-W321 AromaticContact CE1-CE3 3.93Å; Y50-W321 HydrophobicContact CE1-CE3 3.93Å; Y50-W321 HydrophobicContact CE1-CH2 4.02Å; Y50-W321 AromaticContact CE1-CZ3 3.47Å; Y50-W321 HydrophobicContact CE1-CZ3 3.47Å; Y50-W321 VanDerWaalsContact CE1-CZ3 3.47Å; K147-W321 HydrophobicContact CD-CH2 4.38Å; K147-W321 HydrophobicContact CD-CZ2 4.02Å; K147-W321 HydrophobicContact CG-CZ2 3.93Å; W270-W321 HydrophobicContact CB-CB 4.09Å; W270-W321 AromaticContact CD1-CD1 3.69Å; W270-W321 AromaticContact CD1-CD2 3.76Å; W270-W321 AromaticContact CD1-CG 3.49Å; W270-W321 VanDerWaalsContact CD1-CG 3.49Å; W270-W321 HydrophobicContact CG-CB 4Å; W270-W321 HydrophobicContact CG-CG 4.14Å; W270-W321 HydrophobicContact CZ2-CE3 4.37Å; W270-W321 HydrophobicContact CZ2-CZ3 4.48Å; W270-W321 AromaticContact NE1-CD2 3.54Å; W270-W321 AromaticContact NE1-CE2 3.82Å; W270-W321 AromaticContact NE1-CE3 3.82Å; W270-W321 AromaticContact NE1-CG 3.82Å; W270-W321 PolarHBondContact O-N 2.71Å; W321-L342 HydrophobicContact CB-CD2 4.21Å; W321-L342 HydrophobicContact CE3-CD1 4.44Å; W321-L342 HydrophobicContact CE3-CD2 3.69Å; W321-L342 HydrophobicContact CZ3-CD2 4.49Å
322	H	98.9	Very high	96.8	Very high	12 Å²	12	41.9 Å²	41.9	6%	0.056	23%	0.227	C	C	.	.			trans	-76.6	175.4	162.5	60.3	-79.1	0	0	0	110.1	S272 F284 R319 L320 V334 F335	S272-H322 PolarHBondContact OG-NE2 3.09Å; F284-H322 AromaticContact CD1-NE2 3.55Å; F284-H322 PolarHBondContact O-CE1 2.66Å; F284-H322 PolarHBondContact O-NE2 3.02Å; R319-H322 HydrophobicContact CB-CB 4.07Å; R319-H322 VanDerWaalsContact CB-ND1 3.35Å; R319-H322 WeakPolarHBondContact CB-ND1 3.24Å; R319-H322 PolarHBondContact O-CE1 3.25Å; R319-H322 PolarHBondContact O-ND1 3.32Å; L320-H322 PolarHBondContact O-N 2.73Å; H322-V334 HydrophobicContact CB-CG1 4.08Å; H322-F335 WeakPolarHBondContact CB-O 3.42Å
323	T	98.9	Very high	96.9	Very high	17 Å²	17	40.5 Å²	40.5	10%	0.104	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	160.1	170.3	56.7	0	0	0	0	110	H35 A37 V334 F335	H35-T323 VanDerWaalsContact CD2-CG2 3.48Å; H35-T323 WeakPolarHBondContact CD2-CG2 3.47Å; H35-T323 VanDerWaalsContact NE2-CG2 3.31Å; H35-T323 WeakPolarHBondContact NE2-CG2 3.26Å; H35-T323 PolarHBondContact NE2-OG1 2.83Å; H35-T323 VanDerWaalsContact O-CG2 3.3Å; H35-T323 WeakPolarHBondContact O-CG2 3.4Å; A37-T323 VanDerWaalsContact CB-CB 3.46Å; A37-T323 HydrophobicContact CB-CG2 3.87Å; A37-T323 WeakPolarHBondContact CB-OG1 3.42Å; T323-V334 VanDerWaalsContact O-CA 3.26Å; T323-V334 WeakPolarHBondContact O-CA 3.35Å; T323-F335 PolarHBondContact N-O 3.32Å; T323-F335 VanDerWaalsContact N-O 3.08Å; T323-F335 PolarHBondContact O-N 2.86Å; T323-F335 PolarHBondContact OG1-O 3.37Å
324	A	98.9	Very high	96.9	Very high	20 Å²	20	35.2 Å²	35.2	17%	0.165	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	137.4	174.6	0	0	0	0	0	109.5	T274 V332 I333 V334	T274-A324 WeakPolarHBondContact OG1-CB 3.43Å; A324-V332 HydrophobicContact CB-CG1 3.86Å; A324-I333 VanDerWaalsContact CA-O 3.31Å; A324-I333 WeakPolarHBondContact CA-O 3.17Å; A324-V334 HydrophobicContact CB-CG2 4.02Å
325	C	98.8	Very high	97	Very high	9 Å²	9	33 Å²	33	6%	0.061	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	136.1	175.6	-74.2	0	0	0	0	109.8	M44 M73 I333	M44-C325 HydrophobicContact CG-CB 4.22Å; M44-C325 HydrophobicContact SD-CB 3.95Å; M73-C325 HydrophobicContact CE-CB 3.49Å; M73-C325 VanDerWaalsContact CE-CB 3.49Å; C325-I333 PolarHBondContact N-O 2.91Å; C325-I333 PolarHBondContact O-N 2.98Å
326	A	97.9	Very high	97	Very high	34 Å²	34	29 Å²	29	28%	0.281	15%	0.153	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	143.6	171	0	0	0	0	0	110.4	T274 E331	T274-A326 HydrophobicContact CG2-CB 3.95Å; A326-E331 CarbonylContact C-O 3.56Å; A326-E331 WeakPolarHBondContact CA-O 3.44Å
327	S	95.8	Very high	97	Very high	11 Å²	11	21 Å²	21	8%	0.077	12%	0.115	C	C	.	.			trans	-99.5	157.5	167.2	79	0	0	0	0	111	G41 M73 E329 G330 E331	G41-S327 CarbonylContact O-C 3.56Å; G41-S327 VanDerWaalsContact O-CA 3.27Å; G41-S327 WeakPolarHBondContact O-CA 3.33Å; M73-S327 VanDerWaalsContact SD-CB 3.57Å; S327-E329 PolarHBondContact O-N 2.73Å; S327-E329 PolarHBondContact OG-N 3.17Å; S327-G330 PolarHBondContact O-N 3.4Å; S327-G330 VanDerWaalsContact O-N 3.15Å; S327-E331 PolarHBondContact N-O 3.49Å; S327-E331 WeakPolarHBondContact OG-CB 3.41Å; S327-E331 PolarHBondContact OG-N 2.99Å; S327-E331 VanDerWaalsContact OG-N 3.14Å
328	D	91.3	Very high	97	Very high	114 Å²	114	17.2 Å²	17.2	61%	0.61	10%	0.099	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-19.7	174.3	-69.8	-24.7	0	0	0	112.9	G41 G330	G41-D328 WeakPolarHBondContact CA-OD1 3.37Å; G41-D328 PolarHBondContact O-N 3.07Å; D328-G330 VanDerWaalsContact C-N 3.28Å; D328-G330 PolarHBondContact O-N 2.86Å
329	E	86.5	Confident	97	Very high	54 Å²	54	17.4 Å²	17.4	25%	0.252	10%	0.103	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.7	10.3	179.3	-65.1	-68.2	160.7	0	0	113	S327 S363 R366	S327-E329 PolarHBondContact O-N 2.73Å; S327-E329 PolarHBondContact OG-N 3.17Å; E329-S363 PolarHBondContact OE2-OG 2.9Å; E329-S363 VanDerWaalsContact OE2-OG 3.08Å; E329-R366 WeakPolarHBondContact OE2-CB 3.49Å
330	G	89.4	Confident	96.9	Very high	8 Å²	8	19.6 Å²	19.6	8%	0.082	12%	0.115	C	C	.	.	S	Bend	trans	74.8	32	177.3	0	0	0	0	0	113.5	S327 D328 V359 Q360	S327-G330 PolarHBondContact O-N 3.4Å; S327-G330 VanDerWaalsContact O-N 3.15Å; D328-G330 VanDerWaalsContact C-N 3.28Å; D328-G330 PolarHBondContact O-N 2.86Å; G330-V359 WeakPolarHBondContact O-CG2 3.39Å; G330-V359 PolarHBondContact O-N 3.29Å; G330-V359 VanDerWaalsContact O-N 3.11Å; G330-Q360 PolarHBondContact O-N 3.14Å; G330-Q360 VanDerWaalsContact O-N 3.15Å
331	E	95.6	Very high	96.8	Very high	15 Å²	15	21.2 Å²	21.2	7%	0.07	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	155.4	171.7	-56.7	169.9	138.4	0	0	110.4	A326 S327 I333 I356 F357	A326-E331 CarbonylContact C-O 3.56Å; A326-E331 WeakPolarHBondContact CA-O 3.44Å; S327-E331 PolarHBondContact N-O 3.49Å; S327-E331 WeakPolarHBondContact OG-CB 3.41Å; S327-E331 PolarHBondContact OG-N 2.99Å; S327-E331 VanDerWaalsContact OG-N 3.14Å; E331-I333 HydrophobicContact CB-CD1 4.16Å; E331-I356 HydrophobicContact CB-CG2 4.05Å; E331-I356 HydrophobicContact CG-CG2 4.16Å; E331-F357 CarbonylContact C-O 3.54Å; E331-F357 VanDerWaalsContact CA-O 3.25Å; E331-F357 WeakPolarHBondContact CA-O 3.48Å
332	V	98.6	Very high	96.6	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	119.8	165.6	-179.6	0	0	0	0	108.3	T274 V276 F282 A324 V334 F357 V359	T274-V332 HydrophobicContact CG2-CG1 4.45Å; T274-V332 HydrophobicContact CG2-CG2 4.47Å; V276-V332 HydrophobicContact CG1-CG2 3.38Å; F282-V332 HydrophobicContact CB-CG2 4.16Å; F282-V332 HydrophobicContact CD1-CB 4.02Å; F282-V332 HydrophobicContact CD1-CG1 3.89Å; F282-V332 HydrophobicContact CD1-CG2 3.82Å; F282-V332 HydrophobicContact CE1-CB 4.21Å; F282-V332 HydrophobicContact CE1-CG1 4.14Å; F282-V332 HydrophobicContact CE1-CG2 4.43Å; F282-V332 HydrophobicContact CG-CG2 4.04Å; A324-V332 HydrophobicContact CB-CG1 3.86Å; V332-V334 HydrophobicContact CG1-CG2 4.42Å; V332-F357 HydrophobicContact CB-CB 4.33Å; V332-F357 PolarHBondContact N-O 3.16Å; V332-F357 PolarHBondContact O-N 2.84Å; V332-V359 HydrophobicContact CG2-CG1 4.19Å; V332-V359 HydrophobicContact CG2-CG2 4.14Å
333	I	98.6	Very high	96.3	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	109.2	179.3	-48.5	-55.9	0	0	0	108	M44 Y71 M73 A324 C325 E331 I354 I356	M44-I333 HydrophobicContact CE-CG2 4Å; M44-I333 HydrophobicContact SD-CG2 4.26Å; Y71-I333 HydrophobicContact CD1-CG2 4.26Å; Y71-I333 HydrophobicContact CE1-CG2 3.85Å; M73-I333 HydrophobicContact CE-CB 4.18Å; M73-I333 HydrophobicContact CE-CG1 3.91Å; M73-I333 HydrophobicContact CG-CG1 4.01Å; M73-I333 HydrophobicContact SD-CG1 3.83Å; A324-I333 VanDerWaalsContact CA-O 3.31Å; A324-I333 WeakPolarHBondContact CA-O 3.17Å; C325-I333 PolarHBondContact N-O 2.91Å; C325-I333 PolarHBondContact O-N 2.98Å; E331-I333 HydrophobicContact CB-CD1 4.16Å; I333-I354 HydrophobicContact CG2-CD1 3.7Å; I333-I354 HydrophobicContact CG2-CG2 3.87Å; I333-I356 HydrophobicContact CD1-CB 4.33Å; I333-I356 HydrophobicContact CD1-CD1 4.24Å; I333-I356 HydrophobicContact CD1-CG1 3.89Å; I333-I356 HydrophobicContact CD1-CG2 3.89Å
334	V	98.9	Very high	95.9	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	131.9	174	167.6	0	0	0	0	109.4	F284 H322 T323 A324 V332 I354 L355 F357	F284-V334 HydrophobicContact CD1-CG1 4.16Å; F284-V334 HydrophobicContact CD1-CG2 3.79Å; F284-V334 HydrophobicContact CE1-CG1 4.03Å; F284-V334 HydrophobicContact CE1-CG2 4.32Å; H322-V334 HydrophobicContact CB-CG1 4.08Å; T323-V334 VanDerWaalsContact O-CA 3.26Å; T323-V334 WeakPolarHBondContact O-CA 3.35Å; A324-V334 HydrophobicContact CB-CG2 4.02Å; V332-V334 HydrophobicContact CG1-CG2 4.42Å; V334-I354 CarbonylContact O-C 3.49Å; V334-I354 WeakPolarHBondContact O-CA 3.48Å; V334-L355 HydrophobicContact CB-CB 4.14Å; V334-L355 HydrophobicContact CG1-CD1 4.26Å; V334-L355 PolarHBondContact N-O 3.08Å; V334-L355 PolarHBondContact O-N 2.92Å; V334-F357 HydrophobicContact CB-CE2 4.18Å; V334-F357 HydrophobicContact CG2-CD2 4.12Å; V334-F357 HydrophobicContact CG2-CE2 3.72Å
335	F	98.9	Very high	95.2	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	140.1	178	179.4	-111.4	0	0	0	112.9	P29 R32 H35 M44 V46 W78 H322 T323 N352 I354	P29-F335 HydrophobicContact CB-CZ 3.88Å; P29-F335 HydrophobicContact CG-CE1 4.46Å; P29-F335 HydrophobicContact CG-CE2 3.7Å; P29-F335 HydrophobicContact CG-CZ 3.41Å; P29-F335 VanDerWaalsContact CG-CZ 3.41Å; R32-F335 HydrophobicContact CG-CE1 4.05Å; H35-F335 AromaticContact CD2-CD1 3.92Å; H35-F335 AromaticContact CE1-CD1 4Å; H35-F335 PolarHBondContact CE1-O 3.39Å; H35-F335 AromaticContact NE2-CD1 3.34Å; H35-F335 VanDerWaalsContact NE2-CD1 3.34Å; H35-F335 WeakPolarHBondContact NE2-CD1 3.4Å; H35-F335 AromaticContact NE2-CE1 3.98Å; H35-F335 PolarHBondContact NE2-O 2.89Å; M44-F335 HydrophobicContact CE-CB 3.81Å; M44-F335 HydrophobicContact CE-CG 4.32Å; V46-F335 HydrophobicContact CB-CE1 4.48Å; V46-F335 HydrophobicContact CG1-CD1 3.89Å; V46-F335 HydrophobicContact CG1-CE1 3.65Å; V46-F335 HydrophobicContact CG2-CD1 3.98Å; V46-F335 HydrophobicContact CG2-CE1 4.35Å; W78-F335 HydrophobicContact CH2-CD1 4.07Å; W78-F335 AromaticContact CH2-CD2 3.77Å; W78-F335 HydrophobicContact CH2-CD2 3.77Å; W78-F335 HydrophobicContact CH2-CE1 4.03Å; W78-F335 AromaticContact CH2-CE2 3.67Å; W78-F335 HydrophobicContact CH2-CE2 3.67Å; W78-F335 AromaticContact CH2-CG 3.97Å; W78-F335 HydrophobicContact CH2-CG 3.97Å; W78-F335 AromaticContact CH2-CZ 3.84Å; W78-F335 HydrophobicContact CH2-CZ 3.84Å; W78-F335 AromaticContact CZ2-CD2 3.53Å; W78-F335 HydrophobicContact CZ2-CD2 3.53Å; W78-F335 AromaticContact CZ2-CE2 3.39Å; W78-F335 HydrophobicContact CZ2-CE2 3.39Å; W78-F335 HydrophobicContact CZ2-CG 4.17Å; W78-F335 AromaticContact CZ2-CZ 3.99Å; W78-F335 HydrophobicContact CZ2-CZ 3.99Å; H322-F335 WeakPolarHBondContact CB-O 3.42Å; T323-F335 PolarHBondContact N-O 3.32Å; T323-F335 VanDerWaalsContact N-O 3.08Å; T323-F335 PolarHBondContact O-N 2.86Å; T323-F335 PolarHBondContact OG1-O 3.37Å; F335-N352 HydrophobicContact CE2-CB 4.25Å; F335-N352 VanDerWaalsContact CE2-O 3.25Å; F335-N352 WeakPolarHBondContact CE2-O 3.36Å; F335-N352 HydrophobicContact CZ-CB 4.42Å; F335-I354 HydrophobicContact CB-CD1 3.76Å; F335-I354 HydrophobicContact CD2-CD1 3.6Å; F335-I354 HydrophobicContact CD2-CG1 4.02Å; F335-I354 HydrophobicContact CG-CD1 4.03Å
336	G	98.7	Very high	94.5	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	18%	0.179	C	C	.	.			trans	64.7	-141.3	170.5	0	0	0	0	0	113.9	R319 S351 E353	R319-G336 VanDerWaalsContact CD-O 3.25Å; R319-G336 WeakPolarHBondContact CD-O 3.37Å; R319-G336 PolarHBondContact NE-O 3.35Å; G336-S351 WeakPolarHBondContact CA-O 3.46Å; G336-E353 PolarHBondContact N-O 2.76Å
337	G	98.6	Very high	94.1	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	20%	0.197	C	C	.	.			trans	83	-173.2	-174.7	0	0	0	0	0	113.1	R32 S33 L320 H350 S351	R32-G337 PolarHBondContact O-N 3.05Å; S33-G337 PolarHBondContact OG-O 3.3Å; L320-G337 CarbonylContact O-C 3.55Å; L320-G337 WeakPolarHBondContact O-CA 3.45Å; G337-H350 CarbonylContact O-C 3.48Å; G337-H350 WeakPolarHBondContact O-CA 3.35Å; G337-S351 PolarHBondContact O-N 3.16Å
338	C	98.3	Very high	94	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	20%	0.196	C	C	.	.	B	Isolated β-bridge	trans	-116.3	135.8	179.1	-170.9	0	0	0	0	110.1	S33 R319 L320 N340 L342 A349	S33-C338 WeakPolarHBondContact OG-CB 3.49Å; S33-C338 PolarHBondContact OG-N 3.46Å; R319-C338 WeakPolarHBondContact CA-O 3.42Å; L320-C338 WeakPolarHBondContact CD2-O 3.22Å; L320-C338 HydrophobicContact CG-CB 4.33Å; L320-C338 PolarHBondContact N-O 3.26Å; L320-C338 PolarHBondContact O-N 3.47Å; C338-N340 PolarHBondContact SG-O 3.38Å; C338-N340 PolarHBondContact SG-OD1 3.43Å; C338-L342 HydrophobicContact CB-CB 4.04Å; C338-L342 HydrophobicContact CB-CD2 4.19Å; C338-A349 CarbonylContact C-O 3.52Å; C338-A349 WeakPolarHBondContact CA-O 3.41Å; C338-A349 PolarHBondContact SG-N 2.81Å; C338-A349 VanDerWaalsContact SG-N 3.4Å
339	A	98.3	Very high	94.2	Very high	29 Å²	29	36 Å²	36	24%	0.24	18%	0.184	C	C	.	.	S	Bend	trans	-82.9	-16.7	-179.2	0	0	0	0	0	113.7	P293 P318 A349	P293-A339 WeakPolarHBondContact CB-O 3.33Å; P318-A339 VanDerWaalsContact CG-O 3.3Å; P318-A339 WeakPolarHBondContact CG-O 3.47Å; P318-A339 WeakPolarHBondContact O-CA 3.23Å; A339-A349 HydrophobicContact CB-CB 4.19Å; A339-A349 PolarHBondContact N-O 2.87Å
340	N	97.3	Very high	94.7	Very high	52 Å²	52	34.6 Å²	34.6	28%	0.278	18%	0.177	S	C	.	.	S	Bend	trans	-133.5	-176.1	-179.8	66.2	8	0	0	0	111.8	L320 C338 L342 R347 A348 A349	L320-N340 WeakPolarHBondContact CD2-O 3.42Å; C338-N340 PolarHBondContact SG-O 3.38Å; C338-N340 PolarHBondContact SG-OD1 3.43Å; N340-L342 PolarHBondContact O-N 2.71Å; N340-R347 PolarHBondContact ND2-O 3.06Å; N340-R347 PolarHBondContact OD1-O 3.32Å; N340-A348 WeakPolarHBondContact OD1-CA 3.41Å; N340-A349 PolarHBondContact OD1-N 3.12Å
341	N	96.8	Very high	95.1	Very high	35 Å²	35	34.6 Å²	34.6	19%	0.187	18%	0.176	C	C	.	.			trans	-62.2	97.7	-179.2	178.5	6.1	0	0	0	112.2	F287 L343 V344	F287-N341 HydrophobicContact CE2-CB 3.97Å; F287-N341 HydrophobicContact CZ-CB 3.91Å; F287-N341 VanDerWaalsContact CZ-CG 3.5Å; F287-N341 VanDerWaalsContact CZ-OD1 3.27Å; F287-N341 WeakPolarHBondContact CZ-OD1 3.27Å; N341-L343 PolarHBondContact O-N 3.08Å; N341-L343 VanDerWaalsContact O-N 3.12Å; N341-L343 VanDerWaalsContact OD1-CB 3.24Å; N341-L343 WeakPolarHBondContact OD1-CB 2.86Å; N341-L343 WeakPolarHBondContact OD1-CG 3.22Å; N341-L343 PolarHBondContact OD1-N 2.84Å; N341-L343 VanDerWaalsContact OD1-N 3.08Å; N341-V344 PolarHBondContact O-N 3.28Å; N341-V344 VanDerWaalsContact O-N 3.08Å
342	L	93.4	Very high	95.2	Very high	5 Å²	5	36.7 Å²	36.7	3%	0.026	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-13	-178.4	68.1	77.4	0	0	0	114.7	W270 L320 W321 C338 N340 V344	W270-L342 HydrophobicContact CE3-CD2 4.5Å; W270-L342 HydrophobicContact CH2-CD1 3.65Å; W270-L342 HydrophobicContact CH2-CG 4.28Å; W270-L342 HydrophobicContact CZ2-CD1 4.13Å; W270-L342 HydrophobicContact CZ3-CD1 4.06Å; W270-L342 HydrophobicContact CZ3-CD2 4.41Å; W270-L342 HydrophobicContact CZ3-CG 4.19Å; L320-L342 HydrophobicContact CD1-CB 4.38Å; L320-L342 HydrophobicContact CD1-CD2 3.32Å; L320-L342 HydrophobicContact CD1-CG 3.62Å; L320-L342 HydrophobicContact CG-CD2 4.23Å; W321-L342 HydrophobicContact CB-CD2 4.21Å; W321-L342 HydrophobicContact CE3-CD1 4.44Å; W321-L342 HydrophobicContact CE3-CD2 3.69Å; W321-L342 HydrophobicContact CZ3-CD2 4.49Å; C338-L342 HydrophobicContact CB-CB 4.04Å; C338-L342 HydrophobicContact CB-CD2 4.19Å; N340-L342 PolarHBondContact O-N 2.71Å; L342-V344 PolarHBondContact O-N 3.22Å
343	L	92.6	Very high	95.1	Very high	72 Å²	72	40.1 Å²	40.1	38%	0.377	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-19.2	174.4	-57.9	172.6	0	0	0	111.4	W270 F287 N341 H345	W270-L343 HydrophobicContact CH2-CD2 3.94Å; W270-L343 HydrophobicContact CH2-CG 4.43Å; F287-L343 HydrophobicContact CE1-CD1 4.11Å; N341-L343 PolarHBondContact O-N 3.08Å; N341-L343 VanDerWaalsContact O-N 3.12Å; N341-L343 VanDerWaalsContact OD1-CB 3.24Å; N341-L343 WeakPolarHBondContact OD1-CB 2.86Å; N341-L343 WeakPolarHBondContact OD1-CG 3.22Å; N341-L343 PolarHBondContact OD1-N 2.84Å; N341-L343 VanDerWaalsContact OD1-N 3.08Å; L343-H345 VanDerWaalsContact C-N 3.35Å; L343-H345 PolarHBondContact O-CE1 3.38Å; L343-H345 PolarHBondContact O-N 2.88Å; L343-H345 PolarHBondContact O-ND1 3.23Å
344	V	90.9	Very high	95.1	Very high	54 Å²	54	42 Å²	42	33%	0.327	21%	0.214	S	C	.	.	S	Bend	trans	-93.1	70.9	170.9	-169.9	0	0	0	0	108.5	N341 L342 H346 R347 A348	N341-V344 PolarHBondContact O-N 3.28Å; N341-V344 VanDerWaalsContact O-N 3.08Å; L342-V344 PolarHBondContact O-N 3.22Å; V344-H346 VanDerWaalsContact C-N 3.3Å; V344-H346 WeakPolarHBondContact CG1-CE1 3.41Å; V344-H346 PolarHBondContact O-N 2.87Å; V344-H346 VanDerWaalsContact O-N 3.08Å; V344-R347 HydrophobicContact CG1-CB 4.19Å; V344-R347 HydrophobicContact CG1-CG 4.09Å; V344-R347 PolarHBondContact O-N 2.64Å; V344-A348 PolarHBondContact O-N 3.09Å
345	H	84.1	Confident	95.1	Very high	82 Å²	82	42 Å²	42	38%	0.38	21%	0.214	S	C	.	.	G	3₁₀ helix	trans	-43.9	-46.3	-169.1	-61.6	72	0	0	0	114.7	D60 L343 R347 A348	D60-H345 IonicContact OD1-CD2 3.58Å; D60-H345 IonicContact OD2-CD2 3.21Å; D60-H345 PolarHBondContact OD2-CD2 3.31Å; D60-H345 IonicContact OD2-NE2 3.67Å; L343-H345 VanDerWaalsContact C-N 3.35Å; L343-H345 PolarHBondContact O-CE1 3.38Å; L343-H345 PolarHBondContact O-N 2.88Å; L343-H345 PolarHBondContact O-ND1 3.23Å; H345-R347 PolarHBondContact O-N 3.22Å; H345-R347 VanDerWaalsContact O-N 3.17Å; H345-A348 WeakPolarHBondContact O-CB 3.3Å; H345-A348 PolarHBondContact O-N 2.77Å; H345-A348 VanDerWaalsContact O-N 3.15Å
346	H	83.1	Confident	95.1	Very high	122 Å²	122	44.7 Å²	44.7	57%	0.565	23%	0.227	S	C	*	.	G	3₁₀ helix	trans	-68.3	-12.8	-179.2	69.7	-82.1	0	0	0	115	L58 V344	L58-H346 HydrophobicContact CD2-CB 4.22Å; V344-H346 VanDerWaalsContact C-N 3.3Å; V344-H346 WeakPolarHBondContact CG1-CE1 3.41Å; V344-H346 PolarHBondContact O-N 2.87Å; V344-H346 VanDerWaalsContact O-N 3.08Å
347	R	89.6	Confident	95	Very high	178 Å²	178	44.8 Å²	44.8	67%	0.672	23%	0.228	S	C	*	.	G	3₁₀ helix	trans	-113.6	1.8	175.2	-57.5	-172.1	-174.5	-171.9	-4.5	112.5	N340 V344 H345 A349	N340-R347 PolarHBondContact ND2-O 3.06Å; N340-R347 PolarHBondContact OD1-O 3.32Å; V344-R347 HydrophobicContact CG1-CB 4.19Å; V344-R347 HydrophobicContact CG1-CG 4.09Å; V344-R347 PolarHBondContact O-N 2.64Å; H345-R347 PolarHBondContact O-N 3.22Å; H345-R347 VanDerWaalsContact O-N 3.17Å; R347-A349 PolarHBondContact O-N 3.35Å; R347-A349 VanDerWaalsContact O-N 3.16Å
348	A	93.6	Very high	94.8	Very high	7 Å²	7	47.6 Å²	47.6	6%	0.058	25%	0.248	C	C	.	.			trans	-59.7	119.8	-176	0	0	0	0	0	110.4	N340 V344 H345 H350	N340-A348 WeakPolarHBondContact OD1-CA 3.41Å; V344-A348 PolarHBondContact O-N 3.09Å; H345-A348 WeakPolarHBondContact O-CB 3.3Å; H345-A348 PolarHBondContact O-N 2.77Å; H345-A348 VanDerWaalsContact O-N 3.15Å; A348-H350 PolarHBondContact O-N 3.4Å
349	A	95.8	Very high	94.5	Very high	42 Å²	42	49 Å²	49	35%	0.347	26%	0.256	S	S	.	.			trans	-94.9	74.2	-179.7	0	0	0	0	0	109.8	C338 A339 N340 R347	C338-A349 CarbonylContact C-O 3.52Å; C338-A349 WeakPolarHBondContact CA-O 3.41Å; C338-A349 PolarHBondContact SG-N 2.81Å; C338-A349 VanDerWaalsContact SG-N 3.4Å; A339-A349 HydrophobicContact CB-CB 4.19Å; A339-A349 PolarHBondContact N-O 2.87Å; N340-A349 PolarHBondContact OD1-N 3.12Å; R347-A349 PolarHBondContact O-N 3.35Å; R347-A349 VanDerWaalsContact O-N 3.16Å
350	H	96.9	Very high	93.7	Very high	25 Å²	25	51.7 Å²	51.7	12%	0.116	26%	0.264	C	S	.	.	B	Isolated β-bridge	trans	-64	145.6	173.1	-60	-77.2	0	0	0	110.6	E31 S33 Y50 S52 G337 A348	E31-H350 HydrophobicContact CB-CB 4.06Å; E31-H350 HydrophobicContact CG-CB 3.76Å; S33-H350 WeakPolarHBondContact CB-ND1 3.46Å; S33-H350 PolarHBondContact OG-ND1 3.13Å; Y50-H350 AromaticContact CE2-CE1 3.64Å; Y50-H350 AromaticContact CE2-NE2 3.9Å; Y50-H350 AromaticContact CZ-CE1 3.76Å; S52-H350 PolarHBondContact N-CD2 2.88Å; S52-H350 VanDerWaalsContact N-CD2 3.35Å; S52-H350 PolarHBondContact N-NE2 3.44Å; G337-H350 CarbonylContact O-C 3.48Å; G337-H350 WeakPolarHBondContact O-CA 3.35Å; A348-H350 PolarHBondContact O-N 3.4Å
351	S	97.6	Very high	92.9	Very high	8 Å²	8	55.1 Å²	55.1	6%	0.056	29%	0.289	C	S	.	.			trans	-121.7	155	-179.2	-172	0	0	0	0	111	E31 R32 R319 G336 G337 E353	E31-S351 VanDerWaalsContact CA-O 3.32Å; E31-S351 WeakPolarHBondContact CA-O 3.44Å; R32-S351 PolarHBondContact N-O 2.89Å; R319-S351 PolarHBondContact NH2-OG 3.27Å; G336-S351 WeakPolarHBondContact CA-O 3.46Å; G337-S351 PolarHBondContact O-N 3.16Å; S351-E353 WeakPolarHBondContact OG-CB 3.28Å; S351-E353 WeakPolarHBondContact OG-CG 3.12Å; S351-E353 PolarHBondContact OG-N 3.02Å
352	N	97.9	Very high	92	Very high	59 Å²	59	56.7 Å²	56.7	32%	0.316	29%	0.294	S	S	.	.			trans	-118.5	16.4	162.5	60.4	-9.7	0	0	0	111.5	P29 E31 F335	P29-N352 WeakPolarHBondContact O-CB 3.3Å; P29-N352 PolarHBondContact O-ND2 3.18Å; E31-N352 HydrophobicContact CB-CB 4.25Å; F335-N352 HydrophobicContact CE2-CB 4.25Å; F335-N352 VanDerWaalsContact CE2-O 3.25Å; F335-N352 WeakPolarHBondContact CE2-O 3.36Å; F335-N352 HydrophobicContact CZ-CB 4.42Å
353	E	98.2	Very high	91.4	Very high	73 Å²	73	58.7 Å²	58.7	34%	0.341	31%	0.308	S	S	.	.			trans	-71.3	148.6	178.9	-69	175.5	-118.3	0	0	111.4	K317 R319 G336 S351	K317-E353 WeakPolarHBondContact CD-OE2 3.17Å; K317-E353 WeakPolarHBondContact CE-OE2 3.49Å; K317-E353 IonicContact NZ-OE2 2.98Å; K317-E353 PolarHBondContact NZ-OE2 2.98Å; R319-E353 IonicContact NH2-OE1 3.17Å; R319-E353 PolarHBondContact NH2-OE1 3.49Å; R319-E353 IonicContact NH2-OE2 2.79Å; R319-E353 PolarHBondContact NH2-OE2 2.79Å; G336-E353 PolarHBondContact N-O 2.76Å; S351-E353 WeakPolarHBondContact OG-CB 3.28Å; S351-E353 WeakPolarHBondContact OG-CG 3.12Å; S351-E353 PolarHBondContact OG-N 3.02Å
354	I	98.4	Very high	90.9	Very high	39 Å²	39	61.7 Å²	61.7	20%	0.2	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	129.1	164.2	-70.4	-75.9	0	0	0	108.3	M44 Y71 W78 I333 V334 F335 I356	M44-I354 HydrophobicContact CE-CD1 3.79Å; Y71-I354 HydrophobicContact CD1-CD1 4.46Å; Y71-I354 HydrophobicContact CE1-CD1 4.31Å; Y71-I354 HydrophobicContact CE2-CD1 4.38Å; Y71-I354 HydrophobicContact CE2-CG1 4.11Å; W78-I354 HydrophobicContact CH2-CD1 4.47Å; W78-I354 HydrophobicContact CZ2-CD1 3.8Å; W78-I354 HydrophobicContact CZ2-CG1 3.99Å; I333-I354 HydrophobicContact CG2-CD1 3.7Å; I333-I354 HydrophobicContact CG2-CG2 3.87Å; V334-I354 CarbonylContact O-C 3.49Å; V334-I354 WeakPolarHBondContact O-CA 3.48Å; F335-I354 HydrophobicContact CB-CD1 3.76Å; F335-I354 HydrophobicContact CD2-CD1 3.6Å; F335-I354 HydrophobicContact CD2-CG1 4.02Å; F335-I354 HydrophobicContact CG-CD1 4.03Å; I354-I356 HydrophobicContact CG2-CD1 4.12Å; I354-I356 HydrophobicContact CG2-CG1 3.68Å
355	L	98.6	Very high	90.5	Very high	1 Å²	1	63.1 Å²	63.1	1%	0.005	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	132.3	168.8	-44	175.8	0	0	0	108.3	F284 Y314 K317 R319 V334 F357	F284-L355 HydrophobicContact CE1-CD1 4.02Å; F284-L355 HydrophobicContact CZ-CD1 4Å; Y314-L355 HydrophobicContact CD1-CD2 3.98Å; Y314-L355 HydrophobicContact CD2-CB 4.13Å; Y314-L355 HydrophobicContact CE1-CB 4.5Å; Y314-L355 HydrophobicContact CE1-CD2 4.17Å; Y314-L355 HydrophobicContact CE2-CB 4.05Å; Y314-L355 HydrophobicContact CG-CB 4.38Å; Y314-L355 HydrophobicContact CG-CD2 4.34Å; K317-L355 HydrophobicContact CB-CD1 4.36Å; K317-L355 HydrophobicContact CD-CD2 3.66Å; R319-L355 HydrophobicContact CG-CD1 4.06Å; V334-L355 HydrophobicContact CB-CB 4.14Å; V334-L355 HydrophobicContact CG1-CD1 4.26Å; V334-L355 PolarHBondContact N-O 3.08Å; V334-L355 PolarHBondContact O-N 2.92Å; L355-F357 HydrophobicContact CB-CE2 3.8Å; L355-F357 HydrophobicContact CB-CZ 4.42Å
356	I	97.8	Very high	90.2	Very high	55 Å²	55	60.7 Å²	60.7	28%	0.282	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	113.7	-174.1	-56.4	-176.3	0	0	0	109.2	Y314 E331 I333 I354	Y314-I356 VanDerWaalsContact CE2-O 3.32Å; Y314-I356 WeakPolarHBondContact CE2-O 3.28Å; Y314-I356 PolarHBondContact OH-N 2.82Å; Y314-I356 PolarHBondContact OH-O 2.84Å; E331-I356 HydrophobicContact CB-CG2 4.05Å; E331-I356 HydrophobicContact CG-CG2 4.16Å; I333-I356 HydrophobicContact CD1-CB 4.33Å; I333-I356 HydrophobicContact CD1-CD1 4.24Å; I333-I356 HydrophobicContact CD1-CG1 3.89Å; I333-I356 HydrophobicContact CD1-CG2 3.89Å; I354-I356 HydrophobicContact CG2-CD1 4.12Å; I354-I356 HydrophobicContact CG2-CG1 3.68Å
357	F	97.8	Very high	90.2	Very high	3 Å²	3	59.1 Å²	59.1	1%	0.013	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	111.8	177.3	-59.9	-101.9	0	0	0	109.4	F282 F284 A297 F310 H312 Y314 E331 V332 V334 L355 V359	F282-F357 HydrophobicContact CE1-CB 4.22Å; F282-F357 HydrophobicContact CE1-CD1 4.26Å; F282-F357 HydrophobicContact CE1-CD2 4.22Å; F282-F357 AromaticContact CE1-CG 4Å; F282-F357 HydrophobicContact CE1-CG 4Å; F282-F357 HydrophobicContact CE2-CB 4.39Å; F282-F357 HydrophobicContact CE2-CD1 4.38Å; F282-F357 HydrophobicContact CZ-CB 3.79Å; F282-F357 AromaticContact CZ-CD1 3.5Å; F282-F357 HydrophobicContact CZ-CD1 3.5Å; F282-F357 HydrophobicContact CZ-CD2 4.24Å; F282-F357 HydrophobicContact CZ-CE1 4.07Å; F282-F357 AromaticContact CZ-CG 3.6Å; F282-F357 HydrophobicContact CZ-CG 3.6Å; F284-F357 HydrophobicContact CD1-CE2 4.27Å; F284-F357 HydrophobicContact CD1-CZ 4.13Å; F284-F357 AromaticContact CD2-CE1 3.88Å; F284-F357 HydrophobicContact CD2-CE1 3.88Å; F284-F357 HydrophobicContact CD2-CE2 4.36Å; F284-F357 AromaticContact CD2-CZ 3.52Å; F284-F357 HydrophobicContact CD2-CZ 3.52Å; F284-F357 HydrophobicContact CE1-CE2 4.31Å; F284-F357 HydrophobicContact CE1-CZ 4.01Å; F284-F357 AromaticContact CE2-CE1 3.92Å; F284-F357 HydrophobicContact CE2-CE1 3.92Å; F284-F357 HydrophobicContact CE2-CE2 4.4Å; F284-F357 AromaticContact CE2-CZ 3.39Å; F284-F357 HydrophobicContact CE2-CZ 3.39Å; F284-F357 HydrophobicContact CG-CE2 4.3Å; F284-F357 AromaticContact CG-CZ 3.9Å; F284-F357 HydrophobicContact CG-CZ 3.9Å; F284-F357 HydrophobicContact CZ-CE2 4.38Å; F284-F357 AromaticContact CZ-CZ 3.66Å; F284-F357 HydrophobicContact CZ-CZ 3.66Å; A297-F357 HydrophobicContact CB-CE1 4.25Å; F310-F357 HydrophobicContact CD1-CD1 4.38Å; F310-F357 HydrophobicContact CE1-CB 4.43Å; F310-F357 HydrophobicContact CE1-CD1 4.11Å; H312-F357 HydrophobicContact CB-CD1 3.8Å; H312-F357 HydrophobicContact CB-CE1 3.78Å; H312-F357 AromaticContact CG-CE1 3.49Å; H312-F357 VanDerWaalsContact CG-CE1 3.49Å; H312-F357 AromaticContact ND1-CE1 3.51Å; Y314-F357 HydrophobicContact CD2-CD1 4.17Å; Y314-F357 AromaticContact CD2-CE1 3.66Å; Y314-F357 HydrophobicContact CD2-CE1 3.66Å; Y314-F357 HydrophobicContact CD2-CE2 4.04Å; Y314-F357 AromaticContact CD2-CZ 3.56Å; Y314-F357 HydrophobicContact CD2-CZ 3.56Å; Y314-F357 HydrophobicContact CE2-CD1 4.44Å; Y314-F357 HydrophobicContact CE2-CD2 4.47Å; Y314-F357 HydrophobicContact CE2-CE1 4.34Å; Y314-F357 HydrophobicContact CE2-CE2 4.31Å; Y314-F357 HydrophobicContact CE2-CZ 4.24Å; Y314-F357 HydrophobicContact CG-CZ 4.43Å; E331-F357 CarbonylContact C-O 3.54Å; E331-F357 VanDerWaalsContact CA-O 3.25Å; E331-F357 WeakPolarHBondContact CA-O 3.48Å; V332-F357 HydrophobicContact CB-CB 4.33Å; V332-F357 PolarHBondContact N-O 3.16Å; V332-F357 PolarHBondContact O-N 2.84Å; V334-F357 HydrophobicContact CB-CE2 4.18Å; V334-F357 HydrophobicContact CG2-CD2 4.12Å; V334-F357 HydrophobicContact CG2-CE2 3.72Å; L355-F357 HydrophobicContact CB-CE2 3.8Å; L355-F357 HydrophobicContact CB-CZ 4.42Å; F357-V359 HydrophobicContact CB-CG1 4.38Å; F357-V359 PolarHBondContact O-N 2.87Å
358	S	93.8	Very high	90.1	Very high	59 Å²	59	53.4 Å²	53.4	41%	0.413	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	96.1	173.6	-54.5	0	0	0	0	109.7	F310	F310-S358 WeakPolarHBondContact CZ-O 3.27Å
359	V	91.3	Very high	89.5	Confident	30 Å²	30	53.8 Å²	53.8	18%	0.182	30%	0.304	C	S	.	.			trans	-89.9	-16.7	-176	-68.4	0	0	0	0	112.9	V276 F282 F310 G330 V332 F357	V276-V359 HydrophobicContact CB-CG2 3.79Å; V276-V359 HydrophobicContact CG1-CG2 3.81Å; V276-V359 HydrophobicContact CG2-CG2 4.22Å; F282-V359 HydrophobicContact CD2-CG1 3.41Å; F282-V359 VanDerWaalsContact CD2-CG1 3.41Å; F282-V359 HydrophobicContact CE2-CG1 3.66Å; F282-V359 HydrophobicContact CG-CG1 3.99Å; F282-V359 HydrophobicContact CZ-CG1 4.43Å; F310-V359 HydrophobicContact CE2-CG1 4.19Å; F310-V359 HydrophobicContact CZ-CG1 4.23Å; G330-V359 WeakPolarHBondContact O-CG2 3.39Å; G330-V359 PolarHBondContact O-N 3.29Å; G330-V359 VanDerWaalsContact O-N 3.11Å; V332-V359 HydrophobicContact CG2-CG1 4.19Å; V332-V359 HydrophobicContact CG2-CG2 4.14Å; F357-V359 HydrophobicContact CB-CG1 4.38Å; F357-V359 PolarHBondContact O-N 2.87Å
360	Q	83.1	Confident	88.8	Confident	85 Å²	85	54.4 Å²	54.4	40%	0.397	30%	0.299	S	S	.	.	S	Bend	trans	-123	156.9	170.2	-59.1	-170.4	4.8	0	0	110.9	V276 G330	V276-Q360 PolarHBondContact O-NE2 2.84Å; G330-Q360 PolarHBondContact O-N 3.14Å; G330-Q360 VanDerWaalsContact O-N 3.15Å
361	P	79	Confident	88.2	Confident	124 Å²	124	55.1 Å²	55.1	81%	0.805	31%	0.309	S	S	*	.	P	Polyproline II helix	trans	-59.5	139.3	169.6	-18.8	31.2	0	0	0	110.9
362	K	78.8	Confident	87.7	Confident	68 Å²	68	56.2 Å²	56.2	30%	0.296	32%	0.316	S	S	.	.	P	Polyproline II helix	trans	-60.4	142.1	175.7	-68	-178.7	-179.6	-176.4	0	110.9	R366 L367 E370	K362-R366 HydrophobicContact CB-CB 4.24Å; K362-R366 HydrophobicContact CB-CG 3.99Å; K362-R366 HydrophobicContact CD-CG 3.93Å; K362-R366 HydrophobicContact CG-CG 4.09Å; K362-L367 HydrophobicContact CB-CD2 4.06Å; K362-L367 HydrophobicContact CB-CG 3.99Å; K362-L367 HydrophobicContact CD-CD2 4.22Å; K362-E370 IonicContact NZ-OE1 3.53Å; K362-E370 PolarHBondContact NZ-OE1 3.17Å; K362-E370 IonicContact NZ-OE2 2.73Å; K362-E370 PolarHBondContact NZ-OE2 3.15Å
363	S	80	Confident	86.9	Confident	47 Å²	47	54 Å²	54	33%	0.329	30%	0.304	S	S	.	.	P	Polyproline II helix	trans	-60.4	153.5	173	70.2	0	0	0	0	111.5	E329 V365 R366 L367	E329-S363 PolarHBondContact OE2-OG 2.9Å; E329-S363 VanDerWaalsContact OE2-OG 3.08Å; S363-V365 PolarHBondContact O-N 2.9Å; S363-R366 WeakPolarHBondContact O-CB 3.07Å; S363-R366 PolarHBondContact O-N 2.92Å; S363-R366 VanDerWaalsContact OG-CB 3.23Å; S363-R366 WeakPolarHBondContact OG-CB 3.27Å; S363-R366 PolarHBondContact OG-N 2.86Å; S363-L367 PolarHBondContact O-N 3.06Å
364	L	83.2	Confident	86.2	Confident	135 Å²	135	55.1 Å²	55.1	71%	0.707	32%	0.319	S	S	*	.	H	α-helix	trans	-58.6	-35.3	175.2	179.7	62	0	0	0	111.5	L367 S368	L364-L367 PolarHBondContact O-N 3.03Å; L364-S368 VanDerWaalsContact O-CB 3.28Å; L364-S368 WeakPolarHBondContact O-CB 3.21Å; L364-S368 PolarHBondContact O-N 2.96Å; L364-S368 PolarHBondContact O-OG 3.3Å
365	V	81.4	Confident	85.7	Confident	83 Å²	83	58.9 Å²	58.9	50%	0.503	33%	0.334	S	S	.	.	H	α-helix	trans	-62.3	-47.5	174.7	177.4	0	0	0	0	110.2	S363 S368 L369 L390	S363-V365 PolarHBondContact O-N 2.9Å; V365-S368 PolarHBondContact O-N 2.88Å; V365-L369 HydrophobicContact CG1-CD1 4.04Å; V365-L369 HydrophobicContact CG1-CG 4.39Å; V365-L369 WeakPolarHBondContact O-CB 3.45Å; V365-L369 WeakPolarHBondContact O-CG 3.39Å; V365-L369 PolarHBondContact O-N 3.21Å; V365-L390 HydrophobicContact CG1-CD2 4.47Å
366	R	77.8	Confident	84.9	Confident	31 Å²	31	63 Å²	63	12%	0.117	35%	0.352	C	S	.	.	H	α-helix	trans	-60.4	-47	177	178.9	71	-164.1	-151.7	5.5	112.1	E329 K362 S363 S368 L369 E370 R397	E329-R366 WeakPolarHBondContact OE2-CB 3.49Å; K362-R366 HydrophobicContact CB-CB 4.24Å; K362-R366 HydrophobicContact CB-CG 3.99Å; K362-R366 HydrophobicContact CD-CG 3.93Å; K362-R366 HydrophobicContact CG-CG 4.09Å; S363-R366 WeakPolarHBondContact O-CB 3.07Å; S363-R366 PolarHBondContact O-N 2.92Å; S363-R366 VanDerWaalsContact OG-CB 3.23Å; S363-R366 WeakPolarHBondContact OG-CB 3.27Å; S363-R366 PolarHBondContact OG-N 2.86Å; R366-S368 VanDerWaalsContact C-N 3.3Å; R366-S368 PolarHBondContact O-N 2.98Å; R366-L369 PolarHBondContact O-N 3.35Å; R366-E370 IonicContact CZ-OE1 2.69Å; R366-E370 VanDerWaalsContact CZ-OE1 3.24Å; R366-E370 IonicContact NE-OE1 3.48Å; R366-E370 PolarHBondContact NE-OE1 2.89Å; R366-E370 IonicContact NH2-OE1 3.55Å; R366-E370 PolarHBondContact NH2-OE1 2.95Å; R366-E370 WeakPolarHBondContact O-CG 3.14Å; R366-E370 PolarHBondContact O-N 2.9Å; R366-R397 VanDerWaalsContact CD-NH1 3.33Å
367	L	83.6	Confident	84.4	Confident	89 Å²	89	68.9 Å²	68.9	47%	0.466	38%	0.378	S	S	.	.	H	α-helix	trans	-60.1	-42.1	176.3	-70.5	171.1	0	0	0	111.5	K362 S363 L364 E370 A371	K362-L367 HydrophobicContact CB-CD2 4.06Å; K362-L367 HydrophobicContact CB-CG 3.99Å; K362-L367 HydrophobicContact CD-CD2 4.22Å; S363-L367 PolarHBondContact O-N 3.06Å; L364-L367 PolarHBondContact O-N 3.03Å; L367-E370 PolarHBondContact O-N 3.26Å; L367-A371 WeakPolarHBondContact O-CB 3.36Å; L367-A371 PolarHBondContact O-N 3.44Å
368	S	86.9	Confident	83.9	Confident	58 Å²	58	75.9 Å²	75.9	41%	0.406	41%	0.412	S	S	.	.	H	α-helix	trans	-66.1	-43.7	178.2	-58	0	0	0	0	111.7	L364 V365 R366 A371 V372	L364-S368 VanDerWaalsContact O-CB 3.28Å; L364-S368 WeakPolarHBondContact O-CB 3.21Å; L364-S368 PolarHBondContact O-N 2.96Å; L364-S368 PolarHBondContact O-OG 3.3Å; V365-S368 PolarHBondContact O-N 2.88Å; R366-S368 VanDerWaalsContact C-N 3.3Å; R366-S368 PolarHBondContact O-N 2.98Å; S368-A371 PolarHBondContact O-N 2.89Å; S368-V372 VanDerWaalsContact O-CG2 3.24Å; S368-V372 WeakPolarHBondContact O-CG2 3.39Å; S368-V372 PolarHBondContact O-N 3.08Å
369	L	81	Confident	83.5	Confident	15 Å²	15	76.1 Å²	76.1	8%	0.079	41%	0.409	C	S	.	.	H	α-helix	trans	-62.5	-42.8	176.4	-73.9	173	0	0	0	111.6	V365 R366 V372 I373 L390 V394	V365-L369 HydrophobicContact CG1-CD1 4.04Å; V365-L369 HydrophobicContact CG1-CG 4.39Å; V365-L369 WeakPolarHBondContact O-CB 3.45Å; V365-L369 WeakPolarHBondContact O-CG 3.39Å; V365-L369 PolarHBondContact O-N 3.21Å; R366-L369 PolarHBondContact O-N 3.35Å; L369-V372 PolarHBondContact O-N 2.86Å; L369-I373 WeakPolarHBondContact O-CD1 3.02Å; L369-I373 VanDerWaalsContact O-CG1 3.26Å; L369-I373 WeakPolarHBondContact O-CG1 3.38Å; L369-I373 PolarHBondContact O-N 3.19Å; L369-I373 VanDerWaalsContact O-N 3.07Å; L369-L390 HydrophobicContact CD2-CD2 4.46Å; L369-V394 HydrophobicContact CD2-CG2 3.54Å
370	E	81.3	Confident	83.2	Confident	55 Å²	55	76.7 Å²	76.7	26%	0.257	42%	0.417	S	S	.	.	H	α-helix	trans	-63.2	-42.3	175.4	-74.6	179.7	179.4	0	0	111.9	K362 R366 L367 I373 C374	K362-E370 IonicContact NZ-OE1 3.53Å; K362-E370 PolarHBondContact NZ-OE1 3.17Å; K362-E370 IonicContact NZ-OE2 2.73Å; K362-E370 PolarHBondContact NZ-OE2 3.15Å; R366-E370 IonicContact CZ-OE1 2.69Å; R366-E370 VanDerWaalsContact CZ-OE1 3.24Å; R366-E370 IonicContact NE-OE1 3.48Å; R366-E370 PolarHBondContact NE-OE1 2.89Å; R366-E370 IonicContact NH2-OE1 3.55Å; R366-E370 PolarHBondContact NH2-OE1 2.95Å; R366-E370 WeakPolarHBondContact O-CG 3.14Å; R366-E370 PolarHBondContact O-N 2.9Å; L367-E370 PolarHBondContact O-N 3.26Å; E370-I373 PolarHBondContact O-N 3.32Å; E370-C374 VanDerWaalsContact O-CB 3.3Å; E370-C374 WeakPolarHBondContact O-CB 3.29Å; E370-C374 PolarHBondContact O-N 2.82Å
371	A	85.3	Confident	83.4	Confident	40 Å²	40	79.7 Å²	79.7	33%	0.331	44%	0.436	S	S	.	.	H	α-helix	trans	-62.5	-44.2	174.7	0	0	0	0	0	111.9	L367 S368 I373 C374 F375	L367-A371 WeakPolarHBondContact O-CB 3.36Å; L367-A371 PolarHBondContact O-N 3.44Å; S368-A371 PolarHBondContact O-N 2.89Å; A371-I373 PolarHBondContact O-N 2.87Å; A371-C374 PolarHBondContact O-N 3.41Å; A371-C374 VanDerWaalsContact O-N 3.16Å; A371-F375 HydrophobicContact CB-CD2 4.49Å; A371-F375 VanDerWaalsContact O-CD2 3.23Å; A371-F375 WeakPolarHBondContact O-CD2 3.16Å; A371-F375 PolarHBondContact O-N 3.23Å
372	V	85.6	Confident	83.7	Confident	32 Å²	32	77.1 Å²	77.1	19%	0.194	42%	0.421	C	S	.	.	H	α-helix	trans	-58.2	-39.5	177.2	168.9	0	0	0	0	111.5	S368 L369 K376 L379 W383 V394	S368-V372 VanDerWaalsContact O-CG2 3.24Å; S368-V372 WeakPolarHBondContact O-CG2 3.39Å; S368-V372 PolarHBondContact O-N 3.08Å; L369-V372 PolarHBondContact O-N 2.86Å; V372-K376 PolarHBondContact O-N 3.12Å; V372-L379 HydrophobicContact CG2-CD1 4.33Å; V372-W383 HydrophobicContact CG1-CZ2 4.38Å; V372-V394 HydrophobicContact CG1-CG1 4.28Å; V372-V394 HydrophobicContact CG1-CG2 4.1Å
373	I	81.8	Confident	84.1	Confident	13 Å²	13	75 Å²	75	7%	0.067	41%	0.411	C	S	.	.	H	α-helix	trans	-73.2	-40.8	177	-65	161.5	0	0	0	111.3	L369 E370 A371 K376 V394 R397 N401	L369-I373 WeakPolarHBondContact O-CD1 3.02Å; L369-I373 VanDerWaalsContact O-CG1 3.26Å; L369-I373 WeakPolarHBondContact O-CG1 3.38Å; L369-I373 PolarHBondContact O-N 3.19Å; L369-I373 VanDerWaalsContact O-N 3.07Å; E370-I373 PolarHBondContact O-N 3.32Å; A371-I373 PolarHBondContact O-N 2.87Å; I373-K376 WeakPolarHBondContact O-CB 3.21Å; I373-K376 PolarHBondContact O-N 3.08Å; I373-V394 HydrophobicContact CG1-CG1 4.46Å; I373-R397 HydrophobicContact CD1-CB 3.41Å; I373-R397 VanDerWaalsContact CD1-CB 3.41Å; I373-R397 HydrophobicContact CD1-CG 4.27Å; I373-N401 WeakPolarHBondContact CG2-ND2 2.88Å
374	C	83.8	Confident	84.3	Confident	96 Å²	96	79.3 Å²	79.3	65%	0.649	43%	0.43	S	S	*	.	H	α-helix	trans	-62.5	-42.7	179	-171.2	0	0	0	0	111.6	E370 A371 K376	E370-C374 VanDerWaalsContact O-CB 3.3Å; E370-C374 WeakPolarHBondContact O-CB 3.29Å; E370-C374 PolarHBondContact O-N 2.82Å; A371-C374 PolarHBondContact O-N 3.41Å; A371-C374 VanDerWaalsContact O-N 3.16Å; C374-K376 VanDerWaalsContact C-N 3.31Å; C374-K376 PolarHBondContact O-N 3.41Å
375	F	86.9	Confident	84.4	Confident	118 Å²	118	78.3 Å²	78.3	52%	0.518	43%	0.433	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.6	31.5	177.8	-60.9	-73	0	0	0	112.9	A371 E377 M378 L379	A371-F375 HydrophobicContact CB-CD2 4.49Å; A371-F375 VanDerWaalsContact O-CD2 3.23Å; A371-F375 WeakPolarHBondContact O-CD2 3.16Å; A371-F375 PolarHBondContact O-N 3.23Å; F375-E377 PolarHBondContact O-N 3.04Å; F375-E377 VanDerWaalsContact O-N 3.15Å; F375-M378 HydrophobicContact CD1-SD 4.45Å; F375-M378 PolarHBondContact O-N 3.27Å; F375-L379 HydrophobicContact CB-CD1 3.88Å; F375-L379 HydrophobicContact CB-CG 4.27Å; F375-L379 PolarHBondContact O-N 3.26Å
376	K	83.5	Confident	84.6	Confident	87 Å²	87	76.7 Å²	76.7	38%	0.378	42%	0.421	S	S	.	.	H	α-helix	trans	-52.9	-39.2	-175.3	64.2	173.7	-174.5	179.6	0	113.6	V372 I373 C374 M378 L379 A380 W383 F398	V372-K376 PolarHBondContact O-N 3.12Å; I373-K376 WeakPolarHBondContact O-CB 3.21Å; I373-K376 PolarHBondContact O-N 3.08Å; C374-K376 VanDerWaalsContact C-N 3.31Å; C374-K376 PolarHBondContact O-N 3.41Å; K376-M378 PolarHBondContact O-N 2.76Å; K376-L379 PolarHBondContact O-N 3.04Å; K376-L379 VanDerWaalsContact O-N 3.17Å; K376-A380 WeakPolarHBondContact O-CB 3.24Å; K376-A380 PolarHBondContact O-N 3.37Å; K376-W383 HydrophobicContact CB-CH2 4.29Å; K376-W383 HydrophobicContact CB-CZ2 3.86Å; K376-F398 HydrophobicContact CD-CD2 4.38Å; K376-F398 HydrophobicContact CD-CE2 3.89Å
377	E	85.6	Confident	85.1	Confident	178 Å²	178	78.5 Å²	78.5	83%	0.832	44%	0.437	S	S	*	.	H	α-helix	trans	-63.3	-30.1	-175.5	-64.6	-175.6	175.3	0	0	111.5	F375	F375-E377 PolarHBondContact O-N 3.04Å; F375-E377 VanDerWaalsContact O-N 3.15Å
378	M	87.2	Confident	85.2	Confident	150 Å²	150	83.3 Å²	83.3	74%	0.739	46%	0.455	S	S	*	.	H	α-helix	trans	-87.5	-35.1	176.6	-62.2	177.3	64.5	0	0	112.3	F375 K376	F375-M378 HydrophobicContact CD1-SD 4.45Å; F375-M378 PolarHBondContact O-N 3.27Å; K376-M378 PolarHBondContact O-N 2.76Å
379	L	86.4	Confident	84.8	Confident	64 Å²	64	86.6 Å²	86.6	34%	0.335	46%	0.463	S	S	.	.	H	α-helix	trans	-102.5	-16.7	-165.5	-63	176.7	0	0	0	114.6	V372 F375 K376 N381 S382 W383	V372-L379 HydrophobicContact CG2-CD1 4.33Å; F375-L379 HydrophobicContact CB-CD1 3.88Å; F375-L379 HydrophobicContact CB-CG 4.27Å; F375-L379 PolarHBondContact O-N 3.26Å; K376-L379 PolarHBondContact O-N 3.04Å; K376-L379 VanDerWaalsContact O-N 3.17Å; L379-N381 VanDerWaalsContact C-N 3.28Å; L379-N381 PolarHBondContact O-N 2.69Å; L379-S382 WeakPolarHBondContact O-CA 3.27Å; L379-S382 WeakPolarHBondContact O-CB 3.49Å; L379-S382 PolarHBondContact O-N 3.4Å; L379-W383 PolarHBondContact O-N 2.99Å; L379-W383 PolarHBondContact O-NE1 3.03Å
380	A	85.2	Confident	84.9	Confident	43 Å²	43	88 Å²	88	36%	0.355	47%	0.47	S	S	.	.	G	3₁₀ helix	trans	-55.4	-40.1	-173.1	0	0	0	0	0	113.3	K376 S382 W383	K376-A380 WeakPolarHBondContact O-CB 3.24Å; K376-A380 PolarHBondContact O-N 3.37Å; A380-S382 PolarHBondContact O-N 2.95Å; A380-S382 VanDerWaalsContact O-N 3.16Å; A380-W383 HydrophobicContact CB-CD2 4.44Å; A380-W383 WeakPolarHBondContact O-CB 3.43Å; A380-W383 PolarHBondContact O-N 3.45Å; A380-W383 VanDerWaalsContact O-N 3.07Å
381	N	86.4	Confident	85	Confident	148 Å²	148	87 Å²	87	79%	0.791	47%	0.467	S	S	*	.	G	3₁₀ helix	trans	-63.3	-22.8	178.6	-66.4	-25.1	0	0	0	113	L379	L379-N381 VanDerWaalsContact C-N 3.28Å; L379-N381 PolarHBondContact O-N 2.69Å
382	S	86.3	Confident	84.8	Confident	70 Å²	70	90.3 Å²	90.3	49%	0.49	48%	0.475	S	S	.	.	G	3₁₀ helix	trans	-95.4	-4.7	179	-56.8	0	0	0	0	113.1	L379 A380 N384 C385	L379-S382 WeakPolarHBondContact O-CA 3.27Å; L379-S382 WeakPolarHBondContact O-CB 3.49Å; L379-S382 PolarHBondContact O-N 3.4Å; A380-S382 PolarHBondContact O-N 2.95Å; A380-S382 VanDerWaalsContact O-N 3.16Å; S382-N384 VanDerWaalsContact C-N 3.26Å; S382-N384 PolarHBondContact O-N 3.32Å; S382-C385 VanDerWaalsContact O-CB 3.29Å; S382-C385 WeakPolarHBondContact O-CB 3.4Å; S382-C385 PolarHBondContact O-N 3Å
383	W	86.5	Confident	84.3	Confident	23 Å²	23	89.8 Å²	89.8	9%	0.087	47%	0.473	C	S	.	.	G	3₁₀ helix	trans	-63	-32.6	-177.1	-71.4	5.1	0	0	0	112.6	V372 K376 L379 A380 C385 L386 L391 V394 F398	V372-W383 HydrophobicContact CG1-CZ2 4.38Å; K376-W383 HydrophobicContact CB-CH2 4.29Å; K376-W383 HydrophobicContact CB-CZ2 3.86Å; L379-W383 PolarHBondContact O-N 2.99Å; L379-W383 PolarHBondContact O-NE1 3.03Å; A380-W383 HydrophobicContact CB-CD2 4.44Å; A380-W383 WeakPolarHBondContact O-CB 3.43Å; A380-W383 PolarHBondContact O-N 3.45Å; A380-W383 VanDerWaalsContact O-N 3.07Å; W383-C385 PolarHBondContact O-N 3.32Å; W383-C385 VanDerWaalsContact O-N 3.07Å; W383-L386 HydrophobicContact CB-CD1 4.44Å; W383-L386 VanDerWaalsContact O-CB 3.24Å; W383-L386 WeakPolarHBondContact O-CB 3.1Å; W383-L386 WeakPolarHBondContact O-CG 3.4Å; W383-L386 PolarHBondContact O-N 3.26Å; W383-L391 HydrophobicContact CB-CD1 3.91Å; W383-L391 WeakPolarHBondContact O-CD1 3.49Å; W383-V394 HydrophobicContact CD2-CG1 3.68Å; W383-V394 HydrophobicContact CE3-CG1 3.59Å; W383-V394 HydrophobicContact CG-CG1 4.47Å; W383-V394 HydrophobicContact CH2-CG1 3.62Å; W383-V394 HydrophobicContact CZ2-CG1 3.7Å; W383-V394 HydrophobicContact CZ3-CG1 3.57Å; W383-F398 HydrophobicContact CH2-CB 4.21Å; W383-F398 AromaticContact CH2-CD2 3.83Å; W383-F398 HydrophobicContact CH2-CD2 3.83Å; W383-F398 HydrophobicContact CH2-CG 4.19Å; W383-F398 HydrophobicContact CZ3-CB 4.24Å; W383-F398 HydrophobicContact CZ3-CD2 4.27Å; W383-F398 HydrophobicContact CZ3-CG 4.24Å
384	N	83.6	Confident	84.3	Confident	138 Å²	138	89.2 Å²	89.2	74%	0.738	47%	0.47	S	S	*	.	G	3₁₀ helix	trans	-62.7	-15.5	176.9	-66.8	-32.2	0	0	0	113.3	S382 L386	S382-N384 VanDerWaalsContact C-N 3.26Å; S382-N384 PolarHBondContact O-N 3.32Å; N384-L386 VanDerWaalsContact C-N 3.34Å
385	C	87.3	Confident	84	Confident	113 Å²	113	88.5 Å²	88.5	76%	0.764	46%	0.46	S	S	*	.	G	3₁₀ helix	trans	-83.2	-10.8	174.1	-56.2	0	0	0	0	113	S382 W383	S382-C385 VanDerWaalsContact O-CB 3.29Å; S382-C385 WeakPolarHBondContact O-CB 3.4Å; S382-C385 PolarHBondContact O-N 3Å; W383-C385 PolarHBondContact O-N 3.32Å; W383-C385 VanDerWaalsContact O-N 3.07Å
386	L	85.3	Confident	83.3	Confident	49 Å²	49	85.7 Å²	85.7	26%	0.257	45%	0.448	S	S	.	.	S	Bend	trans	-70.9	144.2	178.6	-66.8	172	0	0	0	110.7	W383 N384 K388 L390 L391 V394	W383-L386 HydrophobicContact CB-CD1 4.44Å; W383-L386 VanDerWaalsContact O-CB 3.24Å; W383-L386 WeakPolarHBondContact O-CB 3.1Å; W383-L386 WeakPolarHBondContact O-CG 3.4Å; W383-L386 PolarHBondContact O-N 3.26Å; N384-L386 VanDerWaalsContact C-N 3.34Å; L386-K388 PolarHBondContact O-N 2.88Å; L386-L390 HydrophobicContact CB-CB 4.3Å; L386-L391 HydrophobicContact CB-CB 4.11Å; L386-V394 HydrophobicContact CD1-CG2 3.96Å
387	P	88.5	Confident	82.8	Confident	70 Å²	70	82 Å²	82	46%	0.455	43%	0.432	S	S	.	.			trans	-49.3	142	165.2	-26.5	34	0	0	0	111.3	H389 L390 L391	P387-H389 PolarHBondContact O-N 3.04Å; P387-L390 HydrophobicContact CG-CD1 4.32Å; P387-L390 PolarHBondContact O-N 2.79Å; P387-L391 PolarHBondContact O-N 2.73Å
388	K	84.5	Confident	81.8	Confident	190 Å²	190	78.3 Å²	78.3	83%	0.826	41%	0.413	S	S	*	.	H	α-helix	trans	-49.2	-39.5	-173.3	-69.6	-175.2	178.4	-179.1	0	114	L386 H392	L386-K388 PolarHBondContact O-N 2.88Å; K388-H392 VanDerWaalsContact O-CB 3.26Å; K388-H392 WeakPolarHBondContact O-CB 3.36Å; K388-H392 PolarHBondContact O-N 2.64Å
389	H	79.7	Confident	80.5	Confident	127 Å²	127	72.4 Å²	72.4	59%	0.588	39%	0.391	S	S	*	.	H	α-helix	trans	-67.8	-42.1	179.4	69.7	-84.5	0	0	0	112.3	P387 H392 S393	P387-H389 PolarHBondContact O-N 3.04Å; H389-H392 WeakPolarHBondContact O-CB 3.42Å; H389-H392 PolarHBondContact O-N 3.3Å; H389-S393 PolarHBondContact O-N 3.33Å; H389-S393 PolarHBondContact O-OG 2.81Å; H389-S393 VanDerWaalsContact O-OG 3.13Å
390	L	82.7	Confident	78.8	Confident	44 Å²	44	70.7 Å²	70.7	23%	0.23	39%	0.385	C	S	.	.	H	α-helix	trans	-69.7	-41.4	175.9	-64.4	-176.9	0	0	0	111.5	V365 L369 L386 P387 H392 S393 V394	V365-L390 HydrophobicContact CG1-CD2 4.47Å; L369-L390 HydrophobicContact CD2-CD2 4.46Å; L386-L390 HydrophobicContact CB-CB 4.3Å; P387-L390 HydrophobicContact CG-CD1 4.32Å; P387-L390 PolarHBondContact O-N 2.79Å; L390-H392 VanDerWaalsContact C-N 3.26Å; L390-H392 PolarHBondContact O-N 3.07Å; L390-S393 PolarHBondContact O-N 2.7Å; L390-V394 WeakPolarHBondContact O-CG2 3.34Å; L390-V394 PolarHBondContact O-N 2.89Å
391	L	83.4	Confident	76.8	Confident	34 Å²	34	72.8 Å²	72.8	18%	0.178	39%	0.39	C	S	.	.	H	α-helix	trans	-59	-42.4	174.2	-178.9	54.8	0	0	0	110.9	W383 L386 P387 V394 N395	W383-L391 HydrophobicContact CB-CD1 3.91Å; W383-L391 WeakPolarHBondContact O-CD1 3.49Å; L386-L391 HydrophobicContact CB-CB 4.11Å; P387-L391 PolarHBondContact O-N 2.73Å; L391-V394 PolarHBondContact O-N 2.62Å; L391-N395 WeakPolarHBondContact O-CB 3.34Å; L391-N395 PolarHBondContact O-N 3.09Å; L391-N395 PolarHBondContact O-ND2 3.48Å
392	H	79.7	Confident	74.5	Confident	109 Å²	109	73.4 Å²	73.4	51%	0.505	39%	0.393	S	S	.	.	H	α-helix	trans	-60.5	-48	174.2	-172.9	73	0	0	0	111.8	K388 H389 L390 V394 N395 Q396	K388-H392 VanDerWaalsContact O-CB 3.26Å; K388-H392 WeakPolarHBondContact O-CB 3.36Å; K388-H392 PolarHBondContact O-N 2.64Å; H389-H392 WeakPolarHBondContact O-CB 3.42Å; H389-H392 PolarHBondContact O-N 3.3Å; L390-H392 VanDerWaalsContact C-N 3.26Å; L390-H392 PolarHBondContact O-N 3.07Å; H392-V394 PolarHBondContact O-N 2.64Å; H392-N395 PolarHBondContact O-N 3.45Å; H392-Q396 PolarHBondContact NE2-NE2 3.08Å; H392-Q396 WeakPolarHBondContact O-CB 3.37Å; H392-Q396 WeakPolarHBondContact O-CG 3.26Å; H392-Q396 PolarHBondContact O-N 2.95Å
393	S	76.8	Confident	72.2	Confident	22 Å²	22	75.2 Å²	75.2	15%	0.154	40%	0.401	C	S	.	.	H	α-helix	trans	-60.7	-42	176.5	-61.4	0	0	0	0	112.9	H389 L390 R397	H389-S393 PolarHBondContact O-N 3.33Å; H389-S393 PolarHBondContact O-OG 2.81Å; H389-S393 VanDerWaalsContact O-OG 3.13Å; L390-S393 PolarHBondContact O-N 2.7Å; S393-R397 WeakPolarHBondContact O-CB 3.36Å; S393-R397 WeakPolarHBondContact O-CD 3.4Å; S393-R397 VanDerWaalsContact O-CG 3.27Å; S393-R397 WeakPolarHBondContact O-CG 3.45Å; S393-R397 PolarHBondContact O-N 3.11Å; S393-R397 VanDerWaalsContact O-N 3.13Å
394	V	80.7	Confident	69.7	Low	0 Å²	0	79 Å²	79	0%	0	43%	0.431	C	S	.	.	H	α-helix	trans	-63.6	-47.2	175.8	172.4	0	0	0	0	110.4	L369 V372 I373 W383 L386 L390 L391 H392 Q396 R397 F398	L369-V394 HydrophobicContact CD2-CG2 3.54Å; V372-V394 HydrophobicContact CG1-CG1 4.28Å; V372-V394 HydrophobicContact CG1-CG2 4.1Å; I373-V394 HydrophobicContact CG1-CG1 4.46Å; W383-V394 HydrophobicContact CD2-CG1 3.68Å; W383-V394 HydrophobicContact CE3-CG1 3.59Å; W383-V394 HydrophobicContact CG-CG1 4.47Å; W383-V394 HydrophobicContact CH2-CG1 3.62Å; W383-V394 HydrophobicContact CZ2-CG1 3.7Å; W383-V394 HydrophobicContact CZ3-CG1 3.57Å; L386-V394 HydrophobicContact CD1-CG2 3.96Å; L390-V394 WeakPolarHBondContact O-CG2 3.34Å; L390-V394 PolarHBondContact O-N 2.89Å; L391-V394 PolarHBondContact O-N 2.62Å; H392-V394 PolarHBondContact O-N 2.64Å; V394-Q396 PolarHBondContact O-N 3.41Å; V394-R397 PolarHBondContact O-N 3.32Å; V394-F398 WeakPolarHBondContact O-CB 3.43Å; V394-F398 PolarHBondContact O-N 3.16Å
395	N	78.8	Confident	67.2	Low	81 Å²	81	75.7 Å²	75.7	43%	0.433	43%	0.43	S	S	.	.	H	α-helix	trans	-63.7	-41	179.4	-73.7	-23.6	0	0	0	112.4	L391 H392 R397 F398 G399	L391-N395 WeakPolarHBondContact O-CB 3.34Å; L391-N395 PolarHBondContact O-N 3.09Å; L391-N395 PolarHBondContact O-ND2 3.48Å; H392-N395 PolarHBondContact O-N 3.45Å; N395-R397 VanDerWaalsContact C-N 3.3Å; N395-R397 PolarHBondContact O-N 3.11Å; N395-F398 PolarHBondContact O-N 2.85Å; N395-G399 PolarHBondContact O-N 3.01Å
396	Q	71.3	Confident	64.4	Low	60 Å²	60	79.9 Å²	79.9	28%	0.28	46%	0.46	S	S	.	.	H	α-helix	trans	-61	-39	176.3	-81.5	-162.1	-5.6	0	0	112.4	T75 H392 V394	T75-Q396 HydrophobicContact CG2-CB 3.67Å; T75-Q396 HydrophobicContact CG2-CG 4.41Å; H392-Q396 PolarHBondContact NE2-NE2 3.08Å; H392-Q396 WeakPolarHBondContact O-CB 3.37Å; H392-Q396 WeakPolarHBondContact O-CG 3.26Å; H392-Q396 PolarHBondContact O-N 2.95Å; V394-Q396 PolarHBondContact O-N 3.41Å
397	R	72.3	Confident	63.3	Low	9 Å²	9	81.5 Å²	81.5	3%	0.034	47%	0.471	C	S	.	.	H	α-helix	trans	-84.9	-26.3	179.2	-67.1	168.2	177.4	-130.3	2.3	113.7	R366 I373 S393 V394 N395 G399 S400	R366-R397 VanDerWaalsContact CD-NH1 3.33Å; I373-R397 HydrophobicContact CD1-CB 3.41Å; I373-R397 VanDerWaalsContact CD1-CB 3.41Å; I373-R397 HydrophobicContact CD1-CG 4.27Å; S393-R397 WeakPolarHBondContact O-CB 3.36Å; S393-R397 WeakPolarHBondContact O-CD 3.4Å; S393-R397 VanDerWaalsContact O-CG 3.27Å; S393-R397 WeakPolarHBondContact O-CG 3.45Å; S393-R397 PolarHBondContact O-N 3.11Å; S393-R397 VanDerWaalsContact O-N 3.13Å; V394-R397 PolarHBondContact O-N 3.32Å; N395-R397 VanDerWaalsContact C-N 3.3Å; N395-R397 PolarHBondContact O-N 3.11Å; R397-G399 PolarHBondContact O-N 3.24Å; R397-S400 PolarHBondContact O-N 3.41Å; R397-S400 PolarHBondContact O-OG 3.32Å
398	F	66.3	Low	62	Low	100 Å²	100	82.1 Å²	82.1	44%	0.439	47%	0.471	S	S	.	.	H	α-helix	trans	-58.3	-39.5	172.4	173.4	-104.2	0	0	0	110.7	K376 W383 V394 N395 S400	K376-F398 HydrophobicContact CD-CD2 4.38Å; K376-F398 HydrophobicContact CD-CE2 3.89Å; W383-F398 HydrophobicContact CH2-CB 4.21Å; W383-F398 AromaticContact CH2-CD2 3.83Å; W383-F398 HydrophobicContact CH2-CD2 3.83Å; W383-F398 HydrophobicContact CH2-CG 4.19Å; W383-F398 HydrophobicContact CZ3-CB 4.24Å; W383-F398 HydrophobicContact CZ3-CD2 4.27Å; W383-F398 HydrophobicContact CZ3-CG 4.24Å; V394-F398 WeakPolarHBondContact O-CB 3.43Å; V394-F398 PolarHBondContact O-N 3.16Å; N395-F398 PolarHBondContact O-N 2.85Å; F398-S400 PolarHBondContact O-N 3.31Å
399	G	58.4	Low	60.8	Low	27 Å²	27	76.1 Å²	76.1	28%	0.278	45%	0.452	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-17.8	174.4	0	0	0	0	0	114.9	R77 N395 R397	R77-G399 VanDerWaalsContact NH2-CA 3.35Å; R77-G399 PolarHBondContact NH2-O 2.89Å; N395-G399 PolarHBondContact O-N 3.01Å; R397-G399 PolarHBondContact O-N 3.24Å
400	S	51.1	Low	59.6	Low	28 Å²	28	73.1 Å²	73.1	20%	0.196	44%	0.444	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.9	-13.5	-173.7	63.3	0	0	0	0	115.2	T75 R397 F398 N402 T403	T75-S400 WeakPolarHBondContact O-CB 3.34Å; R397-S400 PolarHBondContact O-N 3.41Å; R397-S400 PolarHBondContact O-OG 3.32Å; F398-S400 PolarHBondContact O-N 3.31Å; S400-N402 VanDerWaalsContact C-N 3.25Å; S400-N402 PolarHBondContact O-N 3.09Å; S400-N402 VanDerWaalsContact O-N 3.12Å; S400-T403 PolarHBondContact O-OG1 3.07Å
401	N	44.2	Very low	58.2	Low	86 Å²	86	74.9 Å²	74.9	46%	0.46	46%	0.457	S	S	.	.	G	3₁₀ helix	trans	-78.9	10.6	-171	-86.1	9.3	0	0	0	116.3	I373 T403	I373-N401 WeakPolarHBondContact CG2-ND2 2.88Å; N401-T403 VanDerWaalsContact C-N 3.31Å; N401-T403 PolarHBondContact O-N 3.12Å
402	N	37.6	Very low	56.5	Low	161 Å²	161	77.6 Å²	77.6	86%	0.861	48%	0.476	S	S	*	.	G	3₁₀ helix	trans	-85	5.5	174.1	-81.9	1.6	0	0	0	114.2	S400	S400-N402 VanDerWaalsContact C-N 3.25Å; S400-N402 PolarHBondContact O-N 3.09Å; S400-N402 VanDerWaalsContact O-N 3.12Å
403	T	37.1	Very low	54.9	Low	109 Å²	109	75.4 Å²	75.4	67%	0.669	47%	0.474	S	S	*	.	G	3₁₀ helix	trans	-119.4	26.2	-178.4	53.7	0	0	0	0	115.3	L26 S400 N401	L26-T403 HydrophobicContact CD2-CG2 4.11Å; S400-T403 PolarHBondContact O-OG1 3.07Å; N401-T403 VanDerWaalsContact C-N 3.31Å; N401-T403 PolarHBondContact O-N 3.12Å
404	S	35.6	Very low	53.2	Low	102 Å²	102	79.5 Å²	79.5	71%	0.713	50%	0.498	S	S	*	.			trans	-134.4	85.9	164.3	46	0	0	0	0	108.9
405	G	29.1	Very low	50.9	Low	68 Å²	68	86.1 Å²	86.1	70%	0.701	54%	0.54	S	S	*	.			trans	-133.9	118.9	173.5	0	0	0	0	0	109.6
406	S	28.9	Very low	48.3	Very low	202 Å²	202	86.5 Å²	86.5	100%	1.413	55%	0.549	S	S	*	.			trans	63.9	0	174.1	64.5	0	0	0	0	118.4

Retrieved 406 of 406 residues in 561.9 ms (Link to these results)

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