A0A3Q0KFN0_SCHMA Loading...

Putative wd-repeat protein

AlphaFold DB , UniProt , Accession A0A3Q0KFN0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 882 aa.

						>A0A3Q0KFN0_SCHMA|A0A3Q0KFN0
MLENLGMLDSPSGDPNALKKDVSDLMADARKSRKAVFRRTIDYNASAINYLQNRIWVSRDLDRPMLQPDYLWSPKLCPPRSYMDSPMNCVMSKPVRTSTNKNKCPIYCVCWTPEGRRLITGAFSGEFTLWNGLTFNFETILQAHESQIRCMKWSHNEEWLLTADHSGYVKYWQANMNNVEMYQAHKEPIRGVSFCPFDNKFVTCSDDSTVRIWDFHRCAEERVLRGHGSDVRSVAWHPVLSLIISGSKDAQQPIKLWDPKTGESVSTLYVHKNTCTDVSWNDNGNWFLTASRDHLIKLFDLRNLKSELQTFRGHKRDVMRVAWHPFHESLFVSGSADGAIFYWLAGTDTELGAVDNAHESMIWSLAWHPFGHILVSGANDFATKFWTRNRPGDVLKDTISAVGSDNLVQAASATNLLANTYSFGDPEVVDNSLNIDLFKLLTETPISSNRIDTLDDLAFSTNPNDLSTTEIPGLNEGPVTDLNITDTDDPEEREKNKLRSSRTIPKEFAANWASTRITAMPTVMMATPSPSAIAAAAAAAAAAVSNLNATPQYLPPVKPPALNKERLAQRAAPINPSEPEAIVDQIQDRGFCKPNQTPFVEQPIGEMSNGVSTHKYDQPPFSETLPPRGLEQHVPIPEHNVDIRNNTNPSLDWNQRNEELPLQTEHNVPLQTEQPNNIYREPFSGPPQLYNEQENFLEPKPFPRHREDRDYRDHEHSEQFSRPFPENDHYYNGLPGGFNSGSSHGHHNRNVIPSDQMHPGERGRPFSPNVEKYPYDRRGDRPPPMRQNYDEDSWGRRWPDNRNTPDRFDYPQGPPRRPPREHRPPHPDFYPDPRHPLPPNFVPPHKRPPPMGPGGQPPDHMRKYPRQDPSRTKPPWTGYNRW
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	38.3	Very low	38	Very low	231 Å²	231	153.5 Å²	153.5	100%	1.138	86%	0.856	S	S	*	*				0	-22.2	0	-71.6	-158.4	-165	0	0	114.3
2	L	42.5	Very low	38.2	Very low	160 Å²	160	150.5 Å²	150.5	84%	0.838	85%	0.853	S	S	*	*			trans	-92.7	-1.1	178	-90.3	160.3	0	0	0	115
3	E	37.6	Very low	38.7	Very low	182 Å²	182	143.8 Å²	143.8	85%	0.85	84%	0.837	S	S	*	*	S	Bend	trans	-97	-4.8	-173.7	-69.8	166	136	0	0	114.4
4	N	44.7	Very low	39.5	Very low	154 Å²	154	142 Å²	142	82%	0.824	82%	0.823	S	S	*	*			trans	-96	14.6	-175.3	-74	11.2	0	0	0	114.4
5	L	44.1	Very low	40.4	Very low	145 Å²	145	138.4 Å²	138.4	76%	0.759	81%	0.806	S	S	*	*			trans	-98.8	85.4	176.4	-82.4	162.9	0	0	0	110.6	M7	L5-M7 PolarHBondContact O-N 3.02Å
6	G	32.2	Very low	41.2	Very low	83 Å²	83	136.6 Å²	136.6	86%	0.856	79%	0.792	S	S	*	*			trans	-71.5	67.2	176.3	0	0	0	0	0	113.5
7	M	39.2	Very low	41.9	Very low	166 Å²	166	131.5 Å²	131.5	82%	0.818	77%	0.77	S	S	*	*			trans	-127.2	71.4	173.1	-67.7	-123.5	78.9	0	0	110.7	L5	L5-M7 PolarHBondContact O-N 3.02Å
8	L	33.7	Very low	42.2	Very low	172 Å²	172	131.4 Å²	131.4	90%	0.901	77%	0.765	S	S	*	*			trans	-115.7	88.5	164.5	-76.2	177.4	0	0	0	109.2
9	D	32.5	Very low	42.9	Very low	163 Å²	163	132.2 Å²	132.2	87%	0.872	76%	0.758	S	S	*	*			trans	-159.3	71.3	154.5	-116	-12.4	0	0	0	111.3
10	S	38.9	Very low	43.7	Very low	96 Å²	96	132 Å²	132	67%	0.671	75%	0.748	S	S	*	*			trans	-155.4	92.1	164.6	53.3	0	0	0	0	111.2	S12	S10-S12 VanDerWaalsContact C-N 3.29Å; S10-S12 PolarHBondContact O-N 3.15Å
11	P	34.5	Very low	44.1	Very low	137 Å²	137	130.3 Å²	130.3	89%	0.89	74%	0.737	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.9	62.9	-172.6	34.6	-36.4	0	0	0	112.4
12	S	40.1	Very low	45	Very low	117 Å²	117	122.7 Å²	122.7	82%	0.818	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-160	5.7	171.4	58.5	0	0	0	0	116.3	S10	S10-S12 VanDerWaalsContact C-N 3.29Å; S10-S12 PolarHBondContact O-N 3.15Å
13	G	45.2	Very low	45.6	Very low	63 Å²	63	118 Å²	118	65%	0.649	68%	0.684	S	S	*	*			trans	-87.1	120.4	178	0	0	0	0	0	112.6	P15	G13-P15 WeakPolarHBondContact O-CD 3.34Å
14	D	50.1	Low	46.5	Very low	119 Å²	119	113.3 Å²	113.3	64%	0.636	67%	0.665	S	S	*	*			trans	-57.7	120.3	173.9	-109.2	-34.1	0	0	0	110.3	N16 A17	D14-N16 PolarHBondContact O-N 3.22Å; D14-A17 HydrophobicContact CB-CB 4.18Å; D14-A17 WeakPolarHBondContact O-CB 3.48Å; D14-A17 PolarHBondContact O-N 3.39Å
15	P	52	Low	46.9	Very low	88 Å²	88	112 Å²	112	57%	0.571	66%	0.657	S	S	*	*	H	α-helix	trans	-65.4	-13	179.4	26.3	-34.3	0	0	0	112.8	G13 K19	G13-P15 WeakPolarHBondContact O-CD 3.34Å; P15-K19 WeakPolarHBondContact O-CG 3.45Å
16	N	53.7	Low	47.1	Very low	110 Å²	110	110.3 Å²	110.3	59%	0.588	65%	0.647	S	S	*	*	H	α-helix	trans	-78.7	-27.2	170.8	-69.9	-27.4	0	0	0	113.1	D14 K20	D14-N16 PolarHBondContact O-N 3.22Å; N16-K20 WeakPolarHBondContact O-CB 3.42Å; N16-K20 PolarHBondContact O-N 3.4Å
17	A	52.9	Low	47.9	Very low	49 Å²	49	108.1 Å²	108.1	41%	0.405	62%	0.621	S	S	.	*	H	α-helix	trans	-68.4	-48.3	176.4	0	0	0	0	0	110.7	D14 K19 K20 D21	D14-A17 HydrophobicContact CB-CB 4.18Å; D14-A17 WeakPolarHBondContact O-CB 3.48Å; D14-A17 PolarHBondContact O-N 3.39Å; A17-K19 VanDerWaalsContact C-N 3.3Å; A17-K19 PolarHBondContact O-N 3.25Å; A17-K20 WeakPolarHBondContact O-CA 3.38Å; A17-K20 WeakPolarHBondContact O-CB 3.47Å; A17-K20 PolarHBondContact O-N 3.06Å; A17-D21 PolarHBondContact O-N 2.97Å
18	L	48.2	Very low	48.7	Very low	130 Å²	130	104.5 Å²	104.5	68%	0.681	61%	0.605	S	S	*	*	H	α-helix	trans	-60.7	-39.8	176.9	-138.1	96.7	0	0	0	112.2	K20 V22	L18-K20 VanDerWaalsContact C-N 3.31Å; L18-K20 PolarHBondContact O-N 3.4Å; L18-V22 WeakPolarHBondContact O-CB 3.22Å; L18-V22 VanDerWaalsContact O-CG2 3.3Å; L18-V22 WeakPolarHBondContact O-CG2 3.4Å; L18-V22 PolarHBondContact O-N 3.13Å
19	K	54.8	Low	49.8	Very low	147 Å²	147	100.5 Å²	100.5	64%	0.639	60%	0.596	S	S	*	*	H	α-helix	trans	-62.8	-37.8	172.7	-77	176.8	-179.2	176.6	0	112.2	P15 A17 S23	P15-K19 WeakPolarHBondContact O-CG 3.45Å; A17-K19 VanDerWaalsContact C-N 3.3Å; A17-K19 PolarHBondContact O-N 3.25Å; K19-S23 VanDerWaalsContact O-CB 3.29Å; K19-S23 WeakPolarHBondContact O-CB 3.38Å; K19-S23 PolarHBondContact O-N 3.48Å; K19-S23 PolarHBondContact O-OG 3.3Å
20	K	58.1	Low	51.1	Low	127 Å²	127	102.7 Å²	102.7	55%	0.552	59%	0.592	S	S	*	*	H	α-helix	trans	-67.2	-48.8	177.8	-170.8	179.2	176.4	-174	0	111.2	N16 A17 L18 V22 S23 D24	N16-K20 WeakPolarHBondContact O-CB 3.42Å; N16-K20 PolarHBondContact O-N 3.4Å; A17-K20 WeakPolarHBondContact O-CA 3.38Å; A17-K20 WeakPolarHBondContact O-CB 3.47Å; A17-K20 PolarHBondContact O-N 3.06Å; L18-K20 VanDerWaalsContact C-N 3.31Å; L18-K20 PolarHBondContact O-N 3.4Å; K20-V22 VanDerWaalsContact C-N 3.34Å; K20-V22 PolarHBondContact O-N 3.42Å; K20-S23 WeakPolarHBondContact CA-OG 3.48Å; K20-S23 CarbonylContact O-C 3.52Å; K20-S23 WeakPolarHBondContact O-CA 3.44Å; K20-S23 WeakPolarHBondContact O-CB 2.95Å; K20-S23 PolarHBondContact O-N 3.42Å; K20-S23 PolarHBondContact O-OG 2.97Å; K20-D24 PolarHBondContact O-N 3.4Å
21	D	53.8	Low	52.7	Low	97 Å²	97	104.3 Å²	104.3	52%	0.519	59%	0.587	S	S	.	*	H	α-helix	trans	-60.2	-42.7	178.4	-66.5	-21.2	0	0	0	111.8	A17 S23 D24 L25	A17-D21 PolarHBondContact O-N 2.97Å; D21-S23 VanDerWaalsContact C-N 3.34Å; D21-S23 PolarHBondContact O-N 2.92Å; D21-D24 PolarHBondContact O-N 3.35Å; D21-L25 WeakPolarHBondContact O-CB 3.31Å; D21-L25 WeakPolarHBondContact O-CG 3.49Å; D21-L25 PolarHBondContact O-N 2.83Å
22	V	56	Low	54.5	Low	72 Å²	72	103.6 Å²	103.6	44%	0.436	59%	0.586	S	S	.	*	H	α-helix	trans	-64	-38.6	172.8	173.5	0	0	0	0	111.3	L18 K20 M26	L18-V22 WeakPolarHBondContact O-CB 3.22Å; L18-V22 VanDerWaalsContact O-CG2 3.3Å; L18-V22 WeakPolarHBondContact O-CG2 3.4Å; L18-V22 PolarHBondContact O-N 3.13Å; K20-V22 VanDerWaalsContact C-N 3.34Å; K20-V22 PolarHBondContact O-N 3.42Å; V22-M26 HydrophobicContact CG1-CE 4.16Å; V22-M26 WeakPolarHBondContact O-CB 3.38Å; V22-M26 WeakPolarHBondContact O-CG 3.46Å; V22-M26 PolarHBondContact O-N 2.93Å
23	S	54.3	Low	56.4	Low	62 Å²	62	108.2 Å²	108.2	43%	0.434	59%	0.585	S	S	.	*	H	α-helix	trans	-68.1	-37.5	176.9	78.6	0	0	0	0	113	K19 K20 D21 M26 A27	K19-S23 VanDerWaalsContact O-CB 3.29Å; K19-S23 WeakPolarHBondContact O-CB 3.38Å; K19-S23 PolarHBondContact O-N 3.48Å; K19-S23 PolarHBondContact O-OG 3.3Å; K20-S23 WeakPolarHBondContact CA-OG 3.48Å; K20-S23 CarbonylContact O-C 3.52Å; K20-S23 WeakPolarHBondContact O-CA 3.44Å; K20-S23 WeakPolarHBondContact O-CB 2.95Å; K20-S23 PolarHBondContact O-N 3.42Å; K20-S23 PolarHBondContact O-OG 2.97Å; D21-S23 VanDerWaalsContact C-N 3.34Å; D21-S23 PolarHBondContact O-N 2.92Å; S23-M26 PolarHBondContact O-N 3.07Å; S23-A27 VanDerWaalsContact O-CB 3.3Å; S23-A27 WeakPolarHBondContact O-CB 3.45Å; S23-A27 PolarHBondContact O-N 3Å
24	D	57.1	Low	58.4	Low	83 Å²	83	114 Å²	114	44%	0.444	59%	0.593	S	S	.	*	H	α-helix	trans	-71.9	-39.7	178.4	-75.8	-26.5	0	0	0	110.6	K20 D21 M26 A27 D28	K20-D24 PolarHBondContact O-N 3.4Å; D21-D24 PolarHBondContact O-N 3.35Å; D24-M26 PolarHBondContact O-N 3.47Å; D24-A27 PolarHBondContact O-N 3.38Å; D24-D28 PolarHBondContact O-N 3.4Å
25	L	54.1	Low	60.1	Low	127 Å²	127	113.6 Å²	113.6	67%	0.665	61%	0.605	S	S	*	*	H	α-helix	trans	-61	-41.6	170.1	-76.8	166	0	0	0	112.5	D21 A29	D21-L25 WeakPolarHBondContact O-CB 3.31Å; D21-L25 WeakPolarHBondContact O-CG 3.49Å; D21-L25 PolarHBondContact O-N 2.83Å; L25-A29 PolarHBondContact O-N 3.09Å
26	M	48.7	Very low	61.7	Low	108 Å²	108	114.5 Å²	114.5	53%	0.532	61%	0.609	S	S	.	*	H	α-helix	trans	-70.3	-33.5	173.9	-74.6	-166.1	-178.2	0	0	112.7	V22 S23 D24 A29 R30	V22-M26 HydrophobicContact CG1-CE 4.16Å; V22-M26 WeakPolarHBondContact O-CB 3.38Å; V22-M26 WeakPolarHBondContact O-CG 3.46Å; V22-M26 PolarHBondContact O-N 2.93Å; S23-M26 PolarHBondContact O-N 3.07Å; D24-M26 PolarHBondContact O-N 3.47Å; M26-A29 PolarHBondContact O-N 2.96Å; M26-R30 WeakPolarHBondContact O-CG 3.22Å; M26-R30 PolarHBondContact O-N 3.36Å
27	A	47.9	Very low	63.1	Low	38 Å²	38	119.3 Å²	119.3	31%	0.314	63%	0.625	S	S	.	*	H	α-helix	trans	-65.9	-42.8	175.9	0	0	0	0	0	111.2	S23 D24 A29 R30 K31	S23-A27 VanDerWaalsContact O-CB 3.3Å; S23-A27 WeakPolarHBondContact O-CB 3.45Å; S23-A27 PolarHBondContact O-N 3Å; D24-A27 PolarHBondContact O-N 3.38Å; A27-A29 VanDerWaalsContact C-N 3.28Å; A27-A29 PolarHBondContact O-N 2.96Å; A27-R30 PolarHBondContact O-N 2.89Å; A27-K31 WeakPolarHBondContact O-CG 3.45Å; A27-K31 PolarHBondContact O-N 3.27Å
28	D	56.1	Low	64.6	Low	90 Å²	90	124.2 Å²	124.2	48%	0.481	63%	0.633	S	S	.	*	H	α-helix	trans	-65	-28.5	176.7	-99.1	13.9	0	0	0	113.9	D24 K31	D24-D28 PolarHBondContact O-N 3.4Å; D28-K31 WeakPolarHBondContact OD1-CE 3.48Å; D28-K31 IonicContact OD1-NZ 3.7Å; D28-K31 PolarHBondContact OD1-NZ 3.46Å
29	A	57.8	Low	66.4	Low	88 Å²	88	125.7 Å²	125.7	73%	0.727	63%	0.63	S	S	*	*	H	α-helix	trans	-75.2	-27.2	171.6	0	0	0	0	0	113.1	L25 M26 A27	L25-A29 PolarHBondContact O-N 3.09Å; M26-A29 PolarHBondContact O-N 2.96Å; A27-A29 VanDerWaalsContact C-N 3.28Å; A27-A29 PolarHBondContact O-N 2.96Å
30	R	57.9	Low	68.1	Low	208 Å²	208	122.2 Å²	122.2	79%	0.785	62%	0.621	S	S	*	*	H	α-helix	trans	-92.4	-13.6	-178.7	-71.9	179.5	179.7	-177.5	1	114.6	M26 A27 S32	M26-R30 WeakPolarHBondContact O-CG 3.22Å; M26-R30 PolarHBondContact O-N 3.36Å; A27-R30 PolarHBondContact O-N 2.89Å; R30-S32 PolarHBondContact O-N 2.8Å; R30-S32 VanDerWaalsContact O-N 3.08Å
31	K	73.4	Confident	69.6	Low	131 Å²	131	116.7 Å²	116.7	57%	0.57	60%	0.597	S	S	*	*	S	Bend	trans	-62.3	109.2	173.2	-76.6	169.1	-168.8	167.3	0	110.1	A27 D28	A27-K31 WeakPolarHBondContact O-CG 3.45Å; A27-K31 PolarHBondContact O-N 3.27Å; D28-K31 WeakPolarHBondContact OD1-CE 3.48Å; D28-K31 IonicContact OD1-NZ 3.7Å; D28-K31 PolarHBondContact OD1-NZ 3.46Å
32	S	71.8	Confident	71.4	Confident	122 Å²	122	115.8 Å²	115.8	85%	0.853	59%	0.592	S	S	*	*			trans	-59.8	138.1	173.6	54.1	0	0	0	0	110.3	R30	R30-S32 PolarHBondContact O-N 2.8Å; R30-S32 VanDerWaalsContact O-N 3.08Å
33	R	80.2	Confident	73.2	Confident	214 Å²	214	114.6 Å²	114.6	81%	0.808	58%	0.58	S	S	*	*			trans	-108.1	145.4	179.8	-61.6	-175.9	-177.2	-157.1	-3.3	109.3
34	K	87.8	Confident	75	Confident	185 Å²	185	115.1 Å²	115.1	80%	0.804	58%	0.578	S	S	*	*			trans	-56.9	143.8	171.2	-63.8	179.4	-178.7	175.8	0	109.6	V36	K34-V36 PolarHBondContact O-N 3.43Å
35	A	85.2	Confident	76.7	Confident	109 Å²	109	113.7 Å²	113.7	90%	0.901	58%	0.578	S	S	*	*			trans	-64.9	131.1	169.4	0	0	0	0	0	109.3
36	V	85.9	Confident	78.5	Confident	107 Å²	107	108.1 Å²	108.1	65%	0.648	55%	0.549	S	S	*	.			trans	-133	125.3	-177.1	174.4	0	0	0	0	108.4	K34 R38	K34-V36 PolarHBondContact O-N 3.43Å; V36-R38 WeakPolarHBondContact O-CG 3.43Å; V36-R38 PolarHBondContact O-N 3.1Å
37	F	82.8	Confident	80.6	Confident	211 Å²	211	104 Å²	104	93%	0.925	53%	0.533	S	S	*	.			trans	-63.8	131.4	170.7	-72.1	-79.9	0	0	0	110
38	R	84.1	Confident	82.9	Confident	153 Å²	153	106.5 Å²	106.5	58%	0.577	54%	0.54	S	S	*	.			trans	-111.3	136	-171.8	-54.3	-169.9	-179.2	164.3	-1.2	110	V36 T40 N136	V36-R38 WeakPolarHBondContact O-CG 3.43Å; V36-R38 PolarHBondContact O-N 3.1Å; R38-T40 PolarHBondContact O-N 3.5Å; R38-T40 VanDerWaalsContact O-N 3.14Å; R38-T40 PolarHBondContact O-OG1 3.03Å; R38-N136 WeakPolarHBondContact CD-ND2 3.31Å; R38-N136 VanDerWaalsContact CD-OD1 3.31Å; R38-N136 WeakPolarHBondContact CD-OD1 3.27Å; R38-N136 PolarHBondContact NH1-ND2 3.41Å; R38-N136 PolarHBondContact NH1-OD1 3.33Å
39	R	86.5	Confident	84.6	Confident	161 Å²	161	103.7 Å²	103.7	61%	0.608	53%	0.525	S	S	*	.			trans	-54.2	121.4	168.6	-67	-175.1	-176.5	172.2	0.1	108.4	V95	R39-V95 PolarHBondContact NH1-O 2.85Å
40	T	90	Very high	86.2	Confident	73 Å²	73	102.4 Å²	102.4	45%	0.448	50%	0.501	S	S	.	.			trans	-130.3	133.7	-173.1	-59.7	0	0	0	0	107.7	R38 L133 T134	R38-T40 PolarHBondContact O-N 3.5Å; R38-T40 VanDerWaalsContact O-N 3.14Å; R38-T40 PolarHBondContact O-OG1 3.03Å; T40-L133 WeakPolarHBondContact CA-O 3.15Å; T40-T134 HydrophobicContact CG2-CG2 3.96Å
41	I	91.1	Very high	87.9	Confident	11 Å²	11	97.5 Å²	97.5	6%	0.056	49%	0.49	C	S	.	.			trans	-110.9	98.2	171.6	-63.9	-175.2	0	0	0	107	V95 L133 F135 I373 T387	I41-V95 HydrophobicContact CD1-CB 4.02Å; I41-V95 HydrophobicContact CD1-CG1 3.43Å; I41-V95 VanDerWaalsContact CD1-CG1 3.43Å; I41-V95 HydrophobicContact CD1-CG2 3.36Å; I41-V95 HydrophobicContact CG1-CG1 3.97Å; I41-L133 PolarHBondContact N-O 3.45Å; I41-L133 WeakPolarHBondContact O-CD2 3.32Å; I41-F135 HydrophobicContact CB-CE2 4.18Å; I41-F135 HydrophobicContact CB-CZ 4.12Å; I41-F135 HydrophobicContact CD1-CE2 4.24Å; I41-F135 HydrophobicContact CD1-CZ 4.28Å; I41-F135 HydrophobicContact CG1-CE2 4.04Å; I41-F135 HydrophobicContact CG1-CZ 4.31Å; I41-I373 HydrophobicContact CB-CD1 4.3Å; I41-I373 HydrophobicContact CG2-CD1 4.04Å; I41-I373 HydrophobicContact CG2-CG1 4.29Å; I41-T387 HydrophobicContact CD1-CG2 3.54Å
42	D	91.2	Very high	88.8	Confident	78 Å²	78	96.5 Å²	96.5	42%	0.417	49%	0.488	S	S	.	.			trans	-90.1	119.4	175	-170.2	9.2	0	0	0	110.4	N44	D42-N44 VanDerWaalsContact OD1-CB 3.22Å; D42-N44 WeakPolarHBondContact OD1-CB 3.22Å; D42-N44 VanDerWaalsContact OD1-CG 3.32Å; D42-N44 PolarHBondContact OD1-N 3.15Å; D42-N44 PolarHBondContact OD1-ND2 3.4Å
43	Y	92.6	Very high	89.7	Confident	48 Å²	48	92.4 Å²	92.4	19%	0.188	46%	0.456	C	S	.	.	S	Bend	trans	-84.7	-16.1	172.5	57.2	-97.4	0	0	0	112.8	A45 S46 A47 L133 H368 F370 H372	Y43-A45 VanDerWaalsContact C-N 3.34Å; Y43-A45 PolarHBondContact O-N 3.25Å; Y43-S46 PolarHBondContact O-N 3.09Å; Y43-S46 PolarHBondContact O-OG 3.36Å; Y43-A47 PolarHBondContact O-N 3.47Å; Y43-L133 HydrophobicContact CD1-CD2 3.75Å; Y43-L133 HydrophobicContact CE1-CD2 3.5Å; Y43-L133 VanDerWaalsContact CE1-CD2 3.5Å; Y43-L133 HydrophobicContact CE1-CG 4.39Å; Y43-H368 AromaticContact CE1-NE2 3.68Å; Y43-H368 AromaticContact CZ-NE2 3.92Å; Y43-F370 HydrophobicContact CD2-CD1 4.19Å; Y43-F370 HydrophobicContact CD2-CE1 4.22Å; Y43-F370 HydrophobicContact CG-CD1 4.08Å; Y43-F370 HydrophobicContact CG-CE1 4.34Å; Y43-H372 AromaticContact CD1-CE1 3.49Å; Y43-H372 VanDerWaalsContact CD1-CE1 3.49Å; Y43-H372 WeakPolarHBondContact CD1-CE1 3.41Å; Y43-H372 AromaticContact CD1-NE2 3.61Å; Y43-H372 AromaticContact CG-CE1 3.91Å
44	N	93.9	Very high	90.2	Very high	73 Å²	73	90.3 Å²	90.3	39%	0.39	45%	0.448	S	S	.	.	H	α-helix	trans	-60	-42.5	-177.4	-66.5	-65.7	0	0	0	111.7	D42 S46 A47 I48	D42-N44 VanDerWaalsContact OD1-CB 3.22Å; D42-N44 WeakPolarHBondContact OD1-CB 3.22Å; D42-N44 VanDerWaalsContact OD1-CG 3.32Å; D42-N44 PolarHBondContact OD1-N 3.15Å; D42-N44 PolarHBondContact OD1-ND2 3.4Å; N44-S46 VanDerWaalsContact C-N 3.32Å; N44-S46 PolarHBondContact O-N 3.22Å; N44-A47 PolarHBondContact O-N 3.48Å; N44-A47 VanDerWaalsContact O-N 3.15Å; N44-I48 VanDerWaalsContact O-CG1 3.29Å; N44-I48 WeakPolarHBondContact O-CG1 3.48Å; N44-I48 PolarHBondContact O-N 2.92Å
45	A	91.8	Very high	90.4	Very high	52 Å²	52	88.5 Å²	88.5	43%	0.43	45%	0.446	S	S	.	.	H	α-helix	trans	-54.9	-47	173.3	0	0	0	0	0	112	Y43 A47 I48 N49	Y43-A45 VanDerWaalsContact C-N 3.34Å; Y43-A45 PolarHBondContact O-N 3.25Å; A45-A47 PolarHBondContact O-N 3.33Å; A45-I48 PolarHBondContact O-N 3.49Å; A45-N49 VanDerWaalsContact O-CG 3.27Å; A45-N49 PolarHBondContact O-N 3.45Å; A45-N49 VanDerWaalsContact O-N 3.07Å; A45-N49 PolarHBondContact O-ND2 2.66Å
46	S	91.9	Very high	90.7	Very high	10 Å²	10	90.1 Å²	90.1	7%	0.07	43%	0.429	C	S	.	.	H	α-helix	trans	-66.7	-36.2	177.6	73.7	0	0	0	0	113	Y43 N44 N49 Y50 L76 P78	Y43-S46 PolarHBondContact O-N 3.09Å; Y43-S46 PolarHBondContact O-OG 3.36Å; N44-S46 VanDerWaalsContact C-N 3.32Å; N44-S46 PolarHBondContact O-N 3.22Å; S46-N49 PolarHBondContact O-N 3.46Å; S46-Y50 PolarHBondContact O-N 2.84Å; S46-Y50 VanDerWaalsContact O-N 3.09Å; S46-L76 VanDerWaalsContact CA-O 3.29Å; S46-L76 WeakPolarHBondContact CA-O 3.45Å; S46-L76 WeakPolarHBondContact CB-O 3.47Å; S46-P78 WeakPolarHBondContact O-CD 3.36Å
47	A	93.3	Very high	90.7	Very high	23 Å²	23	86.4 Å²	86.4	19%	0.19	41%	0.406	C	S	.	.	H	α-helix	trans	-66.7	-41.1	176.2	0	0	0	0	0	111.8	Y43 N44 A45 Y50 L51 F370	Y43-A47 PolarHBondContact O-N 3.47Å; N44-A47 PolarHBondContact O-N 3.48Å; N44-A47 VanDerWaalsContact O-N 3.15Å; A45-A47 PolarHBondContact O-N 3.33Å; A47-Y50 PolarHBondContact O-N 2.96Å; A47-L51 WeakPolarHBondContact O-CG 3.39Å; A47-L51 PolarHBondContact O-N 2.81Å; A47-F370 HydrophobicContact CB-CZ 4Å
48	I	95.3	Very high	90.8	Very high	89 Å²	89	81.5 Å²	81.5	46%	0.456	40%	0.398	S	S	.	.	H	α-helix	trans	-61.9	-47	175.2	-68.2	163.2	0	0	0	110.5	N44 A45 Y50 L51 Q52	N44-I48 VanDerWaalsContact O-CG1 3.29Å; N44-I48 WeakPolarHBondContact O-CG1 3.48Å; N44-I48 PolarHBondContact O-N 2.92Å; A45-I48 PolarHBondContact O-N 3.49Å; I48-Y50 VanDerWaalsContact C-N 3.29Å; I48-Y50 PolarHBondContact O-N 3.31Å; I48-L51 PolarHBondContact O-N 2.73Å; I48-Q52 WeakPolarHBondContact O-CG 3.21Å; I48-Q52 PolarHBondContact O-N 3.03Å
49	N	92	Very high	90.8	Very high	31 Å²	31	82.6 Å²	82.6	17%	0.166	40%	0.403	C	S	.	.	H	α-helix	trans	-56.1	-43.8	175.2	-66.8	-25	0	0	0	112	A45 S46 Q52 N53 P74 L76	A45-N49 VanDerWaalsContact O-CG 3.27Å; A45-N49 PolarHBondContact O-N 3.45Å; A45-N49 VanDerWaalsContact O-N 3.07Å; A45-N49 PolarHBondContact O-ND2 2.66Å; S46-N49 PolarHBondContact O-N 3.46Å; N49-Q52 PolarHBondContact O-N 2.81Å; N49-N53 WeakPolarHBondContact O-CB 3.44Å; N49-N53 VanDerWaalsContact O-CG 3.23Å; N49-N53 PolarHBondContact O-N 3.13Å; N49-N53 PolarHBondContact O-ND2 3.15Å; N49-P74 PolarHBondContact ND2-O 2.97Å; N49-L76 PolarHBondContact ND2-O 2.92Å
50	Y	91.8	Very high	90.5	Very high	61 Å²	61	78.7 Å²	78.7	24%	0.239	39%	0.394	C	S	.	.	H	α-helix	trans	-65.1	-41.6	177.3	170.4	-110.2	0	0	0	112.8	S46 A47 I48 Q52 N53 R54 P78	S46-Y50 PolarHBondContact O-N 2.84Å; S46-Y50 VanDerWaalsContact O-N 3.09Å; A47-Y50 PolarHBondContact O-N 2.96Å; I48-Y50 VanDerWaalsContact C-N 3.29Å; I48-Y50 PolarHBondContact O-N 3.31Å; Y50-Q52 VanDerWaalsContact C-N 3.31Å; Y50-Q52 PolarHBondContact O-N 2.89Å; Y50-N53 PolarHBondContact O-N 3.45Å; Y50-R54 VanDerWaalsContact O-CB 3.25Å; Y50-R54 WeakPolarHBondContact O-CB 3.37Å; Y50-R54 PolarHBondContact O-N 3.25Å; Y50-P78 VanDerWaalsContact CB-CD 3.47Å; Y50-P78 HydrophobicContact CD1-CG 4.43Å; Y50-P78 HydrophobicContact CG-CG 4.09Å
51	L	93.6	Very high	90.3	Very high	106 Å²	106	82.7 Å²	82.7	56%	0.555	41%	0.412	S	S	*	.	H	α-helix	trans	-63.7	-36.9	175.4	-69.8	173.4	0	0	0	112	A47 I48	A47-L51 WeakPolarHBondContact O-CG 3.39Å; A47-L51 PolarHBondContact O-N 2.81Å; I48-L51 PolarHBondContact O-N 2.73Å
52	Q	92.8	Very high	90	Very high	109 Å²	109	85.8 Å²	85.8	51%	0.509	43%	0.428	S	S	.	.	H	α-helix	trans	-68.1	-45.8	173.6	-70.3	175	-7.2	0	0	112	I48 N49 Y50 I55 W56	I48-Q52 WeakPolarHBondContact O-CG 3.21Å; I48-Q52 PolarHBondContact O-N 3.03Å; N49-Q52 PolarHBondContact O-N 2.81Å; Y50-Q52 VanDerWaalsContact C-N 3.31Å; Y50-Q52 PolarHBondContact O-N 2.89Å; Q52-I55 PolarHBondContact O-N 2.93Å; Q52-W56 VanDerWaalsContact O-CD1 3.32Å; Q52-W56 PolarHBondContact O-NE1 2.68Å
53	N	90.8	Very high	89.8	Confident	37 Å²	37	84.3 Å²	84.3	20%	0.198	42%	0.417	C	S	.	.	H	α-helix	trans	-66.1	-38.5	-179.7	-72.6	-15.5	0	0	0	112.4	N49 Y50 I55 W56 V57 C77	N49-N53 WeakPolarHBondContact O-CB 3.44Å; N49-N53 VanDerWaalsContact O-CG 3.23Å; N49-N53 PolarHBondContact O-N 3.13Å; N49-N53 PolarHBondContact O-ND2 3.15Å; Y50-N53 PolarHBondContact O-N 3.45Å; N53-I55 PolarHBondContact O-N 2.88Å; N53-W56 PolarHBondContact O-N 2.89Å; N53-W56 WeakPolarHBondContact OD1-CZ2 3.35Å; N53-V57 HydrophobicContact CB-CG2 4.13Å; N53-V57 WeakPolarHBondContact O-CB 3.29Å; N53-V57 WeakPolarHBondContact O-CG2 3.42Å; N53-V57 PolarHBondContact O-N 3.27Å; N53-C77 PolarHBondContact ND2-SG 3.19Å
54	R	90.1	Very high	89.4	Confident	169 Å²	169	84.8 Å²	84.8	64%	0.638	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-19	179.6	-175.8	176	179.7	-153.4	-1.4	114.3	Y50 W56	Y50-R54 VanDerWaalsContact O-CB 3.25Å; Y50-R54 WeakPolarHBondContact O-CB 3.37Å; Y50-R54 PolarHBondContact O-N 3.25Å; R54-W56 VanDerWaalsContact C-N 3.28Å; R54-W56 PolarHBondContact O-N 2.63Å
55	I	91.8	Very high	89	Confident	148 Å²	148	87.9 Å²	87.9	76%	0.759	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69	-28.8	178	-60.8	171.3	0	0	0	111.4	Q52 N53	Q52-I55 PolarHBondContact O-N 2.93Å; N53-I55 PolarHBondContact O-N 2.88Å
56	W	90.6	Very high	88.8	Confident	142 Å²	142	87.2 Å²	87.2	54%	0.538	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	-133.7	-18.8	-169.6	60.5	-92.5	0	0	0	114.8	Q52 N53 R54 S58 P64	Q52-W56 VanDerWaalsContact O-CD1 3.32Å; Q52-W56 PolarHBondContact O-NE1 2.68Å; N53-W56 PolarHBondContact O-N 2.89Å; N53-W56 WeakPolarHBondContact OD1-CZ2 3.35Å; R54-W56 VanDerWaalsContact C-N 3.28Å; R54-W56 PolarHBondContact O-N 2.63Å; W56-S58 PolarHBondContact O-N 3.19Å; W56-P64 VanDerWaalsContact CH2-CD 3.48Å; W56-P64 HydrophobicContact CH2-CG 3.5Å; W56-P64 VanDerWaalsContact CH2-CG 3.5Å; W56-P64 HydrophobicContact CZ2-CG 4.23Å; W56-P64 HydrophobicContact CZ3-CG 4.44Å
57	V	87.5	Confident	88.7	Confident	29 Å²	29	90.7 Å²	90.7	18%	0.176	44%	0.444	C	S	.	.			trans	-80.2	107.5	168.5	176.9	0	0	0	0	108.2	N53 R59 D62 R63	N53-V57 HydrophobicContact CB-CG2 4.13Å; N53-V57 WeakPolarHBondContact O-CB 3.29Å; N53-V57 WeakPolarHBondContact O-CG2 3.42Å; N53-V57 PolarHBondContact O-N 3.27Å; V57-R59 WeakPolarHBondContact CG1-O 3.19Å; V57-D62 HydrophobicContact CG1-CB 4.25Å; V57-R63 HydrophobicContact CG1-CB 4.11Å
58	S	84.6	Confident	88.6	Confident	108 Å²	108	94.5 Å²	94.5	76%	0.755	47%	0.467	S	S	*	.			trans	-91.2	-28.5	178	-175.1	0	0	0	0	112.7	W56 D62	W56-S58 PolarHBondContact O-N 3.19Å; S58-D62 PolarHBondContact N-OD2 2.8Å
59	R	83.5	Confident	88.3	Confident	177 Å²	177	93.7 Å²	93.7	67%	0.668	46%	0.463	S	S	*	.	S	Bend	trans	-132.6	154.8	178.7	-62.1	178.1	173.3	-171.5	-4.8	109.2	V57 L61 D62	V57-R59 WeakPolarHBondContact CG1-O 3.19Å; R59-L61 PolarHBondContact O-N 2.97Å; R59-L61 VanDerWaalsContact O-N 3.09Å; R59-D62 PolarHBondContact N-OD2 3.06Å; R59-D62 WeakPolarHBondContact O-CB 3.47Å; R59-D62 PolarHBondContact O-N 3.17Å
60	D	80.7	Confident	88.1	Confident	78 Å²	78	97.5 Å²	97.5	42%	0.417	48%	0.476	S	S	.	.	G	3₁₀ helix	trans	-59.5	-25.5	178.1	-60.9	-46.2	0	0	0	112.8	D62 R63 D84	D60-D62 VanDerWaalsContact C-N 3.32Å; D60-D62 PolarHBondContact O-N 2.86Å; D60-R63 VanDerWaalsContact O-CB 3.24Å; D60-R63 WeakPolarHBondContact O-CB 3.25Å; D60-R63 PolarHBondContact O-N 3.15Å; D60-D84 HydrophobicContact CB-CB 4.42Å
61	L	84.6	Confident	88	Confident	158 Å²	158	100.8 Å²	100.8	83%	0.827	50%	0.497	S	S	*	.	G	3₁₀ helix	trans	-67	-24.9	173.1	-66.5	167.4	0	0	0	114.1	R59 R63	R59-L61 PolarHBondContact O-N 2.97Å; R59-L61 VanDerWaalsContact O-N 3.09Å; L61-R63 VanDerWaalsContact C-N 3.29Å
62	D	85.2	Confident	87.7	Confident	76 Å²	76	98.8 Å²	98.8	41%	0.406	48%	0.482	S	S	.	.	G	3₁₀ helix	trans	-82.7	-10.7	179.5	-49.8	-39	0	0	0	112	V57 S58 R59 D60	V57-D62 HydrophobicContact CG1-CB 4.25Å; S58-D62 PolarHBondContact N-OD2 2.8Å; R59-D62 PolarHBondContact N-OD2 3.06Å; R59-D62 WeakPolarHBondContact O-CB 3.47Å; R59-D62 PolarHBondContact O-N 3.17Å; D60-D62 VanDerWaalsContact C-N 3.32Å; D60-D62 PolarHBondContact O-N 2.86Å
63	R	86.8	Confident	87.5	Confident	46 Å²	46	94.4 Å²	94.4	17%	0.174	46%	0.464	C	S	.	.	S	Bend	trans	-71.3	133	-176.6	-175.6	-171.6	63.7	-141.6	-7.8	110.3	V57 D60 L61 M65 S81 Y82 D84	V57-R63 HydrophobicContact CG1-CB 4.11Å; D60-R63 VanDerWaalsContact O-CB 3.24Å; D60-R63 WeakPolarHBondContact O-CB 3.25Å; D60-R63 PolarHBondContact O-N 3.15Å; L61-R63 VanDerWaalsContact C-N 3.29Å; R63-M65 PolarHBondContact O-N 3.19Å; R63-S81 PolarHBondContact NH1-O 2.98Å; R63-Y82 VanDerWaalsContact CZ-CD1 3.45Å; R63-D84 IonicContact CZ-OD1 2.72Å; R63-D84 IonicContact CZ-OD2 3.56Å; R63-D84 IonicContact NH1-OD1 2.8Å; R63-D84 PolarHBondContact NH1-OD1 3.26Å; R63-D84 IonicContact NH1-OD2 3.45Å; R63-D84 IonicContact NH2-OD1 3.56Å; R63-D84 PolarHBondContact NH2-OD1 3.29Å; R63-D84 IonicContact NH2-OD2 3.66Å; R63-D84 PolarHBondContact NH2-OD2 2.81Å
64	P	84.7	Confident	87.4	Confident	59 Å²	59	97.1 Å²	97.1	38%	0.383	48%	0.483	S	S	.	.	P	Polyproline II helix	trans	-56.3	128.1	172.2	-26.2	35.4	0	0	0	111.8	W56 L66	W56-P64 VanDerWaalsContact CH2-CD 3.48Å; W56-P64 HydrophobicContact CH2-CG 3.5Å; W56-P64 VanDerWaalsContact CH2-CG 3.5Å; W56-P64 HydrophobicContact CZ2-CG 4.23Å; W56-P64 HydrophobicContact CZ3-CG 4.44Å; P64-L66 PolarHBondContact O-N 3.28Å
65	M	85.5	Confident	87.3	Confident	138 Å²	138	94.2 Å²	94.2	68%	0.68	48%	0.475	S	S	*	.	P	Polyproline II helix	trans	-61.3	128.9	168.7	-176.8	-179.4	169.3	0	0	109.4	R63 Q67 W72	R63-M65 PolarHBondContact O-N 3.19Å; M65-Q67 PolarHBondContact O-N 3.45Å; M65-W72 WeakPolarHBondContact O-CZ3 3.48Å
66	L	88.2	Confident	87.3	Confident	37 Å²	37	87.5 Å²	87.5	19%	0.194	44%	0.441	C	S	.	.	P	Polyproline II helix	trans	-72.3	122.4	169.2	-68.3	-179.4	0	0	0	108.8	P64 W72 K75 L76 Y82 P391	P64-L66 PolarHBondContact O-N 3.28Å; L66-W72 HydrophobicContact CD2-CE3 4.1Å; L66-K75 HydrophobicContact CD2-CB 4.02Å; L66-L76 HydrophobicContact CD1-CD1 3.52Å; L66-Y82 VanDerWaalsContact CD1-OH 3.24Å; L66-Y82 WeakPolarHBondContact CD1-OH 3.45Å; L66-P391 HydrophobicContact CD1-CG 4.36Å
67	Q	90.4	Very high	87.3	Confident	84 Å²	84	80.9 Å²	80.9	39%	0.393	42%	0.416	S	S	.	.	P	Polyproline II helix	trans	-71.8	146	170.9	-61.7	-59.9	-37.8	0	0	110	M65 D69 W72 P391	M65-Q67 PolarHBondContact O-N 3.45Å; Q67-D69 PolarHBondContact O-N 2.86Å; Q67-W72 HydrophobicContact CB-CD2 3.95Å; Q67-W72 HydrophobicContact CB-CG 4Å; Q67-W72 HydrophobicContact CB-CZ2 4.33Å; Q67-W72 HydrophobicContact CG-CD2 4.16Å; Q67-W72 HydrophobicContact CG-CH2 4.19Å; Q67-W72 HydrophobicContact CG-CZ2 3.69Å; Q67-P391 WeakPolarHBondContact O-CB 3.22Å
68	P	89.2	Confident	87.5	Confident	103 Å²	103	79.6 Å²	79.6	67%	0.669	41%	0.408	S	S	*	.	S	Bend	trans	-77.8	53.6	-178.8	34.6	-37.4	0	0	0	111.9	G392	P68-G392 VanDerWaalsContact O-CA 3.3Å; P68-G392 WeakPolarHBondContact O-CA 3.41Å; P68-G392 PolarHBondContact O-N 2.86Å
69	D	89.6	Confident	87.7	Confident	71 Å²	71	74.4 Å²	74.4	38%	0.38	37%	0.372	S	S	.	.	S	Bend	trans	-134.8	146	-177.2	171.8	37.5	0	0	0	110.7	Q67 L71 W72 P391	Q67-D69 PolarHBondContact O-N 2.86Å; D69-L71 PolarHBondContact O-N 3.14Å; D69-L71 WeakPolarHBondContact OD2-CB 3.4Å; D69-L71 WeakPolarHBondContact OD2-CD1 3.37Å; D69-L71 WeakPolarHBondContact OD2-CG 3.44Å; D69-W72 WeakPolarHBondContact O-CB 3.3Å; D69-W72 PolarHBondContact O-N 3.43Å; D69-P391 CarbonylContact C-O 3.59Å
70	Y	87.5	Confident	87.9	Confident	111 Å²	111	72.9 Å²	72.9	44%	0.435	37%	0.366	S	S	.	.	G	3₁₀ helix	trans	-59.8	-31.9	-173.5	-173.4	-100.9	0	0	0	112.8	W72 S73 P391	Y70-W72 PolarHBondContact O-N 3.31Å; Y70-S73 WeakPolarHBondContact O-CB 3.49Å; Y70-S73 PolarHBondContact O-N 3.17Å; Y70-P391 WeakPolarHBondContact CA-O 3.33Å; Y70-P391 PolarHBondContact N-O 3.03Å
71	L	89.6	Confident	88.3	Confident	131 Å²	131	69.6 Å²	69.6	69%	0.686	35%	0.35	S	S	*	.	G	3₁₀ helix	trans	-59.7	-17.4	175.4	-61.3	176.7	0	0	0	113.5	D69 P74	D69-L71 PolarHBondContact O-N 3.14Å; D69-L71 WeakPolarHBondContact OD2-CB 3.4Å; D69-L71 WeakPolarHBondContact OD2-CD1 3.37Å; D69-L71 WeakPolarHBondContact OD2-CG 3.44Å; L71-P74 WeakPolarHBondContact O-CD 3.48Å
72	W	88.9	Confident	88.4	Confident	63 Å²	63	62.9 Å²	62.9	24%	0.239	31%	0.313	C	S	.	.	G	3₁₀ helix	trans	-94.9	-6.2	178.1	-68.3	72.4	0	0	0	113.7	M65 L66 Q67 D69 Y70 P74 K75 P391	M65-W72 WeakPolarHBondContact O-CZ3 3.48Å; L66-W72 HydrophobicContact CD2-CE3 4.1Å; Q67-W72 HydrophobicContact CB-CD2 3.95Å; Q67-W72 HydrophobicContact CB-CG 4Å; Q67-W72 HydrophobicContact CB-CZ2 4.33Å; Q67-W72 HydrophobicContact CG-CD2 4.16Å; Q67-W72 HydrophobicContact CG-CH2 4.19Å; Q67-W72 HydrophobicContact CG-CZ2 3.69Å; D69-W72 WeakPolarHBondContact O-CB 3.3Å; D69-W72 PolarHBondContact O-N 3.43Å; Y70-W72 PolarHBondContact O-N 3.31Å; W72-P74 VanDerWaalsContact C-CD 3.48Å; W72-K75 HydrophobicContact CD2-CD 4.14Å; W72-K75 HydrophobicContact CE3-CD 3.57Å; W72-K75 HydrophobicContact CZ3-CD 3.86Å; W72-K75 PolarHBondContact O-N 3.39Å; W72-P391 HydrophobicContact CB-CB 4.45Å
73	S	87.8	Confident	88.4	Confident	18 Å²	18	63.6 Å²	63.6	13%	0.126	32%	0.315	C	S	.	.	G	3₁₀ helix	trans	-52.2	-42.8	173.2	-177.6	0	0	0	0	113.5	Y70 K75 L76	Y70-S73 WeakPolarHBondContact O-CB 3.49Å; Y70-S73 PolarHBondContact O-N 3.17Å; S73-K75 VanDerWaalsContact C-N 3.26Å; S73-K75 PolarHBondContact O-N 3.09Å; S73-L76 VanDerWaalsContact O-CB 3.23Å; S73-L76 WeakPolarHBondContact O-CB 3.27Å; S73-L76 PolarHBondContact O-N 3.35Å
74	P	88.1	Confident	88.5	Confident	93 Å²	93	65 Å²	65	60%	0.604	33%	0.326	S	S	*	.	G	3₁₀ helix	trans	-68.3	-18.8	176.8	-20.2	34.4	0	0	0	114.7	N49 L71 W72	N49-P74 PolarHBondContact ND2-O 2.97Å; L71-P74 WeakPolarHBondContact O-CD 3.48Å; W72-P74 VanDerWaalsContact C-CD 3.48Å
75	K	89	Confident	88.6	Confident	108 Å²	108	64.4 Å²	64.4	47%	0.47	32%	0.324	S	S	.	.	G	3₁₀ helix	trans	-87.7	-3.9	177.8	-65.8	179.6	179.1	176.2	0	113.2	L66 W72 S73 C77	L66-K75 HydrophobicContact CD2-CB 4.02Å; W72-K75 HydrophobicContact CD2-CD 4.14Å; W72-K75 HydrophobicContact CE3-CD 3.57Å; W72-K75 HydrophobicContact CZ3-CD 3.86Å; W72-K75 PolarHBondContact O-N 3.39Å; S73-K75 VanDerWaalsContact C-N 3.26Å; S73-K75 PolarHBondContact O-N 3.09Å; K75-C77 PolarHBondContact O-N 3.13Å; K75-C77 PolarHBondContact O-SG 3.05Å
76	L	90.4	Very high	88.8	Confident	8 Å²	8	58.7 Å²	58.7	4%	0.042	30%	0.297	C	S	.	.	P	Polyproline II helix	trans	-58.4	123.4	-179.1	-174.7	65	0	0	0	110.5	S46 N49 L66 S73 Y82	S46-L76 VanDerWaalsContact CA-O 3.29Å; S46-L76 WeakPolarHBondContact CA-O 3.45Å; S46-L76 WeakPolarHBondContact CB-O 3.47Å; N49-L76 PolarHBondContact ND2-O 2.92Å; L66-L76 HydrophobicContact CD1-CD1 3.52Å; S73-L76 VanDerWaalsContact O-CB 3.23Å; S73-L76 WeakPolarHBondContact O-CB 3.27Å; S73-L76 PolarHBondContact O-N 3.35Å; L76-Y82 HydrophobicContact CD1-CE2 4.5Å
77	C	90.8	Very high	88.7	Confident	3 Å²	3	61.3 Å²	61.3	2%	0.02	31%	0.309	C	S	.	.	P	Polyproline II helix	trans	-90.8	172	175.5	-65.1	0	0	0	0	110	N53 K75 S81 Y82 R388	N53-C77 PolarHBondContact ND2-SG 3.19Å; K75-C77 PolarHBondContact O-N 3.13Å; K75-C77 PolarHBondContact O-SG 3.05Å; C77-S81 WeakPolarHBondContact CB-OG 3.32Å; C77-Y82 HydrophobicContact CB-CE2 3.82Å; C77-Y82 PolarHBondContact N-OH 3.02Å; C77-Y82 WeakPolarHBondContact O-CE2 3.09Å; C77-R388 VanDerWaalsContact O-CZ 3.28Å; C77-R388 PolarHBondContact O-NH1 3.35Å; C77-R388 PolarHBondContact O-NH2 3.35Å
78	P	92	Very high	88.6	Confident	1 Å²	1	59 Å²	59	1%	0.006	30%	0.3	C	S	.	.	P	Polyproline II helix	trans	-82	165.7	-176.6	36.3	-34.1	0	0	0	111.3	S46 Y50 R80 S81 Y82 F370	S46-P78 WeakPolarHBondContact O-CD 3.36Å; Y50-P78 VanDerWaalsContact CB-CD 3.47Å; Y50-P78 HydrophobicContact CD1-CG 4.43Å; Y50-P78 HydrophobicContact CG-CG 4.09Å; P78-R80 PolarHBondContact O-N 3.41Å; P78-R80 VanDerWaalsContact O-N 3.09Å; P78-S81 WeakPolarHBondContact O-CB 3.32Å; P78-S81 PolarHBondContact O-N 3.46Å; P78-S81 PolarHBondContact O-OG 3.33Å; P78-Y82 WeakPolarHBondContact O-CD2 3.4Å; P78-F370 HydrophobicContact CB-CD1 4.23Å; P78-F370 HydrophobicContact CB-CE1 3.32Å; P78-F370 HydrophobicContact CB-CE2 4.29Å; P78-F370 HydrophobicContact CB-CZ 3.36Å; P78-F370 HydrophobicContact CG-CE1 4.28Å; P78-F370 HydrophobicContact CG-CZ 3.85Å
79	P	90.3	Very high	88.5	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	27%	0.268	C	S	.	.	G	3₁₀ helix	trans	-43.6	-43.6	176.5	-35.2	40	0	0	0	115.2	S81 Y82 C89 F326 H327 H372	P79-S81 PolarHBondContact O-N 3.35Å; P79-Y82 PolarHBondContact O-N 2.79Å; P79-C89 WeakPolarHBondContact CB-SG 3.45Å; P79-F326 HydrophobicContact CB-CD2 4.08Å; P79-H327 PolarHBondContact O-CE1 3.38Å; P79-H372 HydrophobicContact CG-CB 4.1Å
80	R	87.8	Confident	88.5	Confident	144 Å²	144	51.6 Å²	51.6	54%	0.543	26%	0.255	S	S	.	.	G	3₁₀ helix	trans	-59.3	-18.4	178.8	-173.6	168.8	-173.9	157.8	7.2	115.1	P78 M83 F326	P78-R80 PolarHBondContact O-N 3.41Å; P78-R80 VanDerWaalsContact O-N 3.09Å; R80-M83 WeakPolarHBondContact O-CG 3.47Å; R80-F326 HydrophobicContact CB-CD2 4.38Å
81	S	87.2	Confident	88.6	Confident	10 Å²	10	46.3 Å²	46.3	7%	0.07	23%	0.234	C	C	.	.	G	3₁₀ helix	trans	-88.5	-5.5	175.2	68.9	0	0	0	0	114.2	R63 C77 P78 P79	R63-S81 PolarHBondContact NH1-O 2.98Å; C77-S81 WeakPolarHBondContact CB-OG 3.32Å; P78-S81 WeakPolarHBondContact O-CB 3.32Å; P78-S81 PolarHBondContact O-N 3.46Å; P78-S81 PolarHBondContact O-OG 3.33Å; P79-S81 PolarHBondContact O-N 3.35Å
82	Y	87.3	Confident	88.3	Confident	16 Å²	16	40.6 Å²	40.6	6%	0.063	21%	0.205	C	C	.	.			trans	-121.6	44.4	-177.2	-60.7	-77.1	0	0	0	111.1	R63 L66 L76 C77 P78 P79 D84 S85 N88 H327	R63-Y82 VanDerWaalsContact CZ-CD1 3.45Å; L66-Y82 VanDerWaalsContact CD1-OH 3.24Å; L66-Y82 WeakPolarHBondContact CD1-OH 3.45Å; L76-Y82 HydrophobicContact CD1-CE2 4.5Å; C77-Y82 HydrophobicContact CB-CE2 3.82Å; C77-Y82 PolarHBondContact N-OH 3.02Å; C77-Y82 WeakPolarHBondContact O-CE2 3.09Å; P78-Y82 WeakPolarHBondContact O-CD2 3.4Å; P79-Y82 PolarHBondContact O-N 2.79Å; Y82-D84 VanDerWaalsContact CA-OD1 3.28Å; Y82-D84 WeakPolarHBondContact CA-OD1 3.41Å; Y82-D84 PolarHBondContact O-N 2.87Å; Y82-S85 CarbonylContact O-C 3.54Å; Y82-S85 PolarHBondContact O-N 2.87Å; Y82-N88 HydrophobicContact CD2-CB 4.45Å; Y82-N88 WeakPolarHBondContact CD2-ND2 3.48Å; Y82-N88 HydrophobicContact CG-CB 4.29Å; Y82-H327 PolarHBondContact O-CE1 2.76Å
83	M	86.3	Confident	88.3	Confident	91 Å²	91	40.7 Å²	40.7	45%	0.448	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-31.9	-177.9	-60.5	-60.2	-68.8	0	0	112.2	R80 S85 F326	R80-M83 WeakPolarHBondContact O-CG 3.47Å; M83-S85 VanDerWaalsContact C-N 3.32Å; M83-F326 HydrophobicContact SD-CB 4.29Å
84	D	87.9	Confident	88.5	Confident	75 Å²	75	44 Å²	44	40%	0.401	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-31.7	169.4	61.1	-59.1	0	0	0	114.1	D60 R63 Y82 P86	D60-D84 HydrophobicContact CB-CB 4.42Å; R63-D84 IonicContact CZ-OD1 2.72Å; R63-D84 IonicContact CZ-OD2 3.56Å; R63-D84 IonicContact NH1-OD1 2.8Å; R63-D84 PolarHBondContact NH1-OD1 3.26Å; R63-D84 IonicContact NH1-OD2 3.45Å; R63-D84 IonicContact NH2-OD1 3.56Å; R63-D84 PolarHBondContact NH2-OD1 3.29Å; R63-D84 IonicContact NH2-OD2 3.66Å; R63-D84 PolarHBondContact NH2-OD2 2.81Å; Y82-D84 VanDerWaalsContact CA-OD1 3.28Å; Y82-D84 WeakPolarHBondContact CA-OD1 3.41Å; Y82-D84 PolarHBondContact O-N 2.87Å; D84-P86 WeakPolarHBondContact O-CD 3.23Å
85	S	87	Confident	88.6	Confident	48 Å²	48	40.2 Å²	40.2	34%	0.336	20%	0.204	S	C	.	.			trans	-126.9	69.2	-164.2	-72	0	0	0	0	111.5	Y82 M83 M87 N88	Y82-S85 CarbonylContact O-C 3.54Å; Y82-S85 PolarHBondContact O-N 2.87Å; M83-S85 VanDerWaalsContact C-N 3.32Å; S85-M87 PolarHBondContact O-N 2.97Å; S85-N88 WeakPolarHBondContact O-CB 3.1Å; S85-N88 PolarHBondContact O-N 3.07Å; S85-N88 VanDerWaalsContact O-N 3.1Å
86	P	88.9	Confident	88.8	Confident	17 Å²	17	41.9 Å²	41.9	11%	0.11	21%	0.207	C	C	.	.	G	3₁₀ helix	trans	-60.6	-20.8	-177.4	25	-34.8	0	0	0	113.6	D84 N88 C89 H327 L344	D84-P86 WeakPolarHBondContact O-CD 3.23Å; P86-N88 PolarHBondContact O-N 2.94Å; P86-N88 VanDerWaalsContact O-N 3.14Å; P86-C89 PolarHBondContact O-N 2.93Å; P86-H327 HydrophobicContact CB-CB 4.17Å; P86-L344 HydrophobicContact CB-CD1 3.91Å; P86-L344 HydrophobicContact CG-CD1 3.62Å; P86-L344 HydrophobicContact CG-CD2 4.11Å
87	M	87.6	Confident	89	Confident	92 Å²	92	44.8 Å²	44.8	45%	0.453	23%	0.225	S	C	.	.	G	3₁₀ helix	trans	-53.1	-29.3	173	-67.2	-55.8	-63.7	0	0	113.9	S85 C89 V90 L351	S85-M87 PolarHBondContact O-N 2.97Å; M87-C89 PolarHBondContact O-N 2.96Å; M87-V90 HydrophobicContact CE-CG2 4.21Å; M87-V90 PolarHBondContact O-N 2.89Å; M87-V90 VanDerWaalsContact O-N 3.17Å; M87-L351 HydrophobicContact CE-CB 4.09Å; M87-L351 HydrophobicContact CE-CD2 4.45Å; M87-L351 HydrophobicContact SD-CB 4.01Å; M87-L351 HydrophobicContact SD-CD1 3.48Å; M87-L351 WeakPolarHBondContact SD-CD1 3.33Å; M87-L351 HydrophobicContact SD-CD2 3.61Å; M87-L351 HydrophobicContact SD-CG 3.88Å
88	N	87	Confident	89.1	Confident	37 Å²	37	44.9 Å²	44.9	20%	0.198	23%	0.226	C	C	.	.	G	3₁₀ helix	trans	-56.1	-22.9	174.7	161.9	70	0	0	0	112.8	Y82 S85 P86 R388	Y82-N88 HydrophobicContact CD2-CB 4.45Å; Y82-N88 WeakPolarHBondContact CD2-ND2 3.48Å; Y82-N88 HydrophobicContact CG-CB 4.29Å; S85-N88 WeakPolarHBondContact O-CB 3.1Å; S85-N88 PolarHBondContact O-N 3.07Å; S85-N88 VanDerWaalsContact O-N 3.1Å; P86-N88 PolarHBondContact O-N 2.94Å; P86-N88 VanDerWaalsContact O-N 3.14Å; N88-R388 PolarHBondContact ND2-NH1 3.29Å; N88-R388 WeakPolarHBondContact O-CD 3.25Å; N88-R388 WeakPolarHBondContact O-CG 3.45Å; N88-R388 WeakPolarHBondContact OD1-CD 3.44Å; N88-R388 PolarHBondContact OD1-NH1 2.85Å
89	C	87.9	Confident	89.2	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	25%	0.25	C	S	.	.	G	3₁₀ helix	trans	-101	14.8	-176.7	-64.9	0	0	0	0	114.1	P79 P86 M87 M91 H327 L330 W367	P79-C89 WeakPolarHBondContact CB-SG 3.45Å; P86-C89 PolarHBondContact O-N 2.93Å; M87-C89 PolarHBondContact O-N 2.96Å; C89-M91 HydrophobicContact CB-CE 3.96Å; C89-M91 PolarHBondContact O-N 3.09Å; C89-H327 PolarHBondContact SG-NE2 3.45Å; C89-L330 HydrophobicContact CB-CD2 3.46Å; C89-L330 VanDerWaalsContact CB-CD2 3.46Å; C89-W367 WeakPolarHBondContact O-CH2 3.07Å
90	V	90.1	Very high	89.2	Confident	17 Å²	17	49.5 Å²	49.5	10%	0.103	25%	0.254	C	S	.	.			trans	-72.9	103.1	166.6	178.2	0	0	0	0	108.9	M87 S92 Y342 L351	M87-V90 HydrophobicContact CE-CG2 4.21Å; M87-V90 PolarHBondContact O-N 2.89Å; M87-V90 VanDerWaalsContact O-N 3.17Å; V90-S92 PolarHBondContact O-N 3.08Å; V90-S92 VanDerWaalsContact O-N 3.07Å; V90-Y342 HydrophobicContact CG1-CD2 3.84Å; V90-Y342 HydrophobicContact CG1-CE2 4.32Å; V90-Y342 HydrophobicContact CG1-CG 4.03Å; V90-Y342 HydrophobicContact CG2-CG 4.45Å; V90-L351 HydrophobicContact CG2-CB 4.13Å; V90-L351 HydrophobicContact CG2-CD1 4.36Å
91	M	89.7	Confident	89.3	Confident	0 Å²	0	52 Å²	52	0%	0	27%	0.268	C	S	.	.			trans	-86.4	69.3	-172.6	-51.3	-59.1	173.4	0	0	112.2	C89 Y342 W367 G371 L374 W386 T387 R388	C89-M91 HydrophobicContact CB-CE 3.96Å; C89-M91 PolarHBondContact O-N 3.09Å; M91-Y342 HydrophobicContact CB-CE1 4.21Å; M91-Y342 WeakPolarHBondContact CB-OH 3.44Å; M91-Y342 HydrophobicContact CG-CE1 4.44Å; M91-Y342 PolarHBondContact O-OH 3.46Å; M91-W367 HydrophobicContact CE-CH2 4.14Å; M91-W367 HydrophobicContact CE-CZ3 3.54Å; M91-W367 HydrophobicContact CG-CH2 3.87Å; M91-W367 HydrophobicContact CG-CZ3 3.55Å; M91-W367 HydrophobicContact SD-CZ3 4.4Å; M91-G371 WeakPolarHBondContact CE-O 3.35Å; M91-L374 HydrophobicContact CB-CB 4.21Å; M91-L374 HydrophobicContact CG-CB 4.03Å; M91-W386 HydrophobicContact CB-CB 3.81Å; M91-W386 WeakPolarHBondContact O-CB 3.46Å; M91-T387 CarbonylContact C-O 3.58Å; M91-T387 VanDerWaalsContact CA-O 3.3Å; M91-T387 WeakPolarHBondContact CA-O 3.18Å; M91-R388 HydrophobicContact CE-CG 3.49Å; M91-R388 VanDerWaalsContact CE-CG 3.49Å; M91-R388 HydrophobicContact SD-CB 4.11Å; M91-R388 HydrophobicContact SD-CG 3.3Å; M91-R388 WeakPolarHBondContact SD-CG 3.4Å; M91-R388 PolarHBondContact SD-N 3.21Å
92	S	82.9	Confident	89.4	Confident	11 Å²	11	55.8 Å²	55.8	8%	0.077	29%	0.288	C	S	.	.			trans	-85.4	-10.4	178.4	51.6	0	0	0	0	114.9	V90 P94 N389	V90-S92 PolarHBondContact O-N 3.08Å; V90-S92 VanDerWaalsContact O-N 3.07Å; S92-P94 VanDerWaalsContact O-CD 3.23Å; S92-P94 WeakPolarHBondContact O-CD 3.49Å; S92-N389 PolarHBondContact OG-ND2 2.87Å; S92-N389 PolarHBondContact OG-OD1 3.41Å
93	K	89.6	Confident	89.7	Confident	65 Å²	65	62.8 Å²	62.8	28%	0.283	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	111.8	-178.8	-172	165	-167.1	160.8	0	111.2	W386 T387 N389 D393	K93-W386 WeakPolarHBondContact O-CA 3.46Å; K93-T387 HydrophobicContact CB-CG2 4Å; K93-T387 WeakPolarHBondContact CB-O 3.31Å; K93-T387 HydrophobicContact CD-CG2 4.4Å; K93-T387 HydrophobicContact CG-CG2 4.22Å; K93-T387 PolarHBondContact N-O 3.17Å; K93-T387 VanDerWaalsContact N-O 3.14Å; K93-T387 PolarHBondContact O-N 3.44Å; K93-N389 PolarHBondContact N-OD1 2.88Å; K93-D393 WeakPolarHBondContact CD-OD2 3.11Å; K93-D393 WeakPolarHBondContact CE-OD2 3.34Å; K93-D393 IonicContact NZ-OD1 2.69Å; K93-D393 PolarHBondContact NZ-OD1 3.46Å; K93-D393 IonicContact NZ-OD2 3.18Å; K93-D393 PolarHBondContact NZ-OD2 3.04Å
94	P	91.3	Very high	90	Very high	89 Å²	89	59.5 Å²	59.5	58%	0.578	31%	0.305	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.1	136.6	174.5	29.5	-34.1	0	0	0	110.6	S92 W386	S92-P94 VanDerWaalsContact O-CD 3.23Å; S92-P94 WeakPolarHBondContact O-CD 3.49Å; P94-W386 HydrophobicContact CB-CE3 4.06Å; P94-W386 HydrophobicContact CB-CH2 4.43Å; P94-W386 HydrophobicContact CB-CZ3 3.74Å; P94-W386 HydrophobicContact CG-CZ3 4.47Å
95	V	90.8	Very high	90.4	Very high	13 Å²	13	56.9 Å²	56.9	8%	0.079	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	-60	-173.8	-174.4	0	0	0	0	110.7	R39 I41 F135 F385 T387	R39-V95 PolarHBondContact NH1-O 2.85Å; I41-V95 HydrophobicContact CD1-CB 4.02Å; I41-V95 HydrophobicContact CD1-CG1 3.43Å; I41-V95 VanDerWaalsContact CD1-CG1 3.43Å; I41-V95 HydrophobicContact CD1-CG2 3.36Å; I41-V95 HydrophobicContact CG1-CG1 3.97Å; V95-F135 HydrophobicContact CG1-CD2 3.84Å; V95-F135 HydrophobicContact CG1-CE2 3.49Å; V95-F135 VanDerWaalsContact CG1-CE2 3.49Å; V95-F135 HydrophobicContact CG1-CZ 4.23Å; V95-F385 HydrophobicContact CB-CB 4.09Å; V95-F385 WeakPolarHBondContact CB-O 3.29Å; V95-F385 WeakPolarHBondContact CG2-O 3.4Å; V95-F385 PolarHBondContact N-O 3.15Å; V95-T387 HydrophobicContact CG2-CG2 3.54Å
96	R	92.1	Very high	90.8	Very high	143 Å²	143	54.7 Å²	54.7	54%	0.54	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	140.5	-173.6	-174.8	65.1	-171.9	176.7	2.6	109.2	F135 F385	R96-F135 HydrophobicContact CB-CB 3.96Å; R96-F135 HydrophobicContact CB-CD2 4.25Å; R96-F135 HydrophobicContact CB-CG 4.23Å; R96-F135 HydrophobicContact CG-CB 3.86Å; R96-F385 HydrophobicContact CB-CD2 4.25Å; R96-F385 PolarHBondContact O-N 3.48Å
97	T	94	Very high	91.2	Very high	69 Å²	69	55.5 Å²	55.5	42%	0.423	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	126.5	160.8	-58.1	0	0	0	0	107.4	T99 A382 K384	T97-T99 HydrophobicContact CG2-CG2 4.24Å; T97-A382 HydrophobicContact CG2-CB 3.77Å; T97-K384 HydrophobicContact CG2-CG 3.97Å
98	S	93.2	Very high	91.6	Very high	4 Å²	4	51.4 Å²	51.4	3%	0.028	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	123.5	179.6	-72.6	0	0	0	0	109.4	F135 T383	S98-F135 PolarHBondContact OG-O 2.9Å; S98-T383 PolarHBondContact N-O 3.26Å; S98-T383 PolarHBondContact O-N 3.31Å
99	T	93.7	Very high	92	Very high	85 Å²	85	50 Å²	50	52%	0.521	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	139	-175.6	53.8	0	0	0	0	109.1	T97 A382	T97-T99 HydrophobicContact CG2-CG2 4.24Å; T99-A382 HydrophobicContact CG2-CB 4.04Å
100	N	91.7	Very high	92.4	Very high	13 Å²	13	51 Å²	51	7%	0.07	26%	0.257	C	S	.	.			trans	-72	158.1	173.6	-71.1	-25	0	0	0	111.4	N102 T128 W130	N100-N102 VanDerWaalsContact C-N 3.3Å; N100-N102 VanDerWaalsContact CB-O 3.22Å; N100-N102 WeakPolarHBondContact CB-O 3.32Å; N100-T128 WeakPolarHBondContact ND2-CG2 3.44Å; N100-T128 PolarHBondContact ND2-OG1 3.02Å; N100-T128 WeakPolarHBondContact OD1-CG2 3.37Å; N100-T128 PolarHBondContact OD1-OG1 2.87Å; N100-W130 WeakPolarHBondContact OD1-CZ2 3.44Å
101	K	90.1	Very high	92.8	Very high	196 Å²	196	50.7 Å²	50.7	85%	0.852	25%	0.254	S	S	*	.	S	Bend	trans	-60.3	-46.1	172.1	-65.4	-173.8	-178.7	-177.8	0	110.2
102	N	89.1	Confident	93.1	Very high	90 Å²	90	51.3 Å²	51.3	48%	0.481	26%	0.257	S	S	.	.	S	Bend	trans	-77.6	118.3	168.6	-63.6	-12.3	0	0	0	108.2	N100 C104 E126	N100-N102 VanDerWaalsContact C-N 3.3Å; N100-N102 VanDerWaalsContact CB-O 3.22Å; N100-N102 WeakPolarHBondContact CB-O 3.32Å; N102-C104 PolarHBondContact O-N 3.28Å; N102-E126 PolarHBondContact ND2-OE1 3.23Å
103	K	92	Very high	93.6	Very high	163 Å²	163	52.2 Å²	52.2	71%	0.709	26%	0.263	S	S	*	.			trans	-79.9	87.9	-179.8	-69.3	-175.1	178.2	-174.7	0	110.2	F381	K103-F381 HydrophobicContact CB-CB 4.25Å; K103-F381 HydrophobicContact CB-CD2 3.95Å; K103-F381 HydrophobicContact CB-CE2 4.45Å; K103-F381 HydrophobicContact CB-CG 4Å; K103-F381 HydrophobicContact CD-CD2 4.39Å; K103-F381 HydrophobicContact CG-CD2 4.48Å
104	C	94	Very high	93.8	Very high	23 Å²	23	55.6 Å²	55.6	16%	0.155	28%	0.28	C	S	.	.			trans	-117	138.8	-178.8	-63.2	0	0	0	0	110.6	N102 A122 F123	N102-C104 PolarHBondContact O-N 3.28Å; C104-A122 HydrophobicContact CB-CB 4.04Å; C104-F123 HydrophobicContact CB-CB 4.33Å
105	P	95.6	Very high	93.9	Very high	20 Å²	20	51.4 Å²	51.4	13%	0.13	25%	0.253	C	S	.	.			trans	-57.3	141.5	173.9	-27.9	34.5	0	0	0	111.6	A122 F123 F381	P105-A122 CarbonylContact O-C 3.57Å; P105-A122 WeakPolarHBondContact O-CA 3.45Å; P105-F123 HydrophobicContact CB-CB 4.35Å; P105-F123 HydrophobicContact CG-CB 4.32Å; P105-F123 PolarHBondContact O-N 2.67Å; P105-F381 HydrophobicContact CG-CD1 3.99Å; P105-F381 HydrophobicContact CG-CE1 3.87Å
106	I	96.4	Very high	94	Very high	2 Å²	2	57.7 Å²	57.7	1%	0.01	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	115.3	177	-62.7	137.6	0	0	0	107.7	V109 A378 A382 T383	I106-V109 HydrophobicContact CG2-CG2 3.63Å; I106-A378 PolarHBondContact N-O 3.37Å; I106-A382 WeakPolarHBondContact CD1-O 3.37Å; I106-T383 VanDerWaalsContact CD1-OG1 3.3Å; I106-T383 WeakPolarHBondContact CD1-OG1 3.44Å
107	Y	96.4	Very high	94.2	Very high	34 Å²	34	54.1 Å²	54.1	13%	0.133	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	-34.1	-178.7	-73.9	-54.6	0	0	0	112.9	G121 F123 Q147 I148 R149 W363 S364	Y107-G121 PolarHBondContact N-O 1.81Å; Y107-G121 VanDerWaalsContact N-O 3.13Å; Y107-F123 HydrophobicContact CE2-CB 4.16Å; Y107-F123 AromaticContact CE2-CD2 3.75Å; Y107-F123 HydrophobicContact CE2-CD2 3.75Å; Y107-F123 HydrophobicContact CE2-CG 4.4Å; Y107-Q147 HydrophobicContact CD2-CB 4.1Å; Y107-Q147 HydrophobicContact CE2-CB 3.85Å; Y107-Q147 HydrophobicContact CE2-CG 4.02Å; Y107-I148 VanDerWaalsContact CB-O 3.31Å; Y107-I148 WeakPolarHBondContact CB-O 3.32Å; Y107-R149 VanDerWaalsContact CE1-NH1 3.31Å; Y107-W363 HydrophobicContact CD1-CB 4.38Å; Y107-W363 AromaticContact CD1-CD1 3.69Å; Y107-W363 AromaticContact CD1-CD2 3.77Å; Y107-W363 HydrophobicContact CD1-CD2 3.77Å; Y107-W363 AromaticContact CD1-CE2 3.83Å; Y107-W363 HydrophobicContact CD1-CE3 4.42Å; Y107-W363 AromaticContact CD1-CG 3.72Å; Y107-W363 HydrophobicContact CD1-CG 3.72Å; Y107-W363 AromaticContact CD1-NE1 3.73Å; Y107-W363 HydrophobicContact CE1-CD2 4.06Å; Y107-W363 AromaticContact CE1-CE2 3.63Å; Y107-W363 HydrophobicContact CE1-CG 4.32Å; Y107-W363 HydrophobicContact CE1-CZ2 4.01Å; Y107-W363 AromaticContact CE1-NE1 3.57Å; Y107-W363 WeakPolarHBondContact O-CB 3.44Å; Y107-S364 WeakPolarHBondContact O-CB 3.4Å
108	C	95.7	Very high	94.3	Very high	5 Å²	5	50.9 Å²	50.9	3%	0.034	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	140.5	-175	49.6	0	0	0	0	111	G121 M151	C108-G121 PolarHBondContact O-N 3.33Å; C108-M151 HydrophobicContact CB-CE 4.1Å; C108-M151 HydrophobicContact CB-CG 4.31Å; C108-M151 WeakPolarHBondContact O-CE 3.16Å
109	V	96.5	Very high	94.4	Very high	9 Å²	9	50.7 Å²	50.7	6%	0.055	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	132.5	-179.2	176.9	0	0	0	0	107.4	I106 L118 T120 S364 A366 V375	I106-V109 HydrophobicContact CG2-CG2 3.63Å; V109-L118 HydrophobicContact CG1-CD1 3.46Å; V109-L118 VanDerWaalsContact CG1-CD1 3.46Å; V109-L118 HydrophobicContact CG1-CD2 3.97Å; V109-L118 HydrophobicContact CG1-CG 4.02Å; V109-T120 HydrophobicContact CB-CG2 4.5Å; V109-T120 HydrophobicContact CG1-CG2 4.17Å; V109-T120 HydrophobicContact CG2-CG2 3.98Å; V109-S364 PolarHBondContact N-OG 2.9Å; V109-S364 VanDerWaalsContact N-OG 3.11Å; V109-A366 HydrophobicContact CB-CB 4.42Å; V109-A366 HydrophobicContact CG1-CB 3.94Å; V109-V375 HydrophobicContact CG1-CB 4.16Å; V109-V375 HydrophobicContact CG1-CG1 3.8Å
110	C	96.3	Very high	94.6	Very high	19 Å²	19	46.7 Å²	46.7	13%	0.128	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	133.8	-179.9	-153	0	0	0	0	110.6	I119 M151 W153	C110-I119 PolarHBondContact N-O 2.9Å; C110-I119 PolarHBondContact O-N 3.49Å; C110-M151 HydrophobicContact CB-CB 4.34Å; C110-M151 HydrophobicContact CB-CE 4.18Å; C110-W153 VanDerWaalsContact SG-CD1 3.55Å
111	W	96.8	Very high	94.8	Very high	12 Å²	12	46 Å²	46	5%	0.045	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	146.6	169.5	-74.8	97.2	0	0	0	110.1	L118 W153 A366 H368 P369 I373 V375 F385	W111-L118 HydrophobicContact CD2-CB 4.33Å; W111-L118 HydrophobicContact CD2-CD1 3.65Å; W111-L118 HydrophobicContact CE3-CB 4.06Å; W111-L118 HydrophobicContact CE3-CD1 4.24Å; W111-L118 HydrophobicContact CG-CD1 3.81Å; W111-L118 HydrophobicContact CH2-CB 4.35Å; W111-L118 HydrophobicContact CZ2-CD1 4.25Å; W111-L118 HydrophobicContact CZ3-CB 4.06Å; W111-W153 PolarHBondContact O-NE1 3.49Å; W111-A366 PolarHBondContact NE1-O 2.86Å; W111-H368 HydrophobicContact CD2-CB 4.34Å; W111-H368 AromaticContact CE3-CD2 3.73Å; W111-H368 AromaticContact CH2-CD2 3.76Å; W111-H368 HydrophobicContact CZ2-CB 4.11Å; W111-H368 AromaticContact CZ3-CD2 3.62Å; W111-P369 HydrophobicContact CB-CG 4.43Å; W111-I373 HydrophobicContact CZ2-CG2 3.92Å; W111-V375 HydrophobicContact CH2-CG2 4.45Å; W111-V375 HydrophobicContact CZ2-CG2 3.33Å; W111-F385 HydrophobicContact CH2-CE1 4.14Å; W111-F385 HydrophobicContact CZ2-CD1 4.37Å; W111-F385 HydrophobicContact CZ2-CE1 4.14Å
112	T	96.1	Very high	95.1	Very high	12 Å²	12	36.7 Å²	36.7	7%	0.074	17%	0.172	C	C	.	.			trans	-61	144.6	159.1	52.5	0	0	0	0	109.2	E114 G115 R116 R117 I119 W153	T112-E114 VanDerWaalsContact C-N 3.26Å; T112-E114 PolarHBondContact O-N 3.24Å; T112-G115 WeakPolarHBondContact O-CA 3.3Å; T112-G115 PolarHBondContact O-N 3.31Å; T112-R116 PolarHBondContact OG1-N 3.44Å; T112-R117 HydrophobicContact CG2-CB 3.77Å; T112-R117 PolarHBondContact N-O 3.04Å; T112-R117 PolarHBondContact OG1-N 3.22Å; T112-R117 PolarHBondContact OG1-O 3.26Å; T112-I119 HydrophobicContact CG2-CD1 4.41Å; T112-W153 HydrophobicContact CG2-CZ2 3.95Å
113	P	94.3	Very high	95.4	Very high	30 Å²	30	36.8 Å²	36.8	20%	0.195	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-36.8	-178.8	-28.8	37.5	0	0	0	114.2	G115 W153 E157 P369	P113-G115 PolarHBondContact O-N 3.32Å; P113-G115 VanDerWaalsContact O-N 3.12Å; P113-W153 HydrophobicContact CG-CB 4.01Å; P113-W153 HydrophobicContact CG-CD2 3.88Å; P113-W153 HydrophobicContact CG-CE3 4.11Å; P113-W153 HydrophobicContact CG-CG 3.82Å; P113-E157 HydrophobicContact CB-CB 3.82Å; P113-E157 HydrophobicContact CB-CG 3.47Å; P113-E157 VanDerWaalsContact CB-CG 3.47Å; P113-E157 WeakPolarHBondContact CB-OE1 3.48Å; P113-E157 HydrophobicContact CG-CB 3.82Å; P113-E157 HydrophobicContact CG-CG 3.91Å; P113-P369 WeakPolarHBondContact O-CG 3.2Å
114	E	92.8	Very high	95.5	Very high	136 Å²	136	30.5 Å²	30.5	64%	0.636	15%	0.145	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-17.5	172.3	-57.6	-177.7	162.8	0	0	114.8	T112 R116	T112-E114 VanDerWaalsContact C-N 3.26Å; T112-E114 PolarHBondContact O-N 3.24Å; E114-R116 HydrophobicContact CB-CB 4.24Å; E114-R116 PolarHBondContact O-N 3.17Å
115	G	93.4	Very high	95.5	Very high	1 Å²	1	29.4 Å²	29.4	1%	0.01	14%	0.137	C	C	.	.	S	Bend	trans	75.8	-3.3	-168.9	0	0	0	0	0	115.4	T112 P113 R117	T112-G115 WeakPolarHBondContact O-CA 3.3Å; T112-G115 PolarHBondContact O-N 3.31Å; P113-G115 PolarHBondContact O-N 3.32Å; P113-G115 VanDerWaalsContact O-N 3.12Å; G115-R117 PolarHBondContact O-N 3.35Å
116	R	94.3	Very high	95.6	Very high	146 Å²	146	29.4 Å²	29.4	55%	0.551	14%	0.135	S	C	*	.	S	Bend	trans	-60	-39.4	-176.6	-171.7	-169.3	170.6	96.8	8.1	113.9	T112 E114 G132	T112-R116 PolarHBondContact OG1-N 3.44Å; E114-R116 HydrophobicContact CB-CB 4.24Å; E114-R116 PolarHBondContact O-N 3.17Å; R116-G132 WeakPolarHBondContact O-CA 3.38Å; R116-G132 PolarHBondContact O-N 3.27Å
117	R	95	Very high	95.6	Very high	68 Å²	68	29.3 Å²	29.3	26%	0.257	14%	0.135	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	152.1	-172.7	-72.6	164	164.5	175.6	-9.4	111.6	T112 G115 W130 E138	T112-R117 HydrophobicContact CG2-CB 3.77Å; T112-R117 PolarHBondContact N-O 3.04Å; T112-R117 PolarHBondContact OG1-N 3.22Å; T112-R117 PolarHBondContact OG1-O 3.26Å; G115-R117 PolarHBondContact O-N 3.35Å; R117-W130 CarbonylContact C-O 3.36Å; R117-W130 VanDerWaalsContact CA-O 3.31Å; R117-W130 WeakPolarHBondContact CA-O 3.34Å; R117-E138 IonicContact CZ-OE2 2.75Å; R117-E138 IonicContact NE-OE2 3.54Å; R117-E138 PolarHBondContact NE-OE2 3.37Å; R117-E138 IonicContact NH2-OE2 2.74Å; R117-E138 PolarHBondContact NH2-OE2 3.19Å
118	L	96.4	Very high	95.5	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	133.5	166	-177.3	81.1	0	0	0	109.5	V109 W111 T120 L129 W130 V375 T383 F385	V109-L118 HydrophobicContact CG1-CD1 3.46Å; V109-L118 VanDerWaalsContact CG1-CD1 3.46Å; V109-L118 HydrophobicContact CG1-CD2 3.97Å; V109-L118 HydrophobicContact CG1-CG 4.02Å; W111-L118 HydrophobicContact CD2-CB 4.33Å; W111-L118 HydrophobicContact CD2-CD1 3.65Å; W111-L118 HydrophobicContact CE3-CB 4.06Å; W111-L118 HydrophobicContact CE3-CD1 4.24Å; W111-L118 HydrophobicContact CG-CD1 3.81Å; W111-L118 HydrophobicContact CH2-CB 4.35Å; W111-L118 HydrophobicContact CZ2-CD1 4.25Å; W111-L118 HydrophobicContact CZ3-CB 4.06Å; L118-T120 HydrophobicContact CD2-CG2 3.62Å; L118-T120 HydrophobicContact CG-CG2 4.11Å; L118-L129 CarbonylContact O-C 3.52Å; L118-L129 WeakPolarHBondContact O-CA 3.48Å; L118-W130 HydrophobicContact CB-CB 4.25Å; L118-W130 PolarHBondContact N-O 2.8Å; L118-W130 PolarHBondContact O-N 2.91Å; L118-V375 HydrophobicContact CD1-CB 4.39Å; L118-V375 HydrophobicContact CD1-CG1 4.42Å; L118-V375 HydrophobicContact CD1-CG2 4.19Å; L118-V375 HydrophobicContact CD2-CB 4.46Å; L118-V375 HydrophobicContact CD2-CG1 3.69Å; L118-V375 HydrophobicContact CD2-CG2 4.32Å; L118-T383 HydrophobicContact CD2-CG2 3.77Å; L118-F385 HydrophobicContact CD2-CE1 3.74Å; L118-F385 HydrophobicContact CD2-CZ 3.56Å
119	I	96.8	Very high	95.6	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	129.5	172.5	-54.4	168.6	0	0	0	108	C110 T112 F127 L129 M151 W153 L160 M176	C110-I119 PolarHBondContact N-O 2.9Å; C110-I119 PolarHBondContact O-N 3.49Å; T112-I119 HydrophobicContact CG2-CD1 4.41Å; I119-F127 HydrophobicContact CG2-CB 4.17Å; I119-F127 HydrophobicContact CG2-CD1 4.04Å; I119-F127 HydrophobicContact CG2-CG 4.04Å; I119-L129 HydrophobicContact CG1-CD1 4.33Å; I119-L129 HydrophobicContact CG1-CG 4.21Å; I119-L129 HydrophobicContact CG2-CD1 4.38Å; I119-M151 HydrophobicContact CB-CE 4.46Å; I119-M151 HydrophobicContact CG2-CE 4.03Å; I119-M151 HydrophobicContact CG2-SD 3.97Å; I119-M151 WeakPolarHBondContact O-CE 3.15Å; I119-W153 HydrophobicContact CD1-CZ2 3.71Å; I119-L160 HydrophobicContact CD1-CD2 3.73Å; I119-M176 HydrophobicContact CD1-CE 3.52Å; I119-M176 HydrophobicContact CD1-SD 3.72Å; I119-M176 HydrophobicContact CG1-SD 4.48Å
120	T	96.8	Very high	95.6	Very high	1 Å²	1	27.7 Å²	27.7	1%	0.006	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	126.1	175.7	55.7	0	0	0	0	109.8	V109 L118 F127 T128 W130 T383	V109-T120 HydrophobicContact CB-CG2 4.5Å; V109-T120 HydrophobicContact CG1-CG2 4.17Å; V109-T120 HydrophobicContact CG2-CG2 3.98Å; L118-T120 HydrophobicContact CD2-CG2 3.62Å; L118-T120 HydrophobicContact CG-CG2 4.11Å; T120-F127 WeakPolarHBondContact O-CA 3.5Å; T120-T128 PolarHBondContact N-O 3.23Å; T120-T128 PolarHBondContact O-N 3.39Å; T120-T128 PolarHBondContact OG1-O 3.22Å; T120-T128 VanDerWaalsContact OG1-O 3.05Å; T120-T128 PolarHBondContact OG1-OG1 2.63Å; T120-W130 PolarHBondContact OG1-NE1 3.03Å; T120-T383 HydrophobicContact CG2-CG2 4.04Å
121	G	96.2	Very high	95.5	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	118.8	179.3	0	0	0	0	0	110.6	Y107 C108	Y107-G121 PolarHBondContact N-O 1.81Å; Y107-G121 VanDerWaalsContact N-O 3.13Å; C108-G121 PolarHBondContact O-N 3.33Å
122	A	96.1	Very high	95.3	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	165.5	-175.5	0	0	0	0	0	112.9	C104 P105 S124 G125 E126 I148	C104-A122 HydrophobicContact CB-CB 4.04Å; P105-A122 CarbonylContact O-C 3.57Å; P105-A122 WeakPolarHBondContact O-CA 3.45Å; A122-S124 WeakPolarHBondContact CB-OG 3.34Å; A122-S124 PolarHBondContact O-N 3.42Å; A122-G125 PolarHBondContact O-N 3.14Å; A122-E126 PolarHBondContact N-O 2.75Å; A122-I148 PolarHBondContact O-N 2.92Å
123	F	95.1	Very high	95.1	Very high	92 Å²	92	29.7 Å²	29.7	40%	0.404	14%	0.137	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.8	-34.4	168.4	-177	-78.4	0	0	0	112.6	C104 P105 Y107 G125 Q147	C104-F123 HydrophobicContact CB-CB 4.33Å; P105-F123 HydrophobicContact CB-CB 4.35Å; P105-F123 HydrophobicContact CG-CB 4.32Å; P105-F123 PolarHBondContact O-N 2.67Å; Y107-F123 HydrophobicContact CE2-CB 4.16Å; Y107-F123 AromaticContact CE2-CD2 3.75Å; Y107-F123 HydrophobicContact CE2-CD2 3.75Å; Y107-F123 HydrophobicContact CE2-CG 4.4Å; F123-G125 PolarHBondContact O-N 2.84Å; F123-G125 VanDerWaalsContact O-N 3.15Å; F123-Q147 HydrophobicContact CB-CG 4.34Å; F123-Q147 HydrophobicContact CD1-CG 4.11Å; F123-Q147 HydrophobicContact CD2-CG 3.44Å; F123-Q147 VanDerWaalsContact CD2-CG 3.44Å; F123-Q147 HydrophobicContact CE1-CG 4.21Å; F123-Q147 HydrophobicContact CE2-CG 3.55Å; F123-Q147 HydrophobicContact CG-CG 3.71Å; F123-Q147 HydrophobicContact CZ-CG 3.93Å; F123-Q147 WeakPolarHBondContact O-CA 3.5Å; F123-Q147 WeakPolarHBondContact O-CG 3.38Å
124	S	94.7	Very high	95.1	Very high	31 Å²	31	30.1 Å²	30.1	22%	0.217	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-4.2	-179.2	39.6	0	0	0	0	115.1	A122 E126 Q142	A122-S124 WeakPolarHBondContact CB-OG 3.34Å; A122-S124 PolarHBondContact O-N 3.42Å; S124-E126 VanDerWaalsContact CB-OE2 3.3Å; S124-E126 WeakPolarHBondContact CB-OE2 3.36Å; S124-E126 PolarHBondContact O-N 3.07Å; S124-E126 VanDerWaalsContact OG-CD 3.27Å; S124-E126 WeakPolarHBondContact OG-CG 3.41Å; S124-E126 PolarHBondContact OG-OE2 3.37Å; S124-Q142 PolarHBondContact O-NE2 3.44Å
125	G	94.5	Very high	95.1	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	11%	0.11	C	C	.	.	S	Bend	trans	76.5	6.9	-169.9	0	0	0	0	0	113.4	A122 F123 A143 H144 S146	A122-G125 PolarHBondContact O-N 3.14Å; F123-G125 PolarHBondContact O-N 2.84Å; F123-G125 VanDerWaalsContact O-N 3.15Å; G125-A143 PolarHBondContact O-N 3.19Å; G125-H144 WeakPolarHBondContact CA-O 3.38Å; G125-H144 PolarHBondContact O-N 2.99Å; G125-S146 VanDerWaalsContact CA-O 3.26Å; G125-S146 WeakPolarHBondContact CA-O 2.95Å
126	E	96.2	Very high	95.1	Very high	19 Å²	19	25.5 Å²	25.5	9%	0.089	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	135.1	176.6	-64.3	165.7	143.2	0	0	110.9	N102 A122 S124 I140 L141	N102-E126 PolarHBondContact ND2-OE1 3.23Å; A122-E126 PolarHBondContact N-O 2.75Å; S124-E126 VanDerWaalsContact CB-OE2 3.3Å; S124-E126 WeakPolarHBondContact CB-OE2 3.36Å; S124-E126 PolarHBondContact O-N 3.07Å; S124-E126 VanDerWaalsContact OG-CD 3.27Å; S124-E126 WeakPolarHBondContact OG-CG 3.41Å; S124-E126 PolarHBondContact OG-OE2 3.37Å; E126-I140 HydrophobicContact CB-CD1 4.22Å; E126-I140 HydrophobicContact CB-CG1 4.22Å; E126-I140 HydrophobicContact CG-CD1 4.15Å; E126-I140 HydrophobicContact CG-CG1 4.38Å; E126-L141 CarbonylContact C-O 3.54Å; E126-L141 WeakPolarHBondContact CA-O 3Å
127	F	96.3	Very high	95	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	134.1	154.2	-64.9	-31.4	0	0	0	109.2	I119 T120 L129 I140 L141 A143 I148 M151 T162 W172	I119-F127 HydrophobicContact CG2-CB 4.17Å; I119-F127 HydrophobicContact CG2-CD1 4.04Å; I119-F127 HydrophobicContact CG2-CG 4.04Å; T120-F127 WeakPolarHBondContact O-CA 3.5Å; F127-L129 HydrophobicContact CB-CD1 4.09Å; F127-I140 WeakPolarHBondContact O-CA 3.48Å; F127-L141 HydrophobicContact CB-CB 4.42Å; F127-L141 PolarHBondContact N-O 2.93Å; F127-L141 PolarHBondContact O-N 3.11Å; F127-A143 HydrophobicContact CD1-CB 3.89Å; F127-A143 HydrophobicContact CD2-CB 3.48Å; F127-A143 VanDerWaalsContact CD2-CB 3.48Å; F127-A143 HydrophobicContact CE1-CB 3.76Å; F127-A143 HydrophobicContact CE2-CB 3.34Å; F127-A143 HydrophobicContact CG-CB 3.72Å; F127-A143 HydrophobicContact CZ-CB 3.45Å; F127-A143 VanDerWaalsContact CZ-CB 3.45Å; F127-I148 HydrophobicContact CD1-CD1 3.4Å; F127-I148 HydrophobicContact CE1-CD1 3.29Å; F127-I148 HydrophobicContact CE1-CG2 4.26Å; F127-I148 HydrophobicContact CG-CD1 4.46Å; F127-I148 HydrophobicContact CZ-CD1 4.29Å; F127-M151 HydrophobicContact CD1-SD 3.8Å; F127-M151 HydrophobicContact CE1-CG 4.42Å; F127-M151 HydrophobicContact CE1-SD 3.43Å; F127-M151 WeakPolarHBondContact CE1-SD 3.46Å; F127-M151 HydrophobicContact CZ-SD 4.37Å; F127-T162 HydrophobicContact CE1-CG2 3.92Å; F127-T162 HydrophobicContact CZ-CG2 3.49Å; F127-T162 VanDerWaalsContact CZ-CG2 3.49Å; F127-W172 AromaticContact CE2-CD2 3.8Å; F127-W172 HydrophobicContact CE2-CD2 3.8Å; F127-W172 AromaticContact CE2-CE2 3.52Å; F127-W172 HydrophobicContact CE2-CE3 4.17Å; F127-W172 HydrophobicContact CE2-CG 4.34Å; F127-W172 HydrophobicContact CE2-CH2 4.07Å; F127-W172 AromaticContact CE2-CZ2 3.69Å; F127-W172 HydrophobicContact CE2-CZ2 3.69Å; F127-W172 HydrophobicContact CE2-CZ3 4.28Å; F127-W172 AromaticContact CE2-NE1 3.86Å; F127-W172 HydrophobicContact CZ-CD2 4.45Å; F127-W172 AromaticContact CZ-CE2 3.87Å; F127-W172 HydrophobicContact CZ-CZ2 4.14Å; F127-W172 AromaticContact CZ-NE1 3.75Å
128	T	96.3	Very high	94.9	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	126.5	165.4	41.7	0	0	0	0	110.7	N100 T120 F137 I140	N100-T128 WeakPolarHBondContact ND2-CG2 3.44Å; N100-T128 PolarHBondContact ND2-OG1 3.02Å; N100-T128 WeakPolarHBondContact OD1-CG2 3.37Å; N100-T128 PolarHBondContact OD1-OG1 2.87Å; T120-T128 PolarHBondContact N-O 3.23Å; T120-T128 PolarHBondContact O-N 3.39Å; T120-T128 PolarHBondContact OG1-O 3.22Å; T120-T128 VanDerWaalsContact OG1-O 3.05Å; T120-T128 PolarHBondContact OG1-OG1 2.63Å; T128-F137 HydrophobicContact CG2-CE2 4.31Å; T128-I140 HydrophobicContact CG2-CB 3.91Å; T128-I140 HydrophobicContact CG2-CD1 3.52Å; T128-I140 HydrophobicContact CG2-CG1 3.52Å
129	L	96.1	Very high	94.8	Very high	2 Å²	2	25.7 Å²	25.7	1%	0.01	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	123.1	-175.4	-85.4	68.8	0	0	0	109.7	L118 I119 F127 E138 T139 M176	L118-L129 CarbonylContact O-C 3.52Å; L118-L129 WeakPolarHBondContact O-CA 3.48Å; I119-L129 HydrophobicContact CG1-CD1 4.33Å; I119-L129 HydrophobicContact CG1-CG 4.21Å; I119-L129 HydrophobicContact CG2-CD1 4.38Å; F127-L129 HydrophobicContact CB-CD1 4.09Å; L129-E138 PolarHBondContact O-N 3.38Å; L129-T139 PolarHBondContact N-O 3.34Å; L129-M176 HydrophobicContact CD2-CG 3.89Å; L129-M176 HydrophobicContact CD2-SD 4.37Å
130	W	96.3	Very high	94.7	Very high	12 Å²	12	29.4 Å²	29.4	5%	0.045	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	142	177.4	-49.2	90	0	0	0	110.5	N100 R117 L118 T120 N136 F137 F385	N100-W130 WeakPolarHBondContact OD1-CZ2 3.44Å; R117-W130 CarbonylContact C-O 3.36Å; R117-W130 VanDerWaalsContact CA-O 3.31Å; R117-W130 WeakPolarHBondContact CA-O 3.34Å; L118-W130 HydrophobicContact CB-CB 4.25Å; L118-W130 PolarHBondContact N-O 2.8Å; L118-W130 PolarHBondContact O-N 2.91Å; T120-W130 PolarHBondContact OG1-NE1 3.03Å; W130-N136 CarbonylContact C-O 3.57Å; W130-N136 VanDerWaalsContact CA-O 3.32Å; W130-N136 WeakPolarHBondContact CA-O 3.37Å; W130-F137 HydrophobicContact CE3-CB 4.26Å; W130-F137 HydrophobicContact CZ3-CB 3.92Å; W130-F385 HydrophobicContact CB-CZ 4.22Å; W130-F385 HydrophobicContact CG-CZ 4.44Å
131	N	95.2	Very high	94.7	Very high	31 Å²	31	32.1 Å²	32.1	17%	0.166	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	131.2	175	-175	-91	0	0	0	111.2	L133 T134 F135 N136 E138	N131-L133 PolarHBondContact O-N 2.92Å; N131-L133 PolarHBondContact OD1-N 2.59Å; N131-T134 VanDerWaalsContact CG-OG1 3.24Å; N131-T134 PolarHBondContact OD1-N 2.95Å; N131-T134 PolarHBondContact OD1-OG1 2.9Å; N131-F135 WeakPolarHBondContact O-CA 3.5Å; N131-F135 PolarHBondContact O-N 3.07Å; N131-N136 PolarHBondContact N-O 2.96Å; N131-E138 WeakPolarHBondContact CA-OE1 3.49Å; N131-E138 HydrophobicContact CB-CG 4.07Å; N131-E138 VanDerWaalsContact CB-OE1 3.31Å; N131-E138 WeakPolarHBondContact CB-OE1 3.33Å; N131-E138 PolarHBondContact ND2-OE1 3.28Å
132	G	92.3	Very high	94.6	Very high	2 Å²	2	38 Å²	38	2%	0.021	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-25.8	-172.7	0	0	0	0	0	116.6	R116 F135	R116-G132 WeakPolarHBondContact O-CA 3.38Å; R116-G132 PolarHBondContact O-N 3.27Å; G132-F135 WeakPolarHBondContact O-CE1 3.48Å
133	L	92.8	Very high	94.5	Very high	52 Å²	52	38.1 Å²	38.1	27%	0.272	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.7	-37.3	-178.6	-68.9	165.4	0	0	0	112.3	T40 I41 Y43 N131 F135	T40-L133 WeakPolarHBondContact CA-O 3.15Å; I41-L133 PolarHBondContact N-O 3.45Å; I41-L133 WeakPolarHBondContact O-CD2 3.32Å; Y43-L133 HydrophobicContact CD1-CD2 3.75Å; Y43-L133 HydrophobicContact CE1-CD2 3.5Å; Y43-L133 VanDerWaalsContact CE1-CD2 3.5Å; Y43-L133 HydrophobicContact CE1-CG 4.39Å; N131-L133 PolarHBondContact O-N 2.92Å; N131-L133 PolarHBondContact OD1-N 2.59Å; L133-F135 WeakPolarHBondContact O-CE2 3.45Å
134	T	92.8	Very high	94.5	Very high	39 Å²	39	33.8 Å²	33.8	24%	0.239	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-118.5	-1.7	-167.9	67.2	0	0	0	0	113.8	T40 N131 N136	T40-T134 HydrophobicContact CG2-CG2 3.96Å; N131-T134 VanDerWaalsContact CG-OG1 3.24Å; N131-T134 PolarHBondContact OD1-N 2.95Å; N131-T134 PolarHBondContact OD1-OG1 2.9Å; T134-N136 WeakPolarHBondContact CB-ND2 3.4Å; T134-N136 PolarHBondContact O-N 3.5Å; T134-N136 PolarHBondContact O-ND2 3.3Å; T134-N136 PolarHBondContact OG1-ND2 3.48Å
135	F	93.2	Very high	94.5	Very high	3 Å²	3	41.3 Å²	41.3	1%	0.013	21%	0.206	C	C	.	.			trans	57	21	174.1	-44.9	-64.3	0	0	0	115.7	I41 V95 R96 S98 N131 G132 L133 I373 F385	I41-F135 HydrophobicContact CB-CE2 4.18Å; I41-F135 HydrophobicContact CB-CZ 4.12Å; I41-F135 HydrophobicContact CD1-CE2 4.24Å; I41-F135 HydrophobicContact CD1-CZ 4.28Å; I41-F135 HydrophobicContact CG1-CE2 4.04Å; I41-F135 HydrophobicContact CG1-CZ 4.31Å; V95-F135 HydrophobicContact CG1-CD2 3.84Å; V95-F135 HydrophobicContact CG1-CE2 3.49Å; V95-F135 VanDerWaalsContact CG1-CE2 3.49Å; V95-F135 HydrophobicContact CG1-CZ 4.23Å; R96-F135 HydrophobicContact CB-CB 3.96Å; R96-F135 HydrophobicContact CB-CD2 4.25Å; R96-F135 HydrophobicContact CB-CG 4.23Å; R96-F135 HydrophobicContact CG-CB 3.86Å; S98-F135 PolarHBondContact OG-O 2.9Å; N131-F135 WeakPolarHBondContact O-CA 3.5Å; N131-F135 PolarHBondContact O-N 3.07Å; G132-F135 WeakPolarHBondContact O-CE1 3.48Å; L133-F135 WeakPolarHBondContact O-CE2 3.45Å; F135-I373 HydrophobicContact CE1-CD1 4.08Å; F135-I373 HydrophobicContact CZ-CD1 3.78Å; F135-F385 HydrophobicContact CB-CD2 4.21Å; F135-F385 HydrophobicContact CB-CE2 4.15Å; F135-F385 HydrophobicContact CB-CZ 4.47Å; F135-F385 HydrophobicContact CD1-CB 4.22Å; F135-F385 AromaticContact CD1-CD1 3.24Å; F135-F385 HydrophobicContact CD1-CD1 3.24Å; F135-F385 AromaticContact CD1-CD2 3.94Å; F135-F385 HydrophobicContact CD1-CD2 3.94Å; F135-F385 AromaticContact CD1-CE1 3.4Å; F135-F385 HydrophobicContact CD1-CE1 3.4Å; F135-F385 VanDerWaalsContact CD1-CE1 3.4Å; F135-F385 HydrophobicContact CD1-CE2 4.07Å; F135-F385 AromaticContact CD1-CG 3.53Å; F135-F385 HydrophobicContact CD1-CG 3.53Å; F135-F385 AromaticContact CD1-CZ 3.82Å; F135-F385 HydrophobicContact CD1-CZ 3.82Å; F135-F385 HydrophobicContact CE1-CB 4.29Å; F135-F385 AromaticContact CE1-CD1 3.41Å; F135-F385 HydrophobicContact CE1-CD1 3.41Å; F135-F385 VanDerWaalsContact CE1-CD1 3.41Å; F135-F385 AromaticContact CE1-CE1 3.86Å; F135-F385 HydrophobicContact CE1-CE1 3.86Å; F135-F385 AromaticContact CE1-CG 3.92Å; F135-F385 HydrophobicContact CE1-CG 3.92Å; F135-F385 HydrophobicContact CG-CD1 4.22Å; F135-F385 HydrophobicContact CG-CD2 4.19Å; F135-F385 HydrophobicContact CG-CE1 4.47Å; F135-F385 HydrophobicContact CG-CE2 4.43Å; F135-F385 HydrophobicContact CG-CG 4.08Å
136	N	92.9	Very high	94.6	Very high	38 Å²	38	42.3 Å²	42.3	20%	0.203	21%	0.213	C	C	.	.			trans	-82.7	150.7	178.9	-66.3	-68.1	0	0	0	111.6	R38 W130 N131 T134 E138	R38-N136 WeakPolarHBondContact CD-ND2 3.31Å; R38-N136 VanDerWaalsContact CD-OD1 3.31Å; R38-N136 WeakPolarHBondContact CD-OD1 3.27Å; R38-N136 PolarHBondContact NH1-ND2 3.41Å; R38-N136 PolarHBondContact NH1-OD1 3.33Å; W130-N136 CarbonylContact C-O 3.57Å; W130-N136 VanDerWaalsContact CA-O 3.32Å; W130-N136 WeakPolarHBondContact CA-O 3.37Å; N131-N136 PolarHBondContact N-O 2.96Å; T134-N136 WeakPolarHBondContact CB-ND2 3.4Å; T134-N136 PolarHBondContact O-N 3.5Å; T134-N136 PolarHBondContact O-ND2 3.3Å; T134-N136 PolarHBondContact OG1-ND2 3.48Å; N136-E138 PolarHBondContact O-N 3.23Å
137	F	93.7	Very high	94.6	Very high	109 Å²	109	43 Å²	43	48%	0.478	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-60	128	165.9	176.7	-93	0	0	0	110.1	T128 W130 T139 I140	T128-F137 HydrophobicContact CG2-CE2 4.31Å; W130-F137 HydrophobicContact CE3-CB 4.26Å; W130-F137 HydrophobicContact CZ3-CB 3.92Å; F137-T139 VanDerWaalsContact CZ-C 3.47Å; F137-I140 HydrophobicContact CE2-CB 3.99Å; F137-I140 HydrophobicContact CZ-CB 3.9Å; F137-I140 HydrophobicContact CZ-CG2 4Å
138	E	93.3	Very high	94.6	Very high	50 Å²	50	43 Å²	43	23%	0.234	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	-62.5	169.8	-65.4	-164.6	-171.6	0	0	110.9	R117 L129 N131 N136	R117-E138 IonicContact CZ-OE2 2.75Å; R117-E138 IonicContact NE-OE2 3.54Å; R117-E138 PolarHBondContact NE-OE2 3.37Å; R117-E138 IonicContact NH2-OE2 2.74Å; R117-E138 PolarHBondContact NH2-OE2 3.19Å; L129-E138 PolarHBondContact O-N 3.38Å; N131-E138 WeakPolarHBondContact CA-OE1 3.49Å; N131-E138 HydrophobicContact CB-CG 4.07Å; N131-E138 VanDerWaalsContact CB-OE1 3.31Å; N131-E138 WeakPolarHBondContact CB-OE1 3.33Å; N131-E138 PolarHBondContact ND2-OE1 3.28Å; N136-E138 PolarHBondContact O-N 3.23Å
139	T	94.4	Very high	94.6	Very high	59 Å²	59	45 Å²	45	36%	0.362	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	161.9	-176.3	59.8	0	0	0	0	112.3	L129 F137	L129-T139 PolarHBondContact N-O 3.34Å; F137-T139 VanDerWaalsContact CZ-C 3.47Å
140	I	94.7	Very high	94.5	Very high	77 Å²	77	45.6 Å²	45.6	40%	0.395	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	141.4	169	-172.5	161.6	0	0	0	108.4	E126 F127 T128 F137	E126-I140 HydrophobicContact CB-CD1 4.22Å; E126-I140 HydrophobicContact CB-CG1 4.22Å; E126-I140 HydrophobicContact CG-CD1 4.15Å; E126-I140 HydrophobicContact CG-CG1 4.38Å; F127-I140 WeakPolarHBondContact O-CA 3.48Å; T128-I140 HydrophobicContact CG2-CB 3.91Å; T128-I140 HydrophobicContact CG2-CD1 3.52Å; T128-I140 HydrophobicContact CG2-CG1 3.52Å; F137-I140 HydrophobicContact CE2-CB 3.99Å; F137-I140 HydrophobicContact CZ-CB 3.9Å; F137-I140 HydrophobicContact CZ-CG2 4Å
141	L	95.2	Very high	94.5	Very high	59 Å²	59	45.9 Å²	45.9	31%	0.309	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	133.6	179	-62.3	171.3	0	0	0	109.1	E126 F127 A143 M176	E126-L141 CarbonylContact C-O 3.54Å; E126-L141 WeakPolarHBondContact CA-O 3Å; F127-L141 HydrophobicContact CB-CB 4.42Å; F127-L141 PolarHBondContact N-O 2.93Å; F127-L141 PolarHBondContact O-N 3.11Å; L141-A143 PolarHBondContact O-N 3.26Å; L141-M176 HydrophobicContact CD1-CB 3.51Å; L141-M176 HydrophobicContact CD1-CG 4.07Å
142	Q	94.3	Very high	94.6	Very high	122 Å²	122	48.6 Å²	48.6	57%	0.57	24%	0.24	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-77.8	105.9	167.6	-167.8	68	35.4	0	0	108.1	S124 H144	S124-Q142 PolarHBondContact O-NE2 3.44Å; Q142-H144 PolarHBondContact NE2-O 2.97Å
143	A	94.4	Very high	94.8	Very high	3 Å²	3	49.4 Å²	49.4	3%	0.025	24%	0.243	C	C	.	.			trans	-97	-45.3	-171.9	0	0	0	0	0	112.3	G125 F127 L141 I148 K170 W172	G125-A143 PolarHBondContact O-N 3.19Å; F127-A143 HydrophobicContact CD1-CB 3.89Å; F127-A143 HydrophobicContact CD2-CB 3.48Å; F127-A143 VanDerWaalsContact CD2-CB 3.48Å; F127-A143 HydrophobicContact CE1-CB 3.76Å; F127-A143 HydrophobicContact CE2-CB 3.34Å; F127-A143 HydrophobicContact CG-CB 3.72Å; F127-A143 HydrophobicContact CZ-CB 3.45Å; F127-A143 VanDerWaalsContact CZ-CB 3.45Å; L141-A143 PolarHBondContact O-N 3.26Å; A143-I148 HydrophobicContact CB-CD1 4.05Å; A143-K170 WeakPolarHBondContact O-CD 3.47Å; A143-K170 WeakPolarHBondContact O-CE 3.38Å; A143-K170 PolarHBondContact O-NZ 3.28Å; A143-W172 HydrophobicContact CB-CH2 3.88Å; A143-W172 HydrophobicContact CB-CZ2 3.61Å
144	H	95.7	Very high	94.9	Very high	2 Å²	2	47.2 Å²	47.2	1%	0.009	23%	0.232	C	C	.	.			trans	-127.9	161.2	179.1	-70.4	-102.5	0	0	0	110.1	G125 Q142 S146 I148 T162 D164	G125-H144 WeakPolarHBondContact CA-O 3.38Å; G125-H144 PolarHBondContact O-N 2.99Å; Q142-H144 PolarHBondContact NE2-O 2.97Å; H144-S146 VanDerWaalsContact C-N 3.32Å; H144-I148 HydrophobicContact CB-CG1 4.35Å; H144-T162 PolarHBondContact NE2-OG1 2.98Å; H144-D164 HydrophobicContact CB-CB 4.1Å; H144-D164 IonicContact CE1-OD2 2.71Å; H144-D164 IonicContact CG-OD2 3.66Å; H144-D164 WeakPolarHBondContact ND1-CB 3.35Å; H144-D164 IonicContact ND1-OD2 3.77Å; H144-D164 PolarHBondContact ND1-OD2 3.42Å
145	E	94.4	Very high	94.9	Very high	189 Å²	189	50.2 Å²	50.2	88%	0.883	24%	0.243	S	C	*	.	S	Bend	trans	-83.8	-15.9	172.2	-64.1	176	-174.1	0	0	111.9
146	S	95.7	Very high	94.9	Very high	20 Å²	20	53.3 Å²	53.3	14%	0.14	26%	0.259	C	S	.	.	S	Bend	trans	-124.4	172.9	-174.8	-166.2	0	0	0	0	111.2	G125 H144 I148 S166	G125-S146 VanDerWaalsContact CA-O 3.26Å; G125-S146 WeakPolarHBondContact CA-O 2.95Å; H144-S146 VanDerWaalsContact C-N 3.32Å; S146-I148 PolarHBondContact O-N 3.43Å; S146-S166 WeakPolarHBondContact CB-OG 3.41Å
147	Q	95.9	Very high	94.9	Very high	35 Å²	35	56.3 Å²	56.3	16%	0.164	27%	0.272	C	S	.	.			trans	-61.5	126.8	-175.9	-51.7	87.8	55.9	0	0	111.1	Y107 F123 R149 D164 H165	Y107-Q147 HydrophobicContact CD2-CB 4.1Å; Y107-Q147 HydrophobicContact CE2-CB 3.85Å; Y107-Q147 HydrophobicContact CE2-CG 4.02Å; F123-Q147 HydrophobicContact CB-CG 4.34Å; F123-Q147 HydrophobicContact CD1-CG 4.11Å; F123-Q147 HydrophobicContact CD2-CG 3.44Å; F123-Q147 VanDerWaalsContact CD2-CG 3.44Å; F123-Q147 HydrophobicContact CE1-CG 4.21Å; F123-Q147 HydrophobicContact CE2-CG 3.55Å; F123-Q147 HydrophobicContact CG-CG 3.71Å; F123-Q147 HydrophobicContact CZ-CG 3.93Å; F123-Q147 WeakPolarHBondContact O-CA 3.5Å; F123-Q147 WeakPolarHBondContact O-CG 3.38Å; Q147-R149 PolarHBondContact O-N 3.11Å; Q147-D164 CarbonylContact O-C 3.56Å; Q147-D164 VanDerWaalsContact O-CA 3.27Å; Q147-D164 WeakPolarHBondContact O-CA 3.49Å; Q147-D164 WeakPolarHBondContact O-CB 3.49Å; Q147-H165 HydrophobicContact CB-CB 4.13Å; Q147-H165 PolarHBondContact O-N 2.79Å; Q147-H165 PolarHBondContact OE1-CD2 2.8Å; Q147-H165 VanDerWaalsContact OE1-CD2 3.26Å
148	I	96.8	Very high	94.9	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	125	176.2	-40.5	-171.2	0	0	0	108	Y107 A122 F127 A143 H144 S146 M151	Y107-I148 VanDerWaalsContact CB-O 3.31Å; Y107-I148 WeakPolarHBondContact CB-O 3.32Å; A122-I148 PolarHBondContact O-N 2.92Å; F127-I148 HydrophobicContact CD1-CD1 3.4Å; F127-I148 HydrophobicContact CE1-CD1 3.29Å; F127-I148 HydrophobicContact CE1-CG2 4.26Å; F127-I148 HydrophobicContact CG-CD1 4.46Å; F127-I148 HydrophobicContact CZ-CD1 4.29Å; A143-I148 HydrophobicContact CB-CD1 4.05Å; H144-I148 HydrophobicContact CB-CG1 4.35Å; S146-I148 PolarHBondContact O-N 3.43Å; I148-M151 HydrophobicContact CG2-CG 3.95Å; I148-M151 HydrophobicContact CG2-SD 4.3Å
149	R	95.9	Very high	95	Very high	41 Å²	41	56.7 Å²	56.7	16%	0.155	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	-38.2	-174	-68.7	-60.4	-122.1	-158.8	-5.2	113.2	Y107 Q147 A163 H165 I189	Y107-R149 VanDerWaalsContact CE1-NH1 3.31Å; Q147-R149 PolarHBondContact O-N 3.11Å; R149-A163 PolarHBondContact N-O 2.69Å; R149-H165 HydrophobicContact CG-CB 4.28Å; R149-I189 WeakPolarHBondContact CB-O 3.21Å; R149-I189 VanDerWaalsContact CG-O 3.31Å; R149-I189 WeakPolarHBondContact CG-O 3.41Å
150	C	95.3	Very high	95.1	Very high	14 Å²	14	54 Å²	54	10%	0.095	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145	147.7	180	51.6	0	0	0	0	111.1	T162 A163	C150-T162 WeakPolarHBondContact O-CA 3.46Å; C150-A163 PolarHBondContact N-O 2.79Å; C150-A163 PolarHBondContact O-N 3.03Å
151	M	96	Very high	95.2	Very high	18 Å²	18	50.3 Å²	50.3	9%	0.089	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	135.5	177.3	-58.7	-172.6	-59.7	0	0	107.4	C108 C110 I119 F127 I148 L160 L161 T162	C108-M151 HydrophobicContact CB-CE 4.1Å; C108-M151 HydrophobicContact CB-CG 4.31Å; C108-M151 WeakPolarHBondContact O-CE 3.16Å; C110-M151 HydrophobicContact CB-CB 4.34Å; C110-M151 HydrophobicContact CB-CE 4.18Å; I119-M151 HydrophobicContact CB-CE 4.46Å; I119-M151 HydrophobicContact CG2-CE 4.03Å; I119-M151 HydrophobicContact CG2-SD 3.97Å; I119-M151 WeakPolarHBondContact O-CE 3.15Å; F127-M151 HydrophobicContact CD1-SD 3.8Å; F127-M151 HydrophobicContact CE1-CG 4.42Å; F127-M151 HydrophobicContact CE1-SD 3.43Å; F127-M151 WeakPolarHBondContact CE1-SD 3.46Å; F127-M151 HydrophobicContact CZ-SD 4.37Å; I148-M151 HydrophobicContact CG2-CG 3.95Å; I148-M151 HydrophobicContact CG2-SD 4.3Å; M151-L160 HydrophobicContact CB-CD1 4.24Å; M151-L161 CarbonylContact C-O 3.59Å; M151-L161 WeakPolarHBondContact CA-O 3.11Å; M151-T162 HydrophobicContact CB-CG2 4.02Å; M151-T162 HydrophobicContact CG-CG2 3.61Å; M151-T162 HydrophobicContact SD-CG2 4.17Å
152	K	96.4	Very high	95.3	Very high	89 Å²	89	47.5 Å²	47.5	39%	0.387	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-149	135	178.9	-172.7	67.9	178.9	179.6	0	109.1	L161 F194	K152-L161 PolarHBondContact N-O 2.91Å; K152-L161 PolarHBondContact O-N 2.9Å; K152-F194 HydrophobicContact CB-CE2 4.45Å; K152-F194 HydrophobicContact CG-CD2 3.94Å; K152-F194 HydrophobicContact CG-CE2 4.32Å; K152-F194 WeakPolarHBondContact O-CE2 3.26Å
153	W	96.2	Very high	95.4	Very high	19 Å²	19	41.7 Å²	41.7	7%	0.072	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	148.8	168.8	-71.6	96.3	0	0	0	111.1	C110 W111 T112 P113 I119 E157 W159 L160 A174 M176 F194	C110-W153 VanDerWaalsContact SG-CD1 3.55Å; W111-W153 PolarHBondContact O-NE1 3.49Å; T112-W153 HydrophobicContact CG2-CZ2 3.95Å; P113-W153 HydrophobicContact CG-CB 4.01Å; P113-W153 HydrophobicContact CG-CD2 3.88Å; P113-W153 HydrophobicContact CG-CE3 4.11Å; P113-W153 HydrophobicContact CG-CG 3.82Å; I119-W153 HydrophobicContact CD1-CZ2 3.71Å; W153-E157 WeakPolarHBondContact CZ3-O 3.46Å; W153-W159 CarbonylContact C-O 3.58Å; W153-W159 WeakPolarHBondContact CA-O 3.5Å; W153-L160 HydrophobicContact CD2-CB 3.9Å; W153-L160 HydrophobicContact CD2-CD1 4.19Å; W153-L160 HydrophobicContact CE3-CB 3.79Å; W153-L160 HydrophobicContact CG-CD1 4.29Å; W153-L160 HydrophobicContact CH2-CB 3.91Å; W153-L160 HydrophobicContact CZ2-CB 4.02Å; W153-L160 HydrophobicContact CZ2-CD2 4.11Å; W153-L160 HydrophobicContact CZ2-CG 4.46Å; W153-L160 HydrophobicContact CZ3-CB 3.8Å; W153-A174 HydrophobicContact CZ3-CB 4.37Å; W153-M176 HydrophobicContact CH2-CE 3.66Å; W153-M176 HydrophobicContact CZ2-CE 3.79Å; W153-F194 WeakPolarHBondContact O-CD2 3.19Å; W153-F194 WeakPolarHBondContact O-CE2 3.38Å
154	S	95.3	Very high	95.5	Very high	6 Å²	6	41.7 Å²	41.7	4%	0.042	20%	0.195	C	C	.	.			trans	-63.1	158	163.6	57	0	0	0	0	110.9	N156 E157 W159 F194 D198	S154-N156 VanDerWaalsContact C-N 3.26Å; S154-N156 VanDerWaalsContact CB-OD1 3.29Å; S154-N156 WeakPolarHBondContact CB-OD1 3.42Å; S154-N156 PolarHBondContact O-N 3.29Å; S154-N156 PolarHBondContact OG-OD1 3.17Å; S154-E157 PolarHBondContact O-N 3.06Å; S154-W159 PolarHBondContact N-O 2.9Å; S154-W159 PolarHBondContact OG-N 2.93Å; S154-W159 VanDerWaalsContact OG-N 3.1Å; S154-W159 PolarHBondContact OG-O 3Å; S154-W159 VanDerWaalsContact OG-O 3.06Å; S154-F194 VanDerWaalsContact N-CE2 3.28Å; S154-D198 WeakPolarHBondContact CA-OD1 3.49Å; S154-D198 WeakPolarHBondContact CB-OD1 3.28Å
155	H	92.9	Very high	95.5	Very high	102 Å²	102	44.5 Å²	44.5	47%	0.472	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-24.5	175.5	-64.5	-82.2	0	0	0	112.3	E157 D198	H155-E157 VanDerWaalsContact C-N 3.3Å; H155-E157 PolarHBondContact O-N 2.85Å; H155-D198 WeakPolarHBondContact CA-OD2 3.4Å; H155-D198 IonicContact CD2-OD1 3.9Å; H155-D198 PolarHBondContact CD2-OD1 2.98Å; H155-D198 IonicContact CG-OD1 3.42Å; H155-D198 VanDerWaalsContact N-CG 3.31Å; H155-D198 PolarHBondContact N-OD1 2.81Å; H155-D198 PolarHBondContact N-OD2 2.83Å
156	N	93	Very high	95.6	Very high	68 Å²	68	37.3 Å²	37.3	36%	0.364	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.2	1.5	174.1	84.3	-16.9	0	0	0	115.1	S154 E158 D198	S154-N156 VanDerWaalsContact C-N 3.26Å; S154-N156 VanDerWaalsContact CB-OD1 3.29Å; S154-N156 WeakPolarHBondContact CB-OD1 3.42Å; S154-N156 PolarHBondContact O-N 3.29Å; S154-N156 PolarHBondContact OG-OD1 3.17Å; N156-E158 VanDerWaalsContact ND2-CD 3.25Å; N156-E158 PolarHBondContact ND2-OE2 2.96Å; N156-E158 PolarHBondContact O-N 2.89Å; N156-E158 PolarHBondContact OD1-N 3.35Å; N156-D198 WeakPolarHBondContact CB-OD2 3.42Å; N156-D198 PolarHBondContact N-OD2 3.22Å
157	E	93.1	Very high	95.5	Very high	101 Å²	101	36.4 Å²	36.4	47%	0.472	17%	0.172	S	C	.	.	S	Bend	trans	65.8	-8.4	178	-44.8	-168	162.1	0	0	117.1	P113 W153 S154 H155	P113-E157 HydrophobicContact CB-CB 3.82Å; P113-E157 HydrophobicContact CB-CG 3.47Å; P113-E157 VanDerWaalsContact CB-CG 3.47Å; P113-E157 WeakPolarHBondContact CB-OE1 3.48Å; P113-E157 HydrophobicContact CG-CB 3.82Å; P113-E157 HydrophobicContact CG-CG 3.91Å; W153-E157 WeakPolarHBondContact CZ3-O 3.46Å; S154-E157 PolarHBondContact O-N 3.06Å; H155-E157 VanDerWaalsContact C-N 3.3Å; H155-E157 PolarHBondContact O-N 2.85Å
158	E	93.8	Very high	95.6	Very high	111 Å²	111	38.4 Å²	38.4	52%	0.519	18%	0.179	S	C	.	.	S	Bend	trans	-74	-33.3	-176.9	-65	176.8	164.6	0	0	113.5	N156 A174	N156-E158 VanDerWaalsContact ND2-CD 3.25Å; N156-E158 PolarHBondContact ND2-OE2 2.96Å; N156-E158 PolarHBondContact O-N 2.89Å; N156-E158 PolarHBondContact OD1-N 3.35Å; E158-A174 PolarHBondContact O-N 2.66Å; E158-A174 VanDerWaalsContact O-N 3.12Å
159	W	95.3	Very high	95.6	Very high	56 Å²	56	38.4 Å²	38.4	21%	0.212	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	132	-164.1	-62.1	101.2	0	0	0	112.8	W153 S154 W172 Q173 V179 F215	W153-W159 CarbonylContact C-O 3.58Å; W153-W159 WeakPolarHBondContact CA-O 3.5Å; S154-W159 PolarHBondContact N-O 2.9Å; S154-W159 PolarHBondContact OG-N 2.93Å; S154-W159 VanDerWaalsContact OG-N 3.1Å; S154-W159 PolarHBondContact OG-O 3Å; S154-W159 VanDerWaalsContact OG-O 3.06Å; W159-W172 WeakPolarHBondContact CA-O 3.44Å; W159-Q173 HydrophobicContact CE3-CG 4.42Å; W159-Q173 HydrophobicContact CH2-CG 4.2Å; W159-Q173 HydrophobicContact CZ3-CG 3.91Å; W159-V179 HydrophobicContact CH2-CG1 4.43Å; W159-V179 HydrophobicContact CH2-CG2 4.23Å; W159-V179 HydrophobicContact CZ3-CB 4.14Å; W159-V179 HydrophobicContact CZ3-CG1 4.41Å; W159-V179 HydrophobicContact CZ3-CG2 3.79Å; W159-F215 HydrophobicContact CB-CE2 4.36Å; W159-F215 HydrophobicContact CB-CZ 3.85Å; W159-F215 AromaticContact CD1-CE1 3.98Å; W159-F215 AromaticContact CD1-CZ 3.75Å; W159-F215 HydrophobicContact CD2-CE1 4.25Å; W159-F215 AromaticContact CD2-CZ 3.73Å; W159-F215 HydrophobicContact CD2-CZ 3.73Å; W159-F215 HydrophobicContact CE3-CZ 4.29Å; W159-F215 HydrophobicContact CG-CE1 4.14Å; W159-F215 HydrophobicContact CG-CE2 4.44Å; W159-F215 AromaticContact CG-CZ 3.49Å; W159-F215 HydrophobicContact CG-CZ 3.49Å; W159-F215 VanDerWaalsContact CG-CZ 3.49Å
160	L	96.5	Very high	95.6	Very high	1 Å²	1	37.5 Å²	37.5	1%	0.005	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	117.7	170.1	167	68.7	0	0	0	108.4	I119 M151 W153 T162 W172 M176	I119-L160 HydrophobicContact CD1-CD2 3.73Å; M151-L160 HydrophobicContact CB-CD1 4.24Å; W153-L160 HydrophobicContact CD2-CB 3.9Å; W153-L160 HydrophobicContact CD2-CD1 4.19Å; W153-L160 HydrophobicContact CE3-CB 3.79Å; W153-L160 HydrophobicContact CG-CD1 4.29Å; W153-L160 HydrophobicContact CH2-CB 3.91Å; W153-L160 HydrophobicContact CZ2-CB 4.02Å; W153-L160 HydrophobicContact CZ2-CD2 4.11Å; W153-L160 HydrophobicContact CZ2-CG 4.46Å; W153-L160 HydrophobicContact CZ3-CB 3.8Å; L160-T162 HydrophobicContact CD1-CG2 4.09Å; L160-T162 HydrophobicContact CD2-CG2 4.15Å; L160-T162 HydrophobicContact CG-CG2 3.83Å; L160-W172 HydrophobicContact CB-CB 3.98Å; L160-W172 HydrophobicContact CD2-CB 4.24Å; L160-W172 HydrophobicContact CG-CB 4.28Å; L160-W172 PolarHBondContact N-O 3.25Å; L160-W172 WeakPolarHBondContact O-CB 3.25Å; L160-W172 PolarHBondContact O-N 3.46Å; L160-M176 HydrophobicContact CD2-CE 4.33Å; L160-M176 HydrophobicContact CD2-SD 4.35Å
161	L	96.4	Very high	95.6	Very high	1 Å²	1	37.2 Å²	37.2	1%	0.005	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	129.8	169.7	-88.9	-178.5	0	0	0	110	M151 K152 V169 Y171 V192 F194 F201	M151-L161 CarbonylContact C-O 3.59Å; M151-L161 WeakPolarHBondContact CA-O 3.11Å; K152-L161 PolarHBondContact N-O 2.91Å; K152-L161 PolarHBondContact O-N 2.9Å; L161-V169 HydrophobicContact CD2-CG1 3.6Å; L161-Y171 HydrophobicContact CD2-CD1 3.42Å; L161-Y171 VanDerWaalsContact CD2-CD1 3.42Å; L161-Y171 HydrophobicContact CD2-CE1 3.47Å; L161-Y171 VanDerWaalsContact CD2-CE1 3.47Å; L161-Y171 HydrophobicContact CD2-CG 4.19Å; L161-Y171 HydrophobicContact CG-CD1 4.31Å; L161-Y171 HydrophobicContact CG-CE1 4.38Å; L161-V192 HydrophobicContact CB-CG1 4.18Å; L161-V192 HydrophobicContact CD1-CG1 4.02Å; L161-F194 HydrophobicContact CB-CE2 3.96Å; L161-F194 HydrophobicContact CB-CZ 3.87Å; L161-F194 HydrophobicContact CD1-CD1 4.36Å; L161-F194 HydrophobicContact CD1-CE1 3.64Å; L161-F194 HydrophobicContact CD1-CE2 3.89Å; L161-F194 HydrophobicContact CD1-CZ 3.38Å; L161-F194 HydrophobicContact CG-CE1 4.13Å; L161-F194 HydrophobicContact CG-CE2 4.07Å; L161-F194 HydrophobicContact CG-CZ 3.48Å; L161-F194 VanDerWaalsContact CG-CZ 3.48Å; L161-F201 HydrophobicContact CD1-CB 3.96Å; L161-F201 HydrophobicContact CD1-CD1 3.93Å; L161-F201 HydrophobicContact CD1-CD2 3.66Å; L161-F201 HydrophobicContact CD1-CE1 4.37Å; L161-F201 HydrophobicContact CD1-CE2 4.13Å; L161-F201 HydrophobicContact CD1-CG 3.55Å; L161-F201 HydrophobicContact CD1-CZ 4.46Å
162	T	97.3	Very high	95.6	Very high	0 Å²	0	37 Å²	37	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	147.4	174	66.3	0	0	0	0	111.4	F127 H144 C150 M151 L160 V169 K170 W172	F127-T162 HydrophobicContact CE1-CG2 3.92Å; F127-T162 HydrophobicContact CZ-CG2 3.49Å; F127-T162 VanDerWaalsContact CZ-CG2 3.49Å; H144-T162 PolarHBondContact NE2-OG1 2.98Å; C150-T162 WeakPolarHBondContact O-CA 3.46Å; M151-T162 HydrophobicContact CB-CG2 4.02Å; M151-T162 HydrophobicContact CG-CG2 3.61Å; M151-T162 HydrophobicContact SD-CG2 4.17Å; L160-T162 HydrophobicContact CD1-CG2 4.09Å; L160-T162 HydrophobicContact CD2-CG2 4.15Å; L160-T162 HydrophobicContact CG-CG2 3.83Å; T162-V169 WeakPolarHBondContact O-CA 3.42Å; T162-K170 PolarHBondContact N-O 3.16Å; T162-K170 VanDerWaalsContact N-O 3.14Å; T162-K170 PolarHBondContact O-N 2.92Å; T162-W172 PolarHBondContact OG1-NE1 3.41Å
163	A	96.8	Very high	95.6	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	150.8	177.6	0	0	0	0	0	112.6	R149 C150 Y168 V169 I189 V192	R149-A163 PolarHBondContact N-O 2.69Å; C150-A163 PolarHBondContact N-O 2.79Å; C150-A163 PolarHBondContact O-N 3.03Å; A163-Y168 VanDerWaalsContact CA-O 3.31Å; A163-Y168 WeakPolarHBondContact CA-O 3.39Å; A163-V169 HydrophobicContact CB-CG2 3.95Å; A163-I189 HydrophobicContact CB-CB 3.84Å; A163-I189 HydrophobicContact CB-CD1 3.94Å; A163-I189 HydrophobicContact CB-CG2 3.56Å; A163-V192 HydrophobicContact CB-CG2 4.12Å
164	D	96.5	Very high	95.4	Very high	2 Å²	2	37.6 Å²	37.6	1%	0.011	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	176.3	-172.2	66.2	34.3	0	0	0	114.7	H144 Q147 S166 G167 Y168 I189	H144-D164 HydrophobicContact CB-CB 4.1Å; H144-D164 IonicContact CE1-OD2 2.71Å; H144-D164 IonicContact CG-OD2 3.66Å; H144-D164 WeakPolarHBondContact ND1-CB 3.35Å; H144-D164 IonicContact ND1-OD2 3.77Å; H144-D164 PolarHBondContact ND1-OD2 3.42Å; Q147-D164 CarbonylContact O-C 3.56Å; Q147-D164 VanDerWaalsContact O-CA 3.27Å; Q147-D164 WeakPolarHBondContact O-CA 3.49Å; Q147-D164 WeakPolarHBondContact O-CB 3.49Å; D164-S166 VanDerWaalsContact C-N 3.27Å; D164-S166 PolarHBondContact O-N 3.3Å; D164-S166 WeakPolarHBondContact OD1-CA 3.46Å; D164-S166 WeakPolarHBondContact OD1-CB 3.34Å; D164-S166 PolarHBondContact OD1-N 2.96Å; D164-S166 PolarHBondContact OD1-OG 3.02Å; D164-S166 PolarHBondContact OD2-OG 2.91Å; D164-G167 PolarHBondContact O-N 3.32Å; D164-G167 PolarHBondContact OD1-N 3.16Å; D164-Y168 PolarHBondContact N-O 3.37Å; D164-Y168 PolarHBondContact OD1-N 3.23Å; D164-I189 PolarHBondContact O-N 2.87Å
165	H	96.5	Very high	95.3	Very high	62 Å²	62	42.4 Å²	42.4	29%	0.287	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-14	177.3	-168.3	92.8	0	0	0	113.7	Q147 R149 P188	Q147-H165 HydrophobicContact CB-CB 4.13Å; Q147-H165 PolarHBondContact O-N 2.79Å; Q147-H165 PolarHBondContact OE1-CD2 2.8Å; Q147-H165 VanDerWaalsContact OE1-CD2 3.26Å; R149-H165 HydrophobicContact CG-CB 4.28Å; H165-P188 HydrophobicContact CB-CB 4.33Å; H165-P188 WeakPolarHBondContact CE1-CG 3.14Å; H165-P188 WeakPolarHBondContact ND1-CB 3.33Å; H165-P188 WeakPolarHBondContact ND1-CG 3.31Å; H165-P188 WeakPolarHBondContact NE2-CG 3.27Å; H165-P188 WeakPolarHBondContact O-CA 3.37Å; H165-P188 VanDerWaalsContact O-CG 3.3Å; H165-P188 WeakPolarHBondContact O-CG 3.38Å
166	S	95.8	Very high	95.3	Very high	38 Å²	38	38.4 Å²	38.4	27%	0.266	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85	-10.9	172.4	26.9	0	0	0	0	113.7	S146 D164	S146-S166 WeakPolarHBondContact CB-OG 3.41Å; D164-S166 VanDerWaalsContact C-N 3.27Å; D164-S166 PolarHBondContact O-N 3.3Å; D164-S166 WeakPolarHBondContact OD1-CA 3.46Å; D164-S166 WeakPolarHBondContact OD1-CB 3.34Å; D164-S166 PolarHBondContact OD1-N 2.96Å; D164-S166 PolarHBondContact OD1-OG 3.02Å; D164-S166 PolarHBondContact OD2-OG 2.91Å
167	G	94.8	Very high	95.3	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	20%	0.197	C	C	.	.	S	Bend	trans	92.8	12.5	178.6	0	0	0	0	0	114.7	D164 A184 H185 I189	D164-G167 PolarHBondContact O-N 3.32Å; D164-G167 PolarHBondContact OD1-N 3.16Å; G167-A184 PolarHBondContact O-N 3Å; G167-H185 WeakPolarHBondContact CA-O 3.35Å; G167-H185 PolarHBondContact O-N 2.88Å; G167-H185 VanDerWaalsContact O-N 3.11Å; G167-I189 WeakPolarHBondContact O-CD1 3.49Å
168	Y	96.9	Very high	95.4	Very high	78 Å²	78	37.1 Å²	37.1	31%	0.306	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86	145	171.6	-64.3	-85.4	0	0	0	111.4	A163 D164 M181 Y182 Q183	A163-Y168 VanDerWaalsContact CA-O 3.31Å; A163-Y168 WeakPolarHBondContact CA-O 3.39Å; D164-Y168 PolarHBondContact N-O 3.37Å; D164-Y168 PolarHBondContact OD1-N 3.23Å; Y168-M181 HydrophobicContact CD1-CE 3.83Å; Y168-M181 HydrophobicContact CE1-CE 4.12Å; Y168-M181 HydrophobicContact CG-CE 4.31Å; Y168-Y182 WeakPolarHBondContact CA-O 3.39Å; Y168-Q183 HydrophobicContact CD1-CB 3.92Å; Y168-Q183 HydrophobicContact CD1-CG 4.43Å; Y168-Q183 HydrophobicContact CE1-CB 3.73Å; Y168-Q183 HydrophobicContact CE1-CG 4.21Å
169	V	96.6	Very high	95.3	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	138.7	168.4	178.9	0	0	0	0	108.1	L161 T162 A163 M181 Y182 A184 I189 T203	L161-V169 HydrophobicContact CD2-CG1 3.6Å; T162-V169 WeakPolarHBondContact O-CA 3.42Å; A163-V169 HydrophobicContact CB-CG2 3.95Å; V169-M181 WeakPolarHBondContact O-CA 3.43Å; V169-Y182 HydrophobicContact CB-CE1 3.74Å; V169-Y182 HydrophobicContact CB-CE2 4.35Å; V169-Y182 WeakPolarHBondContact CB-OH 3.16Å; V169-Y182 HydrophobicContact CG1-CE1 3.9Å; V169-Y182 VanDerWaalsContact CG1-OH 3.3Å; V169-Y182 WeakPolarHBondContact CG1-OH 3.44Å; V169-Y182 PolarHBondContact N-O 2.86Å; V169-Y182 PolarHBondContact O-N 3.25Å; V169-A184 HydrophobicContact CB-CB 4.48Å; V169-A184 HydrophobicContact CG2-CB 3.61Å; V169-I189 HydrophobicContact CG2-CD1 3.62Å; V169-T203 HydrophobicContact CG2-CG2 4.07Å
170	K	96.3	Very high	95.2	Very high	21 Å²	21	37.4 Å²	37.4	9%	0.091	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	139.2	179	-62	-165.9	179	-167.4	0	111	A143 T162 W172 M181	A143-K170 WeakPolarHBondContact O-CD 3.47Å; A143-K170 WeakPolarHBondContact O-CE 3.38Å; A143-K170 PolarHBondContact O-NZ 3.28Å; T162-K170 PolarHBondContact N-O 3.16Å; T162-K170 VanDerWaalsContact N-O 3.14Å; T162-K170 PolarHBondContact O-N 2.92Å; K170-W172 HydrophobicContact CD-CZ2 4.11Å; K170-M181 HydrophobicContact CD-CB 4.23Å; K170-M181 HydrophobicContact CG-CB 3.75Å
171	Y	96.2	Very high	95	Very high	8 Å²	8	41.5 Å²	41.5	3%	0.031	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	125.9	173.3	-59.1	-85.3	0	0	0	110.1	L161 N178 V179 E180 Y182 F201 F215 C218	L161-Y171 HydrophobicContact CD2-CD1 3.42Å; L161-Y171 VanDerWaalsContact CD2-CD1 3.42Å; L161-Y171 HydrophobicContact CD2-CE1 3.47Å; L161-Y171 VanDerWaalsContact CD2-CE1 3.47Å; L161-Y171 HydrophobicContact CD2-CG 4.19Å; L161-Y171 HydrophobicContact CG-CD1 4.31Å; L161-Y171 HydrophobicContact CG-CE1 4.38Å; Y171-N178 PolarHBondContact O-OD1 2.96Å; Y171-V179 PolarHBondContact O-N 3.14Å; Y171-E180 HydrophobicContact CD2-CB 3.77Å; Y171-E180 HydrophobicContact CE2-CB 4.37Å; Y171-E180 PolarHBondContact N-O 2.66Å; Y171-Y182 HydrophobicContact CD2-CE1 4.3Å; Y171-Y182 AromaticContact CE2-CD1 3.76Å; Y171-Y182 HydrophobicContact CE2-CD1 3.76Å; Y171-Y182 AromaticContact CE2-CE1 3.37Å; Y171-Y182 HydrophobicContact CE2-CE1 3.37Å; Y171-Y182 AromaticContact CZ-CE1 3.69Å; Y171-Y182 WeakPolarHBondContact OH-CE1 3.48Å; Y171-F201 HydrophobicContact CE1-CE1 4.33Å; Y171-F201 WeakPolarHBondContact OH-CE1 3.3Å; Y171-F201 WeakPolarHBondContact OH-CZ 3.41Å; Y171-F215 HydrophobicContact CD1-CD2 4.32Å; Y171-F215 AromaticContact CD1-CE2 3.58Å; Y171-F215 HydrophobicContact CD1-CE2 3.58Å; Y171-F215 AromaticContact CD1-CZ 3.91Å; Y171-F215 HydrophobicContact CD1-CZ 3.91Å; Y171-F215 AromaticContact CE1-CD2 3.71Å; Y171-F215 HydrophobicContact CE1-CD2 3.71Å; Y171-F215 AromaticContact CE1-CE2 3.44Å; Y171-F215 HydrophobicContact CE1-CE2 3.44Å; Y171-F215 VanDerWaalsContact CE1-CE2 3.44Å; Y171-F215 HydrophobicContact CE1-CZ 4.07Å; Y171-C218 WeakPolarHBondContact CE2-SG 3.43Å; Y171-C218 PolarHBondContact OH-SG 2.9Å; Y171-C218 VanDerWaalsContact OH-SG 3.39Å
172	W	96.2	Very high	94.9	Very high	13 Å²	13	43 Å²	43	5%	0.049	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	135.8	178	-59.8	85.7	0	0	0	110.4	F127 A143 W159 L160 T162 K170 M176 N177 N178	F127-W172 AromaticContact CE2-CD2 3.8Å; F127-W172 HydrophobicContact CE2-CD2 3.8Å; F127-W172 AromaticContact CE2-CE2 3.52Å; F127-W172 HydrophobicContact CE2-CE3 4.17Å; F127-W172 HydrophobicContact CE2-CG 4.34Å; F127-W172 HydrophobicContact CE2-CH2 4.07Å; F127-W172 AromaticContact CE2-CZ2 3.69Å; F127-W172 HydrophobicContact CE2-CZ2 3.69Å; F127-W172 HydrophobicContact CE2-CZ3 4.28Å; F127-W172 AromaticContact CE2-NE1 3.86Å; F127-W172 HydrophobicContact CZ-CD2 4.45Å; F127-W172 AromaticContact CZ-CE2 3.87Å; F127-W172 HydrophobicContact CZ-CZ2 4.14Å; F127-W172 AromaticContact CZ-NE1 3.75Å; A143-W172 HydrophobicContact CB-CH2 3.88Å; A143-W172 HydrophobicContact CB-CZ2 3.61Å; W159-W172 WeakPolarHBondContact CA-O 3.44Å; L160-W172 HydrophobicContact CB-CB 3.98Å; L160-W172 HydrophobicContact CD2-CB 4.24Å; L160-W172 HydrophobicContact CG-CB 4.28Å; L160-W172 PolarHBondContact N-O 3.25Å; L160-W172 WeakPolarHBondContact O-CB 3.25Å; L160-W172 PolarHBondContact O-N 3.46Å; T162-W172 PolarHBondContact OG1-NE1 3.41Å; K170-W172 HydrophobicContact CD-CZ2 4.11Å; W172-M176 WeakPolarHBondContact CZ3-O 3.29Å; W172-N177 WeakPolarHBondContact CA-O 3.36Å; W172-N178 HydrophobicContact CD2-CB 4.43Å; W172-N178 HydrophobicContact CE3-CB 4Å; W172-N178 HydrophobicContact CH2-CB 3.82Å; W172-N178 HydrophobicContact CZ2-CB 4.24Å; W172-N178 HydrophobicContact CZ3-CB 3.7Å
173	Q	95	Very high	94.7	Very high	64 Å²	64	48.1 Å²	48.1	30%	0.299	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	161.6	167.8	-78	169.8	-9.4	0	0	110.9	W159 N175 M176 N177 V179	W159-Q173 HydrophobicContact CE3-CG 4.42Å; W159-Q173 HydrophobicContact CH2-CG 4.2Å; W159-Q173 HydrophobicContact CZ3-CG 3.91Å; Q173-N175 WeakPolarHBondContact CB-OD1 3.34Å; Q173-N175 PolarHBondContact O-N 3.25Å; Q173-N175 PolarHBondContact OE1-ND2 2.68Å; Q173-M176 WeakPolarHBondContact O-CA 3.32Å; Q173-M176 PolarHBondContact O-N 3.3Å; Q173-N177 HydrophobicContact CB-CB 4.46Å; Q173-N177 PolarHBondContact N-O 2.75Å; Q173-V179 HydrophobicContact CG-CG2 3.66Å
174	A	92.3	Very high	94.6	Very high	57 Å²	57	48.2 Å²	48.2	47%	0.471	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.6	-26.7	175.6	0	0	0	0	0	115.1	W153 E158 M176	W153-A174 HydrophobicContact CZ3-CB 4.37Å; E158-A174 PolarHBondContact O-N 2.66Å; E158-A174 VanDerWaalsContact O-N 3.12Å; A174-M176 VanDerWaalsContact C-N 3.26Å; A174-M176 PolarHBondContact O-N 2.74Å
175	N	92.8	Very high	94.6	Very high	107 Å²	107	48.2 Å²	48.2	57%	0.572	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.6	2.1	174.9	63	9.8	0	0	0	114.5	Q173 N177	Q173-N175 WeakPolarHBondContact CB-OD1 3.34Å; Q173-N175 PolarHBondContact O-N 3.25Å; Q173-N175 PolarHBondContact OE1-ND2 2.68Å; N175-N177 VanDerWaalsContact C-N 3.33Å; N175-N177 WeakPolarHBondContact OD1-CB 3.36Å; N175-N177 PolarHBondContact OD1-N 2.76Å
176	M	92.4	Very high	94.5	Very high	19 Å²	19	54 Å²	54	9%	0.094	27%	0.272	C	S	.	.			trans	64.7	25.9	-171.4	-51.6	-68.5	118.5	0	0	115.1	I119 L129 L141 W153 L160 W172 Q173 A174	I119-M176 HydrophobicContact CD1-CE 3.52Å; I119-M176 HydrophobicContact CD1-SD 3.72Å; I119-M176 HydrophobicContact CG1-SD 4.48Å; L129-M176 HydrophobicContact CD2-CG 3.89Å; L129-M176 HydrophobicContact CD2-SD 4.37Å; L141-M176 HydrophobicContact CD1-CB 3.51Å; L141-M176 HydrophobicContact CD1-CG 4.07Å; W153-M176 HydrophobicContact CH2-CE 3.66Å; W153-M176 HydrophobicContact CZ2-CE 3.79Å; L160-M176 HydrophobicContact CD2-CE 4.33Å; L160-M176 HydrophobicContact CD2-SD 4.35Å; W172-M176 WeakPolarHBondContact CZ3-O 3.29Å; Q173-M176 WeakPolarHBondContact O-CA 3.32Å; Q173-M176 PolarHBondContact O-N 3.3Å; A174-M176 VanDerWaalsContact C-N 3.26Å; A174-M176 PolarHBondContact O-N 2.74Å
177	N	94.8	Very high	94.5	Very high	84 Å²	84	56.5 Å²	56.5	45%	0.449	28%	0.279	S	S	.	.			trans	-80.3	133.2	167.9	-172.6	35.4	0	0	0	110.6	W172 Q173 N175	W172-N177 WeakPolarHBondContact CA-O 3.36Å; Q173-N177 HydrophobicContact CB-CB 4.46Å; Q173-N177 PolarHBondContact N-O 2.75Å; N175-N177 VanDerWaalsContact C-N 3.33Å; N175-N177 WeakPolarHBondContact OD1-CB 3.36Å; N175-N177 PolarHBondContact OD1-N 2.76Å
178	N	94.2	Very high	94.5	Very high	57 Å²	57	57.3 Å²	57.3	31%	0.305	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	124.1	171.7	-179.5	22.4	0	0	0	108.5	Y171 W172	Y171-N178 PolarHBondContact O-OD1 2.96Å; W172-N178 HydrophobicContact CD2-CB 4.43Å; W172-N178 HydrophobicContact CE3-CB 4Å; W172-N178 HydrophobicContact CH2-CB 3.82Å; W172-N178 HydrophobicContact CZ2-CB 4.24Å; W172-N178 HydrophobicContact CZ3-CB 3.7Å
179	V	92.7	Very high	94.6	Very high	58 Å²	58	53.6 Å²	53.6	35%	0.352	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	-54.2	-177.4	179.6	0	0	0	0	111.1	W159 Y171 Q173	W159-V179 HydrophobicContact CH2-CG1 4.43Å; W159-V179 HydrophobicContact CH2-CG2 4.23Å; W159-V179 HydrophobicContact CZ3-CB 4.14Å; W159-V179 HydrophobicContact CZ3-CG1 4.41Å; W159-V179 HydrophobicContact CZ3-CG2 3.79Å; Y171-V179 PolarHBondContact O-N 3.14Å; Q173-V179 HydrophobicContact CG-CG2 3.66Å
180	E	91.3	Very high	94.5	Very high	116 Å²	116	56 Å²	56	54%	0.542	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	148.8	-176.2	-83.7	-61.7	166.8	0	0	110.9	Y171	Y171-E180 HydrophobicContact CD2-CB 3.77Å; Y171-E180 HydrophobicContact CE2-CB 4.37Å; Y171-E180 PolarHBondContact N-O 2.66Å
181	M	92.9	Very high	94.5	Very high	86 Å²	86	55.4 Å²	55.4	42%	0.424	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	136.6	174.7	66.6	171.1	-81.9	0	0	111.9	Y168 V169 K170	Y168-M181 HydrophobicContact CD1-CE 3.83Å; Y168-M181 HydrophobicContact CE1-CE 4.12Å; Y168-M181 HydrophobicContact CG-CE 4.31Å; V169-M181 WeakPolarHBondContact O-CA 3.43Å; K170-M181 HydrophobicContact CD-CB 4.23Å; K170-M181 HydrophobicContact CG-CB 3.75Å
182	Y	93.8	Very high	94.5	Very high	34 Å²	34	55.7 Å²	55.7	13%	0.133	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	156.9	-179.6	67.9	-76.2	0	0	0	110.6	Y168 V169 Y171 A184 F201 W213 C218	Y168-Y182 WeakPolarHBondContact CA-O 3.39Å; V169-Y182 HydrophobicContact CB-CE1 3.74Å; V169-Y182 HydrophobicContact CB-CE2 4.35Å; V169-Y182 WeakPolarHBondContact CB-OH 3.16Å; V169-Y182 HydrophobicContact CG1-CE1 3.9Å; V169-Y182 VanDerWaalsContact CG1-OH 3.3Å; V169-Y182 WeakPolarHBondContact CG1-OH 3.44Å; V169-Y182 PolarHBondContact N-O 2.86Å; V169-Y182 PolarHBondContact O-N 3.25Å; Y171-Y182 HydrophobicContact CD2-CE1 4.3Å; Y171-Y182 AromaticContact CE2-CD1 3.76Å; Y171-Y182 HydrophobicContact CE2-CD1 3.76Å; Y171-Y182 AromaticContact CE2-CE1 3.37Å; Y171-Y182 HydrophobicContact CE2-CE1 3.37Å; Y171-Y182 AromaticContact CZ-CE1 3.69Å; Y171-Y182 WeakPolarHBondContact OH-CE1 3.48Å; Y182-A184 HydrophobicContact CD2-CB 4.38Å; Y182-A184 HydrophobicContact CE2-CB 3.72Å; Y182-A184 PolarHBondContact O-N 3.17Å; Y182-F201 VanDerWaalsContact OH-CE2 3.25Å; Y182-F201 WeakPolarHBondContact OH-CE2 3.34Å; Y182-F201 WeakPolarHBondContact OH-CZ 3.38Å; Y182-W213 HydrophobicContact CD2-CE3 4.48Å; Y182-W213 HydrophobicContact CD2-CH2 4.43Å; Y182-W213 HydrophobicContact CD2-CZ3 4.07Å; Y182-W213 HydrophobicContact CE2-CD2 4.12Å; Y182-W213 AromaticContact CE2-CE3 3.71Å; Y182-W213 HydrophobicContact CE2-CE3 3.71Å; Y182-W213 HydrophobicContact CE2-CH2 4.03Å; Y182-W213 HydrophobicContact CE2-CZ2 4.37Å; Y182-W213 AromaticContact CE2-CZ3 3.66Å; Y182-W213 HydrophobicContact CE2-CZ3 3.66Å; Y182-C218 HydrophobicContact CD1-CB 4.46Å
183	Q	94.7	Very high	94.5	Very high	106 Å²	106	55.7 Å²	55.7	50%	0.495	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	103.4	178.9	-169.4	172.9	21.5	0	0	109.7	Y168 H185	Y168-Q183 HydrophobicContact CD1-CB 3.92Å; Y168-Q183 HydrophobicContact CD1-CG 4.43Å; Y168-Q183 HydrophobicContact CE1-CB 3.73Å; Y168-Q183 HydrophobicContact CE1-CG 4.21Å; Q183-H185 VanDerWaalsContact CG-O 3.3Å; Q183-H185 WeakPolarHBondContact CG-O 3.07Å
184	A	94.2	Very high	94.5	Very high	2 Å²	2	52.7 Å²	52.7	2%	0.017	27%	0.269	C	S	.	.			trans	-80.6	-41.3	180	0	0	0	0	0	111.9	G167 V169 Y182 I189 R211 W213	G167-A184 PolarHBondContact O-N 3Å; V169-A184 HydrophobicContact CB-CB 4.48Å; V169-A184 HydrophobicContact CG2-CB 3.61Å; Y182-A184 HydrophobicContact CD2-CB 4.38Å; Y182-A184 HydrophobicContact CE2-CB 3.72Å; Y182-A184 PolarHBondContact O-N 3.17Å; A184-I189 HydrophobicContact CB-CD1 3.99Å; A184-R211 PolarHBondContact O-NH1 2.96Å; A184-W213 VanDerWaalsContact CA-CZ2 3.49Å; A184-W213 HydrophobicContact CB-CH2 4.07Å; A184-W213 HydrophobicContact CB-CZ2 3.5Å; A184-W213 VanDerWaalsContact CB-CZ2 3.5Å; A184-W213 WeakPolarHBondContact O-CZ2 3.43Å
185	H	95.2	Very high	94.6	Very high	2 Å²	2	50.4 Å²	50.4	1%	0.009	25%	0.25	C	C	.	.			trans	-130.3	162.1	-179.2	-71.3	-101.4	0	0	0	111.6	G167 Q183 E187 I189 T203 S205 D207 T209 R211	G167-H185 WeakPolarHBondContact CA-O 3.35Å; G167-H185 PolarHBondContact O-N 2.88Å; G167-H185 VanDerWaalsContact O-N 3.11Å; Q183-H185 VanDerWaalsContact CG-O 3.3Å; Q183-H185 WeakPolarHBondContact CG-O 3.07Å; H185-E187 WeakPolarHBondContact CB-O 3.46Å; H185-I189 HydrophobicContact CB-CD1 4.37Å; H185-I189 HydrophobicContact CB-CG1 4.02Å; H185-T203 PolarHBondContact CD2-OG1 3Å; H185-T203 PolarHBondContact NE2-OG1 2.88Å; H185-S205 VanDerWaalsContact CG-CB 3.47Å; H185-S205 WeakPolarHBondContact ND1-CB 3.36Å; H185-D207 IonicContact CE1-OD1 2.75Å; H185-D207 IonicContact CE1-OD2 3.49Å; H185-D207 IonicContact CG-OD2 2.86Å; H185-D207 VanDerWaalsContact ND1-CG 3.35Å; H185-D207 IonicContact ND1-OD1 2.81Å; H185-D207 PolarHBondContact ND1-OD1 2.95Å; H185-D207 IonicContact ND1-OD2 3.54Å; H185-D207 PolarHBondContact ND1-OD2 2.98Å; H185-T209 PolarHBondContact CE1-OG1 3.09Å; H185-R211 PolarHBondContact CE1-NE 3.3Å; H185-R211 PolarHBondContact ND1-NE 2.98Å
186	K	94.3	Very high	94.5	Very high	185 Å²	185	46.7 Å²	46.7	80%	0.804	23%	0.232	S	C	*	.	S	Bend	trans	-88.9	-12.6	172.7	-63.9	-175.2	178.6	-176.2	0	112.9
187	E	96.2	Very high	94.4	Very high	90 Å²	90	52.6 Å²	52.6	42%	0.421	26%	0.257	S	S	.	.	S	Bend	trans	-127.6	163.1	-176.1	-71.2	-168.4	-148.1	0	0	110.3	H185 I189 S205 D206 D207	H185-E187 WeakPolarHBondContact CB-O 3.46Å; E187-I189 PolarHBondContact O-N 3.46Å; E187-S205 VanDerWaalsContact C-OG 3.27Å; E187-S205 PolarHBondContact O-OG 3.42Å; E187-D206 HydrophobicContact CB-CB 4.37Å; E187-D207 HydrophobicContact CB-CB 3.95Å; E187-D207 HydrophobicContact CG-CB 4.07Å; E187-D207 PolarHBondContact OE2-N 2.85Å
188	P	96.2	Very high	94.2	Very high	17 Å²	17	49.4 Å²	49.4	11%	0.11	24%	0.24	C	C	.	.			trans	-51.8	126.6	-174.3	-27.3	32.4	0	0	0	113.7	H165 S205 D206	H165-P188 HydrophobicContact CB-CB 4.33Å; H165-P188 WeakPolarHBondContact CE1-CG 3.14Å; H165-P188 WeakPolarHBondContact ND1-CB 3.33Å; H165-P188 WeakPolarHBondContact ND1-CG 3.31Å; H165-P188 WeakPolarHBondContact NE2-CG 3.27Å; H165-P188 WeakPolarHBondContact O-CA 3.37Å; H165-P188 VanDerWaalsContact O-CG 3.3Å; H165-P188 WeakPolarHBondContact O-CG 3.38Å; P188-S205 VanDerWaalsContact O-CA 3.27Å; P188-S205 WeakPolarHBondContact O-CA 3.37Å; P188-S205 PolarHBondContact O-OG 3.43Å; P188-S205 VanDerWaalsContact O-OG 3.11Å; P188-D206 WeakPolarHBondContact CB-OD2 3.47Å; P188-D206 PolarHBondContact O-N 3.05Å
189	I	97.3	Very high	94.1	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	136.1	172.1	-63.9	164.9	0	0	0	107.8	R149 A163 D164 G167 V169 A184 H185 E187 V192 C204	R149-I189 WeakPolarHBondContact CB-O 3.21Å; R149-I189 VanDerWaalsContact CG-O 3.31Å; R149-I189 WeakPolarHBondContact CG-O 3.41Å; A163-I189 HydrophobicContact CB-CB 3.84Å; A163-I189 HydrophobicContact CB-CD1 3.94Å; A163-I189 HydrophobicContact CB-CG2 3.56Å; D164-I189 PolarHBondContact O-N 2.87Å; G167-I189 WeakPolarHBondContact O-CD1 3.49Å; V169-I189 HydrophobicContact CG2-CD1 3.62Å; A184-I189 HydrophobicContact CB-CD1 3.99Å; H185-I189 HydrophobicContact CB-CD1 4.37Å; H185-I189 HydrophobicContact CB-CG1 4.02Å; E187-I189 PolarHBondContact O-N 3.46Å; I189-V192 HydrophobicContact CG2-CG2 4.1Å; I189-C204 CarbonylContact C-O 3.59Å; I189-C204 WeakPolarHBondContact CA-O 3.32Å; I189-C204 WeakPolarHBondContact CG2-O 3.48Å
190	R	96	Very high	94.2	Very high	50 Å²	50	50.5 Å²	50.5	19%	0.189	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	-29.9	-173.1	-50.2	-57	-70.6	-121.6	-6.6	112.5	C204 D206 V231 R232	R190-C204 PolarHBondContact N-O 2.81Å; R190-D206 WeakPolarHBondContact CD-OD1 3.38Å; R190-D206 WeakPolarHBondContact CG-OD1 3.03Å; R190-D206 IonicContact CZ-OD1 3.94Å; R190-D206 IonicContact CZ-OD2 3.75Å; R190-D206 IonicContact NE-OD1 3.81Å; R190-D206 IonicContact NE-OD2 2.84Å; R190-D206 IonicContact NH1-OD1 3.14Å; R190-D206 PolarHBondContact NH1-OD1 3.28Å; R190-D206 IonicContact NH1-OD2 3.67Å; R190-D206 PolarHBondContact NH1-OD2 3.22Å; R190-V231 WeakPolarHBondContact CG-O 3.24Å; R190-R232 VanDerWaalsContact CB-O 3.31Å; R190-R232 WeakPolarHBondContact CB-O 3.42Å; R190-R232 VanDerWaalsContact CZ-NE 3.31Å
191	G	95	Very high	94.5	Very high	9 Å²	9	45 Å²	45	9%	0.093	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	151.5	178.3	0	0	0	0	0	112.7	C204	G191-C204 PolarHBondContact N-SG 3.41Å; G191-C204 VanDerWaalsContact N-SG 3.36Å; G191-C204 PolarHBondContact O-N 3.03Å
192	V	96.3	Very high	94.6	Very high	13 Å²	13	40.9 Å²	40.9	8%	0.079	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	139	174.7	172.7	0	0	0	0	108.9	L161 A163 I189 V202 T203	L161-V192 HydrophobicContact CB-CG1 4.18Å; L161-V192 HydrophobicContact CD1-CG1 4.02Å; A163-V192 HydrophobicContact CB-CG2 4.12Å; I189-V192 HydrophobicContact CG2-CG2 4.1Å; V192-V202 VanDerWaalsContact CA-O 3.29Å; V192-V202 WeakPolarHBondContact CA-O 3.41Å; V192-T203 HydrophobicContact CG2-CG2 4.08Å
193	S	96.2	Very high	94.8	Very high	13 Å²	13	39.2 Å²	39.2	9%	0.091	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	141.9	171.7	-169.3	0	0	0	0	111.2	F201 V202 W236	S193-F201 CarbonylContact O-C 3.57Å; S193-F201 WeakPolarHBondContact O-CA 3.34Å; S193-F201 WeakPolarHBondContact O-CB 3.07Å; S193-V202 PolarHBondContact N-O 2.75Å; S193-V202 VanDerWaalsContact N-O 3.09Å; S193-V202 PolarHBondContact O-N 3.11Å; S193-W236 PolarHBondContact OG-N 3.2Å
194	F	95	Very high	94.9	Very high	1 Å²	1	34.2 Å²	34.2	0%	0.004	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	152.3	170	-73.7	-89.3	0	0	0	111.5	K152 W153 S154 L161 D198 F201 F215 W236	K152-F194 HydrophobicContact CB-CE2 4.45Å; K152-F194 HydrophobicContact CG-CD2 3.94Å; K152-F194 HydrophobicContact CG-CE2 4.32Å; K152-F194 WeakPolarHBondContact O-CE2 3.26Å; W153-F194 WeakPolarHBondContact O-CD2 3.19Å; W153-F194 WeakPolarHBondContact O-CE2 3.38Å; S154-F194 VanDerWaalsContact N-CE2 3.28Å; L161-F194 HydrophobicContact CB-CE2 3.96Å; L161-F194 HydrophobicContact CB-CZ 3.87Å; L161-F194 HydrophobicContact CD1-CD1 4.36Å; L161-F194 HydrophobicContact CD1-CE1 3.64Å; L161-F194 HydrophobicContact CD1-CE2 3.89Å; L161-F194 HydrophobicContact CD1-CZ 3.38Å; L161-F194 HydrophobicContact CG-CE1 4.13Å; L161-F194 HydrophobicContact CG-CE2 4.07Å; L161-F194 HydrophobicContact CG-CZ 3.48Å; L161-F194 VanDerWaalsContact CG-CZ 3.48Å; F194-D198 HydrophobicContact CD1-CB 4.35Å; F194-F201 HydrophobicContact CD1-CB 4.18Å; F194-F215 AromaticContact CE1-CD2 3.88Å; F194-F215 HydrophobicContact CE1-CD2 3.88Å; F194-F215 AromaticContact CE1-CE2 3.78Å; F194-F215 HydrophobicContact CE1-CE2 3.78Å; F194-F215 HydrophobicContact CZ-CE2 4.31Å; F194-W236 WeakPolarHBondContact O-CB 3.19Å
195	C	94.1	Very high	95	Very high	9 Å²	9	34.1 Å²	34.1	6%	0.061	17%	0.165	C	C	.	.			trans	-69.6	147.8	157.3	177.8	0	0	0	0	109.2	F197 D198 K200 W236	C195-F197 PolarHBondContact O-N 2.84Å; C195-D198 WeakPolarHBondContact O-CA 3.46Å; C195-D198 PolarHBondContact O-N 2.82Å; C195-K200 HydrophobicContact CB-CB 3.86Å; C195-K200 WeakPolarHBondContact CB-O 3.3Å; C195-K200 PolarHBondContact N-O 2.86Å; C195-W236 HydrophobicContact CB-CD2 3.95Å; C195-W236 HydrophobicContact CB-CE3 4.32Å; C195-W236 HydrophobicContact CB-CG 4.44Å; C195-W236 HydrophobicContact CB-CH2 4.27Å; C195-W236 HydrophobicContact CB-CZ2 3.85Å; C195-W236 HydrophobicContact CB-CZ3 4.47Å
196	P	91	Very high	95	Very high	30 Å²	30	34.9 Å²	34.9	20%	0.195	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-11.4	-178.1	21.8	-35.9	0	0	0	116.5	H237 P238	P196-H237 WeakPolarHBondContact CD-O 3.49Å; P196-P238 WeakPolarHBondContact CB-O 3.34Å
197	F	90	Very high	95.1	Very high	143 Å²	143	27.4 Å²	27.4	63%	0.627	14%	0.138	S	C	*	.	T	Hydrogen-bonded Turn	trans	-103.2	9.1	173.7	-56.1	-72	0	0	0	113.5	C195 N199	C195-F197 PolarHBondContact O-N 2.84Å; F197-N199 PolarHBondContact O-N 2.83Å; F197-N199 PolarHBondContact O-ND2 3.25Å
198	D	91.2	Very high	95	Very high	16 Å²	16	25.1 Å²	25.1	9%	0.086	13%	0.132	C	C	.	.	S	Bend	trans	56.2	-14.1	-175.7	-63.6	-42.9	0	0	0	117.5	S154 H155 N156 F194 C195 K200 F215	S154-D198 WeakPolarHBondContact CA-OD1 3.49Å; S154-D198 WeakPolarHBondContact CB-OD1 3.28Å; H155-D198 WeakPolarHBondContact CA-OD2 3.4Å; H155-D198 IonicContact CD2-OD1 3.9Å; H155-D198 PolarHBondContact CD2-OD1 2.98Å; H155-D198 IonicContact CG-OD1 3.42Å; H155-D198 VanDerWaalsContact N-CG 3.31Å; H155-D198 PolarHBondContact N-OD1 2.81Å; H155-D198 PolarHBondContact N-OD2 2.83Å; N156-D198 WeakPolarHBondContact CB-OD2 3.42Å; N156-D198 PolarHBondContact N-OD2 3.22Å; F194-D198 HydrophobicContact CD1-CB 4.35Å; C195-D198 WeakPolarHBondContact O-CA 3.46Å; C195-D198 PolarHBondContact O-N 2.82Å; D198-K200 PolarHBondContact O-N 3.2Å; D198-F215 WeakPolarHBondContact O-CB 3.3Å
199	N	93.4	Very high	94.9	Very high	88 Å²	88	24.5 Å²	24.5	47%	0.471	13%	0.127	S	C	.	.	S	Bend	trans	-62.2	-24.6	-178.9	-66.4	-39.2	0	0	0	114.8	F197 F215 H216	F197-N199 PolarHBondContact O-N 2.83Å; F197-N199 PolarHBondContact O-ND2 3.25Å; N199-F215 WeakPolarHBondContact O-CB 3.49Å; N199-F215 PolarHBondContact O-N 3.15Å; N199-F215 VanDerWaalsContact O-N 3.1Å; N199-H216 PolarHBondContact OD1-CE1 3.15Å
200	K	94.6	Very high	94.9	Very high	50 Å²	50	24.5 Å²	24.5	22%	0.217	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	148.4	177.2	-61.4	-169.1	176.4	-152.7	0	109.4	C195 D198 I212 W213 E221 W236	C195-K200 HydrophobicContact CB-CB 3.86Å; C195-K200 WeakPolarHBondContact CB-O 3.3Å; C195-K200 PolarHBondContact N-O 2.86Å; D198-K200 PolarHBondContact O-N 3.2Å; K200-I212 HydrophobicContact CD-CG2 4.42Å; K200-W213 WeakPolarHBondContact CA-O 3.3Å; K200-E221 WeakPolarHBondContact CE-OE2 3.5Å; K200-E221 IonicContact NZ-OE1 3.92Å; K200-E221 PolarHBondContact NZ-OE1 2.96Å; K200-E221 IonicContact NZ-OE2 3.37Å; K200-E221 PolarHBondContact NZ-OE2 3.32Å; K200-W236 HydrophobicContact CB-CH2 3.74Å; K200-W236 HydrophobicContact CB-CZ2 4.35Å; K200-W236 HydrophobicContact CB-CZ3 4.19Å; K200-W236 HydrophobicContact CD-CH2 4.02Å; K200-W236 HydrophobicContact CD-CZ2 4.41Å
201	F	95.9	Very high	94.9	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	166.8	166.5	65.3	-83.3	0	0	0	110.5	L161 Y171 Y182 S193 F194 T203 W213 F215	L161-F201 HydrophobicContact CD1-CB 3.96Å; L161-F201 HydrophobicContact CD1-CD1 3.93Å; L161-F201 HydrophobicContact CD1-CD2 3.66Å; L161-F201 HydrophobicContact CD1-CE1 4.37Å; L161-F201 HydrophobicContact CD1-CE2 4.13Å; L161-F201 HydrophobicContact CD1-CG 3.55Å; L161-F201 HydrophobicContact CD1-CZ 4.46Å; Y171-F201 HydrophobicContact CE1-CE1 4.33Å; Y171-F201 WeakPolarHBondContact OH-CE1 3.3Å; Y171-F201 WeakPolarHBondContact OH-CZ 3.41Å; Y182-F201 VanDerWaalsContact OH-CE2 3.25Å; Y182-F201 WeakPolarHBondContact OH-CE2 3.34Å; Y182-F201 WeakPolarHBondContact OH-CZ 3.38Å; S193-F201 CarbonylContact O-C 3.57Å; S193-F201 WeakPolarHBondContact O-CA 3.34Å; S193-F201 WeakPolarHBondContact O-CB 3.07Å; F194-F201 HydrophobicContact CD1-CB 4.18Å; F201-T203 HydrophobicContact CD2-CG2 4.17Å; F201-T203 HydrophobicContact CE2-CG2 3.93Å; F201-W213 HydrophobicContact CD1-CB 4.03Å; F201-W213 HydrophobicContact CD2-CB 4.07Å; F201-W213 HydrophobicContact CD2-CG 4.37Å; F201-W213 HydrophobicContact CE1-CB 3.45Å; F201-W213 VanDerWaalsContact CE1-CB 3.45Å; F201-W213 HydrophobicContact CE1-CG 4.39Å; F201-W213 HydrophobicContact CE2-CB 3.5Å; F201-W213 AromaticContact CE2-CD1 3.6Å; F201-W213 AromaticContact CE2-CG 3.61Å; F201-W213 HydrophobicContact CE2-CG 3.61Å; F201-W213 HydrophobicContact CG-CB 4.29Å; F201-W213 HydrophobicContact CZ-CB 3.14Å; F201-W213 HydrophobicContact CZ-CD2 4.44Å; F201-W213 AromaticContact CZ-CG 3.62Å; F201-W213 HydrophobicContact CZ-CG 3.62Å; F201-W213 PolarHBondContact N-O 2.92Å; F201-W213 VanDerWaalsContact N-O 3.1Å; F201-W213 PolarHBondContact O-N 2.86Å; F201-F215 HydrophobicContact CD1-CB 4.22Å; F201-F215 AromaticContact CD1-CD2 4Å; F201-F215 HydrophobicContact CD1-CD2 4Å; F201-F215 HydrophobicContact CE1-CB 4.4Å; F201-F215 HydrophobicContact CE1-CD2 4.22Å
202	V	96.7	Very high	95	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	137.9	-179.6	66.7	0	0	0	0	110.5	V192 S193 V210 R211 I212 V234 W236 I243	V192-V202 VanDerWaalsContact CA-O 3.29Å; V192-V202 WeakPolarHBondContact CA-O 3.41Å; S193-V202 PolarHBondContact N-O 2.75Å; S193-V202 VanDerWaalsContact N-O 3.09Å; S193-V202 PolarHBondContact O-N 3.11Å; V202-V210 HydrophobicContact CG2-CG1 3.22Å; V202-R211 WeakPolarHBondContact CA-O 3.43Å; V202-R211 WeakPolarHBondContact CG2-O 3.04Å; V202-I212 HydrophobicContact CG2-CG1 4.38Å; V202-V234 HydrophobicContact CB-CG2 4.37Å; V202-V234 HydrophobicContact CG1-CB 4.47Å; V202-V234 HydrophobicContact CG1-CG1 4.05Å; V202-V234 HydrophobicContact CG1-CG2 3.56Å; V202-V234 HydrophobicContact CG2-CG2 3.84Å; V202-W236 HydrophobicContact CB-CE3 3.85Å; V202-W236 HydrophobicContact CB-CZ3 3.94Å; V202-W236 HydrophobicContact CG1-CE3 3.79Å; V202-W236 HydrophobicContact CG1-CZ3 4.39Å; V202-I243 HydrophobicContact CB-CD1 4.17Å; V202-I243 HydrophobicContact CG1-CG2 4.34Å; V202-I243 HydrophobicContact CG2-CD1 4Å; V202-I243 HydrophobicContact CG2-CG2 4.24Å
203	T	97.2	Very high	95	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	142.3	172.7	58.5	0	0	0	0	109.5	V169 H185 V192 F201 V210 R211 W213	V169-T203 HydrophobicContact CG2-CG2 4.07Å; H185-T203 PolarHBondContact CD2-OG1 3Å; H185-T203 PolarHBondContact NE2-OG1 2.88Å; V192-T203 HydrophobicContact CG2-CG2 4.08Å; F201-T203 HydrophobicContact CD2-CG2 4.17Å; F201-T203 HydrophobicContact CE2-CG2 3.93Å; T203-V210 CarbonylContact O-C 3.6Å; T203-V210 WeakPolarHBondContact O-CA 3.34Å; T203-V210 WeakPolarHBondContact O-CG1 3.36Å; T203-R211 PolarHBondContact N-O 3.05Å; T203-R211 PolarHBondContact O-N 3.36Å; T203-W213 PolarHBondContact OG1-NE1 2.77Å
204	C	96.5	Very high	94.9	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	145.8	167.8	71.4	0	0	0	0	111.6	I189 R190 G191 V210 V231 S233 V234	I189-C204 CarbonylContact C-O 3.59Å; I189-C204 WeakPolarHBondContact CA-O 3.32Å; I189-C204 WeakPolarHBondContact CG2-O 3.48Å; R190-C204 PolarHBondContact N-O 2.81Å; G191-C204 PolarHBondContact N-SG 3.41Å; G191-C204 VanDerWaalsContact N-SG 3.36Å; G191-C204 PolarHBondContact O-N 3.03Å; C204-V210 HydrophobicContact CB-CG1 4.41Å; C204-V210 HydrophobicContact CB-CG2 3.94Å; C204-V231 HydrophobicContact CB-CB 3.97Å; C204-V231 HydrophobicContact CB-CG1 3.62Å; C204-S233 VanDerWaalsContact SG-C 3.59Å; C204-V234 HydrophobicContact CB-CB 3.89Å; C204-V234 HydrophobicContact CB-CG1 3.96Å
205	S	96.8	Very high	94.9	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	165	-172.1	177.4	0	0	0	0	112.1	H185 E187 P188 D207 T209 V231	H185-S205 VanDerWaalsContact CG-CB 3.47Å; H185-S205 WeakPolarHBondContact ND1-CB 3.36Å; E187-S205 VanDerWaalsContact C-OG 3.27Å; E187-S205 PolarHBondContact O-OG 3.42Å; P188-S205 VanDerWaalsContact O-CA 3.27Å; P188-S205 WeakPolarHBondContact O-CA 3.37Å; P188-S205 PolarHBondContact O-OG 3.43Å; P188-S205 VanDerWaalsContact O-OG 3.11Å; S205-D207 WeakPolarHBondContact CB-OD1 3.3Å; S205-D207 PolarHBondContact O-N 2.89Å; S205-D207 PolarHBondContact OG-N 3.5Å; S205-T209 PolarHBondContact N-O 2.92Å; S205-V231 PolarHBondContact O-N 3.35Å
206	D	96.2	Very high	94.7	Very high	19 Å²	19	31.4 Å²	31.4	10%	0.102	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-17.4	168.3	-66.9	-30.7	0	0	0	112.3	E187 P188 R190 S208 D230 R232	E187-D206 HydrophobicContact CB-CB 4.37Å; P188-D206 WeakPolarHBondContact CB-OD2 3.47Å; P188-D206 PolarHBondContact O-N 3.05Å; R190-D206 WeakPolarHBondContact CD-OD1 3.38Å; R190-D206 WeakPolarHBondContact CG-OD1 3.03Å; R190-D206 IonicContact CZ-OD1 3.94Å; R190-D206 IonicContact CZ-OD2 3.75Å; R190-D206 IonicContact NE-OD1 3.81Å; R190-D206 IonicContact NE-OD2 2.84Å; R190-D206 IonicContact NH1-OD1 3.14Å; R190-D206 PolarHBondContact NH1-OD1 3.28Å; R190-D206 IonicContact NH1-OD2 3.67Å; R190-D206 PolarHBondContact NH1-OD2 3.22Å; D206-S208 PolarHBondContact O-N 2.79Å; D206-D230 HydrophobicContact CB-CB 4.29Å; D206-D230 WeakPolarHBondContact O-CA 3.31Å; D206-R232 VanDerWaalsContact CG-NH2 3.31Å; D206-R232 IonicContact OD1-CZ 2.86Å; D206-R232 IonicContact OD1-NE 3.55Å; D206-R232 PolarHBondContact OD1-NE 3.06Å; D206-R232 IonicContact OD1-NH2 3.73Å; D206-R232 PolarHBondContact OD1-NH2 2.93Å; D206-R232 IonicContact OD2-NH2 3.48Å
207	D	94.8	Very high	94.7	Very high	27 Å²	27	39.4 Å²	39.4	14%	0.144	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.9	13.5	175	75.6	5.4	0	0	0	115.9	H185 E187 S205 T209 R211	H185-D207 IonicContact CE1-OD1 2.75Å; H185-D207 IonicContact CE1-OD2 3.49Å; H185-D207 IonicContact CG-OD2 2.86Å; H185-D207 VanDerWaalsContact ND1-CG 3.35Å; H185-D207 IonicContact ND1-OD1 2.81Å; H185-D207 PolarHBondContact ND1-OD1 2.95Å; H185-D207 IonicContact ND1-OD2 3.54Å; H185-D207 PolarHBondContact ND1-OD2 2.98Å; E187-D207 HydrophobicContact CB-CB 3.95Å; E187-D207 HydrophobicContact CG-CB 4.07Å; E187-D207 PolarHBondContact OE2-N 2.85Å; S205-D207 WeakPolarHBondContact CB-OD1 3.3Å; S205-D207 PolarHBondContact O-N 2.89Å; S205-D207 PolarHBondContact OG-N 3.5Å; D207-T209 VanDerWaalsContact CG-OG1 3.25Å; D207-T209 PolarHBondContact O-N 2.91Å; D207-T209 VanDerWaalsContact O-N 3.07Å; D207-T209 WeakPolarHBondContact OD1-CA 3.44Å; D207-T209 WeakPolarHBondContact OD1-CB 3.45Å; D207-T209 PolarHBondContact OD1-N 2.89Å; D207-T209 PolarHBondContact OD1-OG1 2.88Å; D207-T209 PolarHBondContact OD2-OG1 2.92Å; D207-R211 IonicContact OD2-CZ 2.82Å; D207-R211 IonicContact OD2-NE 3.74Å; D207-R211 IonicContact OD2-NH2 3.92Å; D207-R211 PolarHBondContact OD2-NH2 3.01Å
208	S	94.1	Very high	94.8	Very high	42 Å²	42	34.8 Å²	34.8	29%	0.294	17%	0.166	S	C	.	.	S	Bend	trans	59.9	4.1	-174.1	71.7	0	0	0	0	116	D206	D206-S208 PolarHBondContact O-N 2.79Å
209	T	95.3	Very high	94.8	Very high	4 Å²	4	36.1 Å²	36.1	3%	0.025	18%	0.18	C	C	.	.			trans	-103.2	150.1	178.9	75.6	0	0	0	0	112.4	H185 S205 D207 R211 V223	H185-T209 PolarHBondContact CE1-OG1 3.09Å; S205-T209 PolarHBondContact N-O 2.92Å; D207-T209 VanDerWaalsContact CG-OG1 3.25Å; D207-T209 PolarHBondContact O-N 2.91Å; D207-T209 VanDerWaalsContact O-N 3.07Å; D207-T209 WeakPolarHBondContact OD1-CA 3.44Å; D207-T209 WeakPolarHBondContact OD1-CB 3.45Å; D207-T209 PolarHBondContact OD1-N 2.89Å; D207-T209 PolarHBondContact OD1-OG1 2.88Å; D207-T209 PolarHBondContact OD2-OG1 2.92Å; T209-R211 PolarHBondContact OG1-NE 2.83Å; T209-V223 HydrophobicContact CG2-CG1 3.93Å
210	V	96.5	Very high	94.8	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	128.3	165.3	-176.6	0	0	0	0	106.6	V202 T203 C204 L224 V231 V234	V202-V210 HydrophobicContact CG2-CG1 3.22Å; T203-V210 CarbonylContact O-C 3.6Å; T203-V210 WeakPolarHBondContact O-CA 3.34Å; T203-V210 WeakPolarHBondContact O-CG1 3.36Å; C204-V210 HydrophobicContact CB-CG1 4.41Å; C204-V210 HydrophobicContact CB-CG2 3.94Å; V210-L224 HydrophobicContact CB-CB 4.1Å; V210-L224 HydrophobicContact CB-CD1 4.05Å; V210-L224 HydrophobicContact CG1-CD1 3.9Å; V210-L224 PolarHBondContact N-O 3.35Å; V210-L224 WeakPolarHBondContact O-CA 3.47Å; V210-L224 VanDerWaalsContact O-CB 3.27Å; V210-L224 WeakPolarHBondContact O-CB 3.42Å; V210-L224 PolarHBondContact O-N 3.02Å; V210-V231 HydrophobicContact CG2-CB 4.24Å; V210-V231 HydrophobicContact CG2-CG1 3.8Å; V210-V231 HydrophobicContact CG2-CG2 4.03Å; V210-V234 HydrophobicContact CG1-CG2 3.93Å
211	R	96.2	Very high	94.8	Very high	37 Å²	37	36.9 Å²	36.9	14%	0.14	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	136.9	-174.1	-62.5	-177	-165.2	-173.5	29.1	110.7	A184 H185 V202 T203 D207 T209 W213 E220 R222 V223	A184-R211 PolarHBondContact O-NH1 2.96Å; H185-R211 PolarHBondContact CE1-NE 3.3Å; H185-R211 PolarHBondContact ND1-NE 2.98Å; V202-R211 WeakPolarHBondContact CA-O 3.43Å; V202-R211 WeakPolarHBondContact CG2-O 3.04Å; T203-R211 PolarHBondContact N-O 3.05Å; T203-R211 PolarHBondContact O-N 3.36Å; D207-R211 IonicContact OD2-CZ 2.82Å; D207-R211 IonicContact OD2-NE 3.74Å; D207-R211 IonicContact OD2-NH2 3.92Å; D207-R211 PolarHBondContact OD2-NH2 3.01Å; T209-R211 PolarHBondContact OG1-NE 2.83Å; R211-W213 HydrophobicContact CB-CZ2 4.25Å; R211-E220 WeakPolarHBondContact CD-OE2 3.5Å; R211-E220 IonicContact CZ-OE2 3.64Å; R211-E220 IonicContact NE-OE2 2.75Å; R211-E220 IonicContact NH1-OE2 2.66Å; R211-E220 PolarHBondContact NH1-OE2 2.82Å; R211-R222 WeakPolarHBondContact CA-O 3.44Å; R211-V223 HydrophobicContact CG-CG1 4.19Å; R211-V223 HydrophobicContact CG-CG2 4.27Å
212	I	96.8	Very high	94.7	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	133.7	177.6	-56.3	175.4	0	0	0	107.7	K200 V202 E221 R222 L224 W236 I243 P259	K200-I212 HydrophobicContact CD-CG2 4.42Å; V202-I212 HydrophobicContact CG2-CG1 4.38Å; I212-E221 HydrophobicContact CG2-CB 4.45Å; I212-E221 PolarHBondContact O-N 2.87Å; I212-R222 HydrophobicContact CB-CB 4.35Å; I212-R222 HydrophobicContact CD1-CB 4.27Å; I212-R222 PolarHBondContact N-O 3.46Å; I212-R222 PolarHBondContact O-N 3.12Å; I212-L224 HydrophobicContact CD1-CD1 4.11Å; I212-L224 HydrophobicContact CD1-CD2 4.18Å; I212-L224 HydrophobicContact CD1-CG 4.29Å; I212-L224 HydrophobicContact CG1-CD1 4.21Å; I212-L224 HydrophobicContact CG1-CG 4.44Å; I212-W236 HydrophobicContact CG2-CH2 4.04Å; I212-W236 HydrophobicContact CG2-CZ3 4.19Å; I212-I243 HydrophobicContact CD1-CD1 3.59Å; I212-I243 HydrophobicContact CG1-CD1 3.78Å; I212-P259 VanDerWaalsContact CD1-CA 3.44Å; I212-P259 HydrophobicContact CD1-CB 3.61Å
213	W	95.8	Very high	94.7	Very high	11 Å²	11	44.3 Å²	44.3	4%	0.042	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	141.9	-174	-61.6	89.3	0	0	0	110.8	Y182 A184 K200 F201 T203 R211 A219 E220	Y182-W213 HydrophobicContact CD2-CE3 4.48Å; Y182-W213 HydrophobicContact CD2-CH2 4.43Å; Y182-W213 HydrophobicContact CD2-CZ3 4.07Å; Y182-W213 HydrophobicContact CE2-CD2 4.12Å; Y182-W213 AromaticContact CE2-CE3 3.71Å; Y182-W213 HydrophobicContact CE2-CE3 3.71Å; Y182-W213 HydrophobicContact CE2-CH2 4.03Å; Y182-W213 HydrophobicContact CE2-CZ2 4.37Å; Y182-W213 AromaticContact CE2-CZ3 3.66Å; Y182-W213 HydrophobicContact CE2-CZ3 3.66Å; A184-W213 VanDerWaalsContact CA-CZ2 3.49Å; A184-W213 HydrophobicContact CB-CH2 4.07Å; A184-W213 HydrophobicContact CB-CZ2 3.5Å; A184-W213 VanDerWaalsContact CB-CZ2 3.5Å; A184-W213 WeakPolarHBondContact O-CZ2 3.43Å; K200-W213 WeakPolarHBondContact CA-O 3.3Å; F201-W213 HydrophobicContact CD1-CB 4.03Å; F201-W213 HydrophobicContact CD2-CB 4.07Å; F201-W213 HydrophobicContact CD2-CG 4.37Å; F201-W213 HydrophobicContact CE1-CB 3.45Å; F201-W213 VanDerWaalsContact CE1-CB 3.45Å; F201-W213 HydrophobicContact CE1-CG 4.39Å; F201-W213 HydrophobicContact CE2-CB 3.5Å; F201-W213 AromaticContact CE2-CD1 3.6Å; F201-W213 AromaticContact CE2-CG 3.61Å; F201-W213 HydrophobicContact CE2-CG 3.61Å; F201-W213 HydrophobicContact CG-CB 4.29Å; F201-W213 HydrophobicContact CZ-CB 3.14Å; F201-W213 HydrophobicContact CZ-CD2 4.44Å; F201-W213 AromaticContact CZ-CG 3.62Å; F201-W213 HydrophobicContact CZ-CG 3.62Å; F201-W213 PolarHBondContact N-O 2.92Å; F201-W213 VanDerWaalsContact N-O 3.1Å; F201-W213 PolarHBondContact O-N 2.86Å; T203-W213 PolarHBondContact OG1-NE1 2.77Å; R211-W213 HydrophobicContact CB-CZ2 4.25Å; W213-A219 WeakPolarHBondContact CA-O 3.25Å; W213-E220 HydrophobicContact CE3-CB 4.27Å; W213-E220 HydrophobicContact CH2-CB 3.95Å; W213-E220 HydrophobicContact CH2-CG 4.45Å; W213-E220 HydrophobicContact CZ2-CB 4.47Å; W213-E220 HydrophobicContact CZ3-CB 3.86Å
214	D	95.2	Very high	94.6	Very high	38 Å²	38	44.3 Å²	44.3	20%	0.203	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	121.8	165.8	-178.2	-25.4	0	0	0	108.9	H216 R217 C218 A219	D214-H216 PolarHBondContact O-N 2.92Å; D214-H216 PolarHBondContact OD1-N 2.66Å; D214-R217 HydrophobicContact CB-CB 4.15Å; D214-R217 PolarHBondContact OD1-N 3.12Å; D214-R217 WeakPolarHBondContact OD2-CD 3.33Å; D214-R217 WeakPolarHBondContact OD2-CG 3.39Å; D214-R217 IonicContact OD2-NE 2.79Å; D214-R217 PolarHBondContact OD2-NE 3.27Å; D214-C218 PolarHBondContact O-N 3.1Å; D214-A219 PolarHBondContact N-O 3.45Å; D214-A219 VanDerWaalsContact N-O 3.15Å
215	F	93.8	Very high	94.4	Very high	19 Å²	19	52.8 Å²	52.8	8%	0.083	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60	-43	-177.1	-174	-95.5	0	0	0	113.1	W159 Y171 F194 D198 N199 F201	W159-F215 HydrophobicContact CB-CE2 4.36Å; W159-F215 HydrophobicContact CB-CZ 3.85Å; W159-F215 AromaticContact CD1-CE1 3.98Å; W159-F215 AromaticContact CD1-CZ 3.75Å; W159-F215 HydrophobicContact CD2-CE1 4.25Å; W159-F215 AromaticContact CD2-CZ 3.73Å; W159-F215 HydrophobicContact CD2-CZ 3.73Å; W159-F215 HydrophobicContact CE3-CZ 4.29Å; W159-F215 HydrophobicContact CG-CE1 4.14Å; W159-F215 HydrophobicContact CG-CE2 4.44Å; W159-F215 AromaticContact CG-CZ 3.49Å; W159-F215 HydrophobicContact CG-CZ 3.49Å; W159-F215 VanDerWaalsContact CG-CZ 3.49Å; Y171-F215 HydrophobicContact CD1-CD2 4.32Å; Y171-F215 AromaticContact CD1-CE2 3.58Å; Y171-F215 HydrophobicContact CD1-CE2 3.58Å; Y171-F215 AromaticContact CD1-CZ 3.91Å; Y171-F215 HydrophobicContact CD1-CZ 3.91Å; Y171-F215 AromaticContact CE1-CD2 3.71Å; Y171-F215 HydrophobicContact CE1-CD2 3.71Å; Y171-F215 AromaticContact CE1-CE2 3.44Å; Y171-F215 HydrophobicContact CE1-CE2 3.44Å; Y171-F215 VanDerWaalsContact CE1-CE2 3.44Å; Y171-F215 HydrophobicContact CE1-CZ 4.07Å; F194-F215 AromaticContact CE1-CD2 3.88Å; F194-F215 HydrophobicContact CE1-CD2 3.88Å; F194-F215 AromaticContact CE1-CE2 3.78Å; F194-F215 HydrophobicContact CE1-CE2 3.78Å; F194-F215 HydrophobicContact CZ-CE2 4.31Å; D198-F215 WeakPolarHBondContact O-CB 3.3Å; N199-F215 WeakPolarHBondContact O-CB 3.49Å; N199-F215 PolarHBondContact O-N 3.15Å; N199-F215 VanDerWaalsContact O-N 3.1Å; F201-F215 HydrophobicContact CD1-CB 4.22Å; F201-F215 AromaticContact CD1-CD2 4Å; F201-F215 HydrophobicContact CD1-CD2 4Å; F201-F215 HydrophobicContact CE1-CB 4.4Å; F201-F215 HydrophobicContact CE1-CD2 4.22Å
216	H	91.6	Very high	94	Very high	135 Å²	135	54.7 Å²	54.7	63%	0.625	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.5	-25.9	-172.4	-62	88.1	0	0	0	112.4	N199 D214	N199-H216 PolarHBondContact OD1-CE1 3.15Å; D214-H216 PolarHBondContact O-N 2.92Å; D214-H216 PolarHBondContact OD1-N 2.66Å
217	R	91.4	Very high	93.9	Very high	199 Å²	199	54.2 Å²	54.2	75%	0.751	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.9	-10.9	-176.9	-59.2	-174.9	-173.3	177.9	0.4	114.1	D214 A219	D214-R217 HydrophobicContact CB-CB 4.15Å; D214-R217 PolarHBondContact OD1-N 3.12Å; D214-R217 WeakPolarHBondContact OD2-CD 3.33Å; D214-R217 WeakPolarHBondContact OD2-CG 3.39Å; D214-R217 IonicContact OD2-NE 2.79Å; D214-R217 PolarHBondContact OD2-NE 3.27Å; R217-A219 HydrophobicContact CB-CB 4.14Å; R217-A219 PolarHBondContact O-N 3.13Å
218	C	90.3	Very high	93.6	Very high	46 Å²	46	55.7 Å²	55.7	31%	0.311	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.7	35.6	-174.4	-58.5	0	0	0	0	113.3	Y171 Y182 D214	Y171-C218 WeakPolarHBondContact CE2-SG 3.43Å; Y171-C218 PolarHBondContact OH-SG 2.9Å; Y171-C218 VanDerWaalsContact OH-SG 3.39Å; Y182-C218 HydrophobicContact CD1-CB 4.46Å; D214-C218 PolarHBondContact O-N 3.1Å
219	A	92.8	Very high	93.6	Very high	44 Å²	44	55 Å²	55	36%	0.364	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	144.5	-171.2	0	0	0	0	0	112.2	W213 D214 R217 E221	W213-A219 WeakPolarHBondContact CA-O 3.25Å; D214-A219 PolarHBondContact N-O 3.45Å; D214-A219 VanDerWaalsContact N-O 3.15Å; R217-A219 HydrophobicContact CB-CB 4.14Å; R217-A219 PolarHBondContact O-N 3.13Å; A219-E221 PolarHBondContact O-N 2.98Å
220	E	93.2	Very high	93.6	Very high	91 Å²	91	56.3 Å²	56.3	43%	0.425	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	110.2	175.9	-171.3	-178.8	101.2	0	0	109.3	R211 W213 V223	R211-E220 WeakPolarHBondContact CD-OE2 3.5Å; R211-E220 IonicContact CZ-OE2 3.64Å; R211-E220 IonicContact NE-OE2 2.75Å; R211-E220 IonicContact NH1-OE2 2.66Å; R211-E220 PolarHBondContact NH1-OE2 2.82Å; W213-E220 HydrophobicContact CE3-CB 4.27Å; W213-E220 HydrophobicContact CH2-CB 3.95Å; W213-E220 HydrophobicContact CH2-CG 4.45Å; W213-E220 HydrophobicContact CZ2-CB 4.47Å; W213-E220 HydrophobicContact CZ3-CB 3.86Å; E220-V223 VanDerWaalsContact CD-CG2 3.4Å; E220-V223 HydrophobicContact CG-CG2 4.06Å; E220-V223 WeakPolarHBondContact OE1-CG2 3.4Å
221	E	93.6	Very high	93.6	Very high	63 Å²	63	56.3 Å²	56.3	29%	0.294	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	-45.3	179.3	-168.3	-169.2	-178.5	0	0	111	K200 I212 A219	K200-E221 WeakPolarHBondContact CE-OE2 3.5Å; K200-E221 IonicContact NZ-OE1 3.92Å; K200-E221 PolarHBondContact NZ-OE1 2.96Å; K200-E221 IonicContact NZ-OE2 3.37Å; K200-E221 PolarHBondContact NZ-OE2 3.32Å; I212-E221 HydrophobicContact CG2-CB 4.45Å; I212-E221 PolarHBondContact O-N 2.87Å; A219-E221 PolarHBondContact O-N 2.98Å
222	R	94.3	Very high	93.5	Very high	120 Å²	120	56.5 Å²	56.5	45%	0.453	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	144.8	-177.7	-66.3	-64.4	178.4	-105.2	6.8	111.4	R211 I212	R211-R222 WeakPolarHBondContact CA-O 3.44Å; I212-R222 HydrophobicContact CB-CB 4.35Å; I212-R222 HydrophobicContact CD1-CB 4.27Å; I212-R222 PolarHBondContact N-O 3.46Å; I212-R222 PolarHBondContact O-N 3.12Å
223	V	95.5	Very high	93.4	Very high	36 Å²	36	56.7 Å²	56.7	22%	0.218	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	114.9	166.7	-171.5	0	0	0	0	109.2	T209 R211 E220 R225	T209-V223 HydrophobicContact CG2-CG1 3.93Å; R211-V223 HydrophobicContact CG-CG1 4.19Å; R211-V223 HydrophobicContact CG-CG2 4.27Å; E220-V223 VanDerWaalsContact CD-CG2 3.4Å; E220-V223 HydrophobicContact CG-CG2 4.06Å; E220-V223 WeakPolarHBondContact OE1-CG2 3.4Å; V223-R225 HydrophobicContact CB-CG 4.44Å; V223-R225 HydrophobicContact CG1-CG 3.73Å; V223-R225 PolarHBondContact O-N 2.85Å
224	L	95.2	Very high	93.5	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	99.7	173.1	-51.4	173.6	0	0	0	107.8	V210 I212 I243 W257 G262	V210-L224 HydrophobicContact CB-CB 4.1Å; V210-L224 HydrophobicContact CB-CD1 4.05Å; V210-L224 HydrophobicContact CG1-CD1 3.9Å; V210-L224 PolarHBondContact N-O 3.35Å; V210-L224 WeakPolarHBondContact O-CA 3.47Å; V210-L224 VanDerWaalsContact O-CB 3.27Å; V210-L224 WeakPolarHBondContact O-CB 3.42Å; V210-L224 PolarHBondContact O-N 3.02Å; I212-L224 HydrophobicContact CD1-CD1 4.11Å; I212-L224 HydrophobicContact CD1-CD2 4.18Å; I212-L224 HydrophobicContact CD1-CG 4.29Å; I212-L224 HydrophobicContact CG1-CD1 4.21Å; I212-L224 HydrophobicContact CG1-CG 4.44Å; L224-I243 HydrophobicContact CD1-CD1 4.15Å; L224-W257 HydrophobicContact CB-CD2 3.89Å; L224-W257 HydrophobicContact CB-CE3 3.81Å; L224-W257 HydrophobicContact CB-CG 4.49Å; L224-W257 HydrophobicContact CB-CH2 4.22Å; L224-W257 HydrophobicContact CB-CZ2 4.28Å; L224-W257 HydrophobicContact CB-CZ3 3.97Å; L224-W257 HydrophobicContact CD1-CB 3.78Å; L224-W257 HydrophobicContact CD1-CD2 3.98Å; L224-W257 HydrophobicContact CD1-CE3 4.45Å; L224-W257 HydrophobicContact CD1-CG 3.68Å; L224-W257 HydrophobicContact CD2-CB 4.27Å; L224-W257 HydrophobicContact CD2-CD2 4.27Å; L224-W257 HydrophobicContact CD2-CE3 3.92Å; L224-W257 HydrophobicContact CD2-CG 4.45Å; L224-W257 HydrophobicContact CG-CD2 4.27Å; L224-W257 HydrophobicContact CG-CE3 4.27Å; L224-W257 HydrophobicContact CG-CG 4.43Å; L224-G262 WeakPolarHBondContact CD2-O 3.18Å
225	R	93.5	Very high	93.5	Very high	177 Å²	177	55.4 Å²	55.4	67%	0.668	28%	0.283	S	S	*	.			trans	-99.9	141.2	177.5	-63.6	-173.2	-179.9	-80.8	-4.7	110.1	V223 W257	V223-R225 HydrophobicContact CB-CG 4.44Å; V223-R225 HydrophobicContact CG1-CG 3.73Å; V223-R225 PolarHBondContact O-N 2.85Å; R225-W257 WeakPolarHBondContact O-CH2 3.47Å
226	G	88.8	Confident	93.6	Very high	40 Å²	40	55 Å²	55	41%	0.412	28%	0.281	S	S	.	.			trans	143.3	-1.9	167.6	0	0	0	0	0	115.4	Q252 K255	G226-Q252 PolarHBondContact O-OE1 2.97Å; G226-K255 PolarHBondContact O-NZ 3.28Å
227	H	92.6	Very high	93.8	Very high	10 Å²	10	49.2 Å²	49.2	5%	0.046	25%	0.254	C	S	.	.			trans	-71.3	144.6	164.8	-78.3	-63.5	0	0	0	110.3	V231 S245 W257	H227-V231 HydrophobicContact CB-CG2 4.06Å; H227-V231 VanDerWaalsContact CD2-CG2 3.44Å; H227-V231 WeakPolarHBondContact CD2-CG2 3.33Å; H227-S245 PolarHBondContact NE2-OG 3.4Å; H227-W257 AromaticContact CD2-CZ2 3.97Å; H227-W257 AromaticContact NE2-NE1 3.96Å
228	G	90.3	Very high	93.9	Very high	58 Å²	58	41.3 Å²	41.3	60%	0.598	23%	0.229	S	C	*	.	S	Bend	trans	-81.1	-11.8	179	0	0	0	0	0	115	D249	G228-D249 WeakPolarHBondContact CA-OD2 3.33Å; G228-D249 PolarHBondContact N-OD2 3.38Å
229	S	93.6	Very high	94	Very high	27 Å²	27	43.9 Å²	43.9	19%	0.189	24%	0.243	C	C	.	.	S	Bend	trans	-161.2	-176.6	179.3	73.2	0	0	0	0	112.9	V231 S247 D249	S229-V231 PolarHBondContact O-N 3.21Å; S229-S247 PolarHBondContact O-OG 3.17Å; S229-S247 VanDerWaalsContact O-OG 3.13Å; S229-D249 WeakPolarHBondContact OG-CA 3.15Å; S229-D249 WeakPolarHBondContact OG-CB 3.28Å; S229-D249 PolarHBondContact OG-N 3.26Å
230	D	94.9	Very high	93.9	Very high	31 Å²	31	45.8 Å²	45.8	17%	0.166	25%	0.246	C	C	.	.			trans	-32.9	123.9	179.6	-30.1	16.3	0	0	0	113.1	D206 R232 S247 K248	D206-D230 HydrophobicContact CB-CB 4.29Å; D206-D230 WeakPolarHBondContact O-CA 3.31Å; D230-R232 IonicContact OD2-CZ 3.25Å; D230-R232 IonicContact OD2-NH1 3.19Å; D230-R232 IonicContact OD2-NH2 2.74Å; D230-R232 PolarHBondContact OD2-NH2 3.21Å; D230-S247 WeakPolarHBondContact O-CA 3.31Å; D230-S247 PolarHBondContact O-OG 3.36Å; D230-K248 HydrophobicContact CB-CB 4.11Å; D230-K248 HydrophobicContact CB-CD 3.9Å; D230-K248 VanDerWaalsContact CG-NZ 3.33Å; D230-K248 WeakPolarHBondContact O-CB 3.48Å; D230-K248 PolarHBondContact O-N 3.14Å; D230-K248 WeakPolarHBondContact OD1-CD 3.47Å; D230-K248 IonicContact OD1-NZ 2.97Å; D230-K248 PolarHBondContact OD1-NZ 3.1Å; D230-K248 VanDerWaalsContact OD1-NZ 3.14Å; D230-K248 WeakPolarHBondContact OD2-CD 3.27Å; D230-K248 WeakPolarHBondContact OD2-CE 3.45Å; D230-K248 IonicContact OD2-NZ 3.88Å; D230-K248 PolarHBondContact OD2-NZ 3.45Å
231	V	96.1	Very high	93.8	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	122.9	173.7	-171.2	0	0	0	0	108.8	R190 C204 S205 V210 H227 S229 G246	R190-V231 WeakPolarHBondContact CG-O 3.24Å; C204-V231 HydrophobicContact CB-CB 3.97Å; C204-V231 HydrophobicContact CB-CG1 3.62Å; S205-V231 PolarHBondContact O-N 3.35Å; V210-V231 HydrophobicContact CG2-CB 4.24Å; V210-V231 HydrophobicContact CG2-CG1 3.8Å; V210-V231 HydrophobicContact CG2-CG2 4.03Å; H227-V231 HydrophobicContact CB-CG2 4.06Å; H227-V231 VanDerWaalsContact CD2-CG2 3.44Å; H227-V231 WeakPolarHBondContact CD2-CG2 3.33Å; S229-V231 PolarHBondContact O-N 3.21Å; V231-G246 WeakPolarHBondContact CG1-O 3.17Å
232	R	95	Very high	93.8	Very high	42 Å²	42	42.2 Å²	42.2	16%	0.158	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	-27.1	-167.8	-72.6	-73	146.5	87.3	-10.2	113.9	R190 D206 D230 G246	R190-R232 VanDerWaalsContact CB-O 3.31Å; R190-R232 WeakPolarHBondContact CB-O 3.42Å; R190-R232 VanDerWaalsContact CZ-NE 3.31Å; D206-R232 VanDerWaalsContact CG-NH2 3.31Å; D206-R232 IonicContact OD1-CZ 2.86Å; D206-R232 IonicContact OD1-NE 3.55Å; D206-R232 PolarHBondContact OD1-NE 3.06Å; D206-R232 IonicContact OD1-NH2 3.73Å; D206-R232 PolarHBondContact OD1-NH2 2.93Å; D206-R232 IonicContact OD2-NH2 3.48Å; D230-R232 IonicContact OD2-CZ 3.25Å; D230-R232 IonicContact OD2-NH1 3.19Å; D230-R232 IonicContact OD2-NH2 2.74Å; D230-R232 PolarHBondContact OD2-NH2 3.21Å; R232-G246 PolarHBondContact N-O 3.29Å
233	S	94.8	Very high	93.9	Very high	3 Å²	3	36.5 Å²	36.5	2%	0.021	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	152.2	179	58.2	0	0	0	0	110.9	C204 S245 G246 V278	C204-S233 VanDerWaalsContact SG-C 3.59Å; S233-S245 WeakPolarHBondContact O-CA 3.43Å; S233-G246 PolarHBondContact N-O 3.06Å; S233-G246 PolarHBondContact O-N 3.44Å; S233-V278 WeakPolarHBondContact OG-CG2 3.45Å; S233-V278 PolarHBondContact OG-N 3.46Å
234	V	96.4	Very high	94	Very high	11 Å²	11	34.8 Å²	34.8	7%	0.067	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	139.2	174.4	69	0	0	0	0	108.7	V202 C204 V210 I243 I244	V202-V234 HydrophobicContact CB-CG2 4.37Å; V202-V234 HydrophobicContact CG1-CB 4.47Å; V202-V234 HydrophobicContact CG1-CG1 4.05Å; V202-V234 HydrophobicContact CG1-CG2 3.56Å; V202-V234 HydrophobicContact CG2-CG2 3.84Å; C204-V234 HydrophobicContact CB-CB 3.89Å; C204-V234 HydrophobicContact CB-CG1 3.96Å; V210-V234 HydrophobicContact CG1-CG2 3.93Å; V234-I243 HydrophobicContact CG2-CG2 3.53Å; V234-I244 WeakPolarHBondContact CA-O 3.4Å; V234-I244 WeakPolarHBondContact CG2-O 3.26Å
235	A	96.3	Very high	94	Very high	12 Å²	12	34.8 Å²	34.8	10%	0.099	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	134.6	174.8	0	0	0	0	0	110.2	I244 W280	A235-I244 HydrophobicContact CB-CG2 3.9Å; A235-I244 PolarHBondContact N-O 3.11Å; A235-I244 WeakPolarHBondContact O-CG2 3.46Å; A235-I244 PolarHBondContact O-N 2.89Å; A235-W280 PolarHBondContact O-NE1 3.33Å
236	W	96	Very high	94.1	Very high	11 Å²	11	26.4 Å²	26.4	4%	0.042	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	144.2	171.8	-152.5	-67.3	0	0	0	109	S193 F194 C195 K200 V202 I212 I243 P259 W280	S193-W236 PolarHBondContact OG-N 3.2Å; F194-W236 WeakPolarHBondContact O-CB 3.19Å; C195-W236 HydrophobicContact CB-CD2 3.95Å; C195-W236 HydrophobicContact CB-CE3 4.32Å; C195-W236 HydrophobicContact CB-CG 4.44Å; C195-W236 HydrophobicContact CB-CH2 4.27Å; C195-W236 HydrophobicContact CB-CZ2 3.85Å; C195-W236 HydrophobicContact CB-CZ3 4.47Å; K200-W236 HydrophobicContact CB-CH2 3.74Å; K200-W236 HydrophobicContact CB-CZ2 4.35Å; K200-W236 HydrophobicContact CB-CZ3 4.19Å; K200-W236 HydrophobicContact CD-CH2 4.02Å; K200-W236 HydrophobicContact CD-CZ2 4.41Å; V202-W236 HydrophobicContact CB-CE3 3.85Å; V202-W236 HydrophobicContact CB-CZ3 3.94Å; V202-W236 HydrophobicContact CG1-CE3 3.79Å; V202-W236 HydrophobicContact CG1-CZ3 4.39Å; I212-W236 HydrophobicContact CG2-CH2 4.04Å; I212-W236 HydrophobicContact CG2-CZ3 4.19Å; W236-I243 HydrophobicContact CD2-CD1 4.35Å; W236-I243 HydrophobicContact CD2-CG1 3.76Å; W236-I243 HydrophobicContact CE3-CD1 3.86Å; W236-I243 HydrophobicContact CE3-CG1 3.68Å; W236-I243 HydrophobicContact CG-CG1 4.29Å; W236-I243 HydrophobicContact CH2-CD1 3.99Å; W236-I243 HydrophobicContact CH2-CG1 4.37Å; W236-I243 HydrophobicContact CZ2-CD1 4.48Å; W236-I243 HydrophobicContact CZ2-CG1 4.46Å; W236-I243 HydrophobicContact CZ3-CD1 3.66Å; W236-I243 HydrophobicContact CZ3-CG1 4.01Å; W236-P259 HydrophobicContact CH2-CB 3.6Å; W236-P259 HydrophobicContact CH2-CG 4.2Å; W236-P259 HydrophobicContact CZ2-CB 3.57Å; W236-P259 HydrophobicContact CZ2-CG 3.63Å; W236-W280 VanDerWaalsContact C-CD1 3.43Å
237	H	96	Very high	94.4	Very high	13 Å²	13	24.5 Å²	24.5	6%	0.06	15%	0.152	C	C	.	.			trans	-70.9	137.9	177.8	-178.7	-66.1	0	0	0	111.6	P196 V239 L240 L242 W280 G284 L301	P196-H237 WeakPolarHBondContact CD-O 3.49Å; H237-V239 VanDerWaalsContact C-N 3.26Å; H237-V239 WeakPolarHBondContact CE1-CB 3.4Å; H237-V239 PolarHBondContact ND1-N 2.82Å; H237-V239 PolarHBondContact O-N 2.94Å; H237-V239 VanDerWaalsContact O-N 3.16Å; H237-L240 HydrophobicContact CB-CB 4.45Å; H237-L240 WeakPolarHBondContact CB-O 3.33Å; H237-L240 WeakPolarHBondContact ND1-CB 3.46Å; H237-L240 PolarHBondContact ND1-N 3.28Å; H237-L242 HydrophobicContact CB-CB 4.11Å; H237-L242 WeakPolarHBondContact CB-O 3.44Å; H237-L242 PolarHBondContact N-O 3.37Å; H237-W280 HydrophobicContact CB-CD2 4.35Å; H237-W280 HydrophobicContact CB-CZ2 4.22Å; H237-W280 AromaticContact CD2-CE3 3.7Å; H237-W280 AromaticContact CD2-CH2 3.73Å; H237-W280 AromaticContact CD2-CZ3 3.55Å; H237-G284 VanDerWaalsContact CE1-CA 3.41Å; H237-G284 WeakPolarHBondContact CE1-CA 3.38Å; H237-G284 WeakPolarHBondContact NE2-CA 3.47Å; H237-G284 CovalentContact NE2-O 1.81Å; H237-G284 PolarHBondContact NE2-O 3.4Å; H237-L301 WeakPolarHBondContact NE2-CD2 3.38Å
238	P	93.1	Very high	94.5	Very high	33 Å²	33	28.1 Å²	28.1	21%	0.214	17%	0.168	C	C	.	.	S	Bend	trans	-69.5	-9.9	-171.5	27.7	-37.7	0	0	0	116.1	P196	P196-P238 WeakPolarHBondContact CB-O 3.34Å
239	V	91.7	Very high	94.5	Very high	99 Å²	99	26.5 Å²	26.5	60%	0.6	15%	0.146	S	C	*	.	S	Bend	trans	-136.4	-50.6	-179.3	-176.2	0	0	0	0	111.8	H237	H237-V239 VanDerWaalsContact C-N 3.26Å; H237-V239 WeakPolarHBondContact CE1-CB 3.4Å; H237-V239 PolarHBondContact ND1-N 2.82Å; H237-V239 PolarHBondContact O-N 2.94Å; H237-V239 VanDerWaalsContact O-N 3.16Å
240	L	91.1	Very high	94.1	Very high	84 Å²	84	28.3 Å²	28.3	44%	0.44	16%	0.162	S	C	.	.	S	Bend	trans	-74.9	146.3	178.5	-56.4	176.1	0	0	0	110.2	H237 L242 L301	H237-L240 HydrophobicContact CB-CB 4.45Å; H237-L240 WeakPolarHBondContact CB-O 3.33Å; H237-L240 WeakPolarHBondContact ND1-CB 3.46Å; H237-L240 PolarHBondContact ND1-N 3.28Å; L240-L242 VanDerWaalsContact C-N 3.26Å; L240-L242 HydrophobicContact CB-CD1 4.18Å; L240-L242 HydrophobicContact CB-CG 4.28Å; L240-L242 HydrophobicContact CD1-CD1 4.08Å; L240-L242 PolarHBondContact O-N 3.2Å; L240-L301 HydrophobicContact CD1-CD2 3.92Å
241	S	91	Very high	93.8	Very high	44 Å²	44	33.7 Å²	33.7	31%	0.308	19%	0.186	S	C	.	.	S	Bend	trans	-75.2	80.1	168.2	-56.8	0	0	0	0	109.6	P259	S241-P259 WeakPolarHBondContact O-CD 3.36Å; S241-P259 WeakPolarHBondContact O-CG 3.11Å
242	L	94.3	Very high	93.1	Very high	36 Å²	36	36 Å²	36	19%	0.188	20%	0.197	C	C	.	.			trans	-144	147.2	178.5	-71.5	174.7	0	0	0	110.7	H237 L240 L301	H237-L242 HydrophobicContact CB-CB 4.11Å; H237-L242 WeakPolarHBondContact CB-O 3.44Å; H237-L242 PolarHBondContact N-O 3.37Å; L240-L242 VanDerWaalsContact C-N 3.26Å; L240-L242 HydrophobicContact CB-CD1 4.18Å; L240-L242 HydrophobicContact CB-CG 4.28Å; L240-L242 HydrophobicContact CD1-CD1 4.08Å; L240-L242 PolarHBondContact O-N 3.2Å; L242-L301 HydrophobicContact CD1-CD2 4.32Å
243	I	96.6	Very high	92.6	Very high	0 Å²	0	34 Å²	34	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	134.6	177.7	-62.5	161.9	0	0	0	109.3	V202 I212 L224 V234 W236 L256 W257 P259	V202-I243 HydrophobicContact CB-CD1 4.17Å; V202-I243 HydrophobicContact CG1-CG2 4.34Å; V202-I243 HydrophobicContact CG2-CD1 4Å; V202-I243 HydrophobicContact CG2-CG2 4.24Å; I212-I243 HydrophobicContact CD1-CD1 3.59Å; I212-I243 HydrophobicContact CG1-CD1 3.78Å; L224-I243 HydrophobicContact CD1-CD1 4.15Å; V234-I243 HydrophobicContact CG2-CG2 3.53Å; W236-I243 HydrophobicContact CD2-CD1 4.35Å; W236-I243 HydrophobicContact CD2-CG1 3.76Å; W236-I243 HydrophobicContact CE3-CD1 3.86Å; W236-I243 HydrophobicContact CE3-CG1 3.68Å; W236-I243 HydrophobicContact CG-CG1 4.29Å; W236-I243 HydrophobicContact CH2-CD1 3.99Å; W236-I243 HydrophobicContact CH2-CG1 4.37Å; W236-I243 HydrophobicContact CZ2-CD1 4.48Å; W236-I243 HydrophobicContact CZ2-CG1 4.46Å; W236-I243 HydrophobicContact CZ3-CD1 3.66Å; W236-I243 HydrophobicContact CZ3-CG1 4.01Å; I243-L256 CarbonylContact O-C 3.6Å; I243-L256 WeakPolarHBondContact O-CA 3.44Å; I243-W257 HydrophobicContact CB-CB 4.36Å; I243-W257 PolarHBondContact N-O 2.93Å; I243-W257 PolarHBondContact O-N 2.87Å; I243-P259 HydrophobicContact CD1-CB 3.85Å; I243-P259 HydrophobicContact CG1-CB 4.45Å
244	I	96.2	Very high	92.6	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	146	166.7	-161.3	164.9	0	0	0	110.2	V234 A235 I254 K255 L256 V278 W280 F287	V234-I244 WeakPolarHBondContact CA-O 3.4Å; V234-I244 WeakPolarHBondContact CG2-O 3.26Å; A235-I244 HydrophobicContact CB-CG2 3.9Å; A235-I244 PolarHBondContact N-O 3.11Å; A235-I244 WeakPolarHBondContact O-CG2 3.46Å; A235-I244 PolarHBondContact O-N 2.89Å; I244-I254 HydrophobicContact CD1-CG2 3.83Å; I244-I254 HydrophobicContact CG1-CG2 3.71Å; I244-K255 WeakPolarHBondContact CA-O 3.3Å; I244-L256 HydrophobicContact CB-CD2 3.65Å; I244-L256 HydrophobicContact CD1-CD2 3.83Å; I244-L256 HydrophobicContact CG1-CD2 3.66Å; I244-L256 HydrophobicContact CG1-CG 4.49Å; I244-V278 HydrophobicContact CB-CG1 4.26Å; I244-V278 HydrophobicContact CD1-CG1 3.66Å; I244-V278 HydrophobicContact CG1-CG1 3.87Å; I244-V278 HydrophobicContact CG2-CB 4.28Å; I244-V278 HydrophobicContact CG2-CG1 3.4Å; I244-W280 HydrophobicContact CB-CZ2 4Å; I244-W280 HydrophobicContact CD1-CZ2 4.49Å; I244-W280 HydrophobicContact CG2-CZ2 4.16Å; I244-W280 VanDerWaalsContact CG2-NE1 3.34Å; I244-F287 HydrophobicContact CD1-CD1 4.41Å; I244-F287 HydrophobicContact CD1-CD2 3.38Å; I244-F287 HydrophobicContact CD1-CE1 4.47Å; I244-F287 HydrophobicContact CD1-CE2 3.46Å; I244-F287 VanDerWaalsContact CD1-CE2 3.46Å; I244-F287 HydrophobicContact CD1-CG 3.89Å; I244-F287 HydrophobicContact CD1-CZ 4.02Å
245	S	96.1	Very high	92.5	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	133.7	-178	54.7	0	0	0	0	111.1	H227 S233 I254 K255 W257	H227-S245 PolarHBondContact NE2-OG 3.4Å; S233-S245 WeakPolarHBondContact O-CA 3.43Å; S245-I254 VanDerWaalsContact O-CA 3.3Å; S245-I254 WeakPolarHBondContact O-CA 3.32Å; S245-K255 PolarHBondContact N-O 3.35Å; S245-K255 PolarHBondContact O-N 2.96Å; S245-K255 PolarHBondContact OG-O 3.07Å; S245-K255 VanDerWaalsContact OG-O 3.07Å; S245-W257 PolarHBondContact OG-NE1 2.81Å
246	G	94.9	Very high	92.5	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	126.7	177.3	0	0	0	0	0	111.5	V231 R232 S233 P253	V231-G246 WeakPolarHBondContact CG1-O 3.17Å; R232-G246 PolarHBondContact N-O 3.29Å; S233-G246 PolarHBondContact N-O 3.06Å; S233-G246 PolarHBondContact O-N 3.44Å; G246-P253 CarbonylContact C-O 3.49Å; G246-P253 WeakPolarHBondContact CA-O 3.48Å
247	S	94.9	Very high	92.5	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	159.6	-179.7	-173.8	0	0	0	0	112.2	S229 D230 D249 P253 C275	S229-S247 PolarHBondContact O-OG 3.17Å; S229-S247 VanDerWaalsContact O-OG 3.13Å; D230-S247 WeakPolarHBondContact O-CA 3.31Å; D230-S247 PolarHBondContact O-OG 3.36Å; S247-D249 WeakPolarHBondContact OG-CB 3.23Å; S247-D249 PolarHBondContact OG-N 3.05Å; S247-P253 PolarHBondContact N-O 3.05Å; S247-C275 PolarHBondContact O-N 3.37Å
248	K	94.4	Very high	92.4	Very high	87 Å²	87	33.9 Å²	33.9	38%	0.378	19%	0.187	S	C	.	.	S	Bend	trans	-71.3	-15.5	164.1	-175.9	-169.6	175.1	-166.5	0	112.7	D230 A250 T274	D230-K248 HydrophobicContact CB-CB 4.11Å; D230-K248 HydrophobicContact CB-CD 3.9Å; D230-K248 VanDerWaalsContact CG-NZ 3.33Å; D230-K248 WeakPolarHBondContact O-CB 3.48Å; D230-K248 PolarHBondContact O-N 3.14Å; D230-K248 WeakPolarHBondContact OD1-CD 3.47Å; D230-K248 IonicContact OD1-NZ 2.97Å; D230-K248 PolarHBondContact OD1-NZ 3.1Å; D230-K248 VanDerWaalsContact OD1-NZ 3.14Å; D230-K248 WeakPolarHBondContact OD2-CD 3.27Å; D230-K248 WeakPolarHBondContact OD2-CE 3.45Å; D230-K248 IonicContact OD2-NZ 3.88Å; D230-K248 PolarHBondContact OD2-NZ 3.45Å; K248-A250 PolarHBondContact O-N 3.14Å; K248-T274 HydrophobicContact CB-CG2 4.19Å; K248-T274 HydrophobicContact CG-CG2 3.5Å
249	D	90.4	Very high	92.5	Very high	24 Å²	24	32.4 Å²	32.4	13%	0.128	18%	0.178	C	C	.	.			trans	-69.6	125.7	-176.9	-172.7	5	0	0	0	111.6	G228 S229 S247 Q251 Q252 P253	G228-D249 WeakPolarHBondContact CA-OD2 3.33Å; G228-D249 PolarHBondContact N-OD2 3.38Å; S229-D249 WeakPolarHBondContact OG-CA 3.15Å; S229-D249 WeakPolarHBondContact OG-CB 3.28Å; S229-D249 PolarHBondContact OG-N 3.26Å; S247-D249 WeakPolarHBondContact OG-CB 3.23Å; S247-D249 PolarHBondContact OG-N 3.05Å; D249-Q251 VanDerWaalsContact C-N 3.3Å; D249-Q251 WeakPolarHBondContact OD1-CB 3.45Å; D249-Q251 PolarHBondContact OD1-N 3.2Å; D249-Q252 CarbonylContact O-C 3.59Å; D249-Q252 PolarHBondContact OD2-N 3.1Å; D249-P253 VanDerWaalsContact O-CA 3.25Å; D249-P253 WeakPolarHBondContact O-CA 3.46Å
250	A	86.6	Confident	92.5	Very high	64 Å²	64	34.4 Å²	34.4	53%	0.529	18%	0.178	S	C	.	.	S	Bend	trans	-73.4	-22.8	174.4	0	0	0	0	0	112.6	K248	K248-A250 PolarHBondContact O-N 3.14Å
251	Q	87.8	Confident	92.6	Very high	145 Å²	145	34 Å²	34	68%	0.678	18%	0.179	S	C	*	.	S	Bend	trans	-79	-31.7	174.6	-61.1	-169.4	4.4	0	0	112	D249 Y269	D249-Q251 VanDerWaalsContact C-N 3.3Å; D249-Q251 WeakPolarHBondContact OD1-CB 3.45Å; D249-Q251 PolarHBondContact OD1-N 3.2Å; Q251-Y269 VanDerWaalsContact O-CD1 3.31Å; Q251-Y269 WeakPolarHBondContact O-CD1 3.31Å; Q251-Y269 WeakPolarHBondContact O-CE1 3.4Å
252	Q	81.2	Confident	92.5	Very high	47 Å²	47	32.8 Å²	32.8	22%	0.22	17%	0.174	C	C	.	.	S	Bend	trans	-139.3	65.3	-173.8	-58.6	-175.6	-1.5	0	0	110.9	G226 D249 I254 T267	G226-Q252 PolarHBondContact O-OE1 2.97Å; D249-Q252 CarbonylContact O-C 3.59Å; D249-Q252 PolarHBondContact OD2-N 3.1Å; Q252-I254 VanDerWaalsContact C-N 3.32Å; Q252-I254 PolarHBondContact O-N 3.27Å; Q252-T267 HydrophobicContact CB-CG2 4.11Å; Q252-T267 HydrophobicContact CG-CG2 4.17Å
253	P	84.9	Confident	92.5	Very high	1 Å²	1	37.5 Å²	37.5	1%	0.006	20%	0.195	C	C	.	.			trans	-68.7	-31.1	-168.6	26.3	-33.3	0	0	0	112.6	G246 S247 D249 L268	G246-P253 CarbonylContact C-O 3.49Å; G246-P253 WeakPolarHBondContact CA-O 3.48Å; S247-P253 PolarHBondContact N-O 3.05Å; D249-P253 VanDerWaalsContact O-CA 3.25Å; D249-P253 WeakPolarHBondContact O-CA 3.46Å; P253-L268 WeakPolarHBondContact CG-O 3.47Å
254	I	94.6	Very high	92.3	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	137	179.6	-64.3	154.6	0	0	0	111	I244 S245 Q252 L268 V270 V278 T289	I244-I254 HydrophobicContact CD1-CG2 3.83Å; I244-I254 HydrophobicContact CG1-CG2 3.71Å; S245-I254 VanDerWaalsContact O-CA 3.3Å; S245-I254 WeakPolarHBondContact O-CA 3.32Å; Q252-I254 VanDerWaalsContact C-N 3.32Å; Q252-I254 PolarHBondContact O-N 3.27Å; I254-L268 HydrophobicContact CB-CB 4.23Å; I254-L268 HydrophobicContact CG2-CB 4.38Å; I254-L268 HydrophobicContact CG2-CD1 4.08Å; I254-L268 HydrophobicContact CG2-CG 4.5Å; I254-L268 PolarHBondContact O-N 3.13Å; I254-V270 HydrophobicContact CD1-CB 4.03Å; I254-V270 HydrophobicContact CD1-CG1 4.37Å; I254-V270 HydrophobicContact CD1-CG2 4.12Å; I254-V278 HydrophobicContact CG1-CG2 4.49Å; I254-T289 HydrophobicContact CD1-CG2 3.41Å; I254-T289 VanDerWaalsContact CD1-CG2 3.41Å; I254-T289 HydrophobicContact CG1-CG2 4.48Å
255	K	94.6	Very high	92.2	Very high	11 Å²	11	44.8 Å²	44.8	5%	0.048	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	139.8	170.6	-70.1	-170.7	177.8	-170.8	0	113	G226 I244 S245 W257 S266 T267	G226-K255 PolarHBondContact O-NZ 3.28Å; I244-K255 WeakPolarHBondContact CA-O 3.3Å; S245-K255 PolarHBondContact N-O 3.35Å; S245-K255 PolarHBondContact O-N 2.96Å; S245-K255 PolarHBondContact OG-O 3.07Å; S245-K255 VanDerWaalsContact OG-O 3.07Å; K255-W257 HydrophobicContact CB-CZ2 4.04Å; K255-W257 HydrophobicContact CD-CH2 4.05Å; K255-W257 HydrophobicContact CD-CZ2 3.58Å; K255-W257 HydrophobicContact CG-CZ2 4.45Å; K255-S266 WeakPolarHBondContact CA-O 3.46Å; K255-T267 WeakPolarHBondContact CE-OG1 2.99Å; K255-T267 HydrophobicContact CG-CG2 4.09Å
256	L	95.5	Very high	92	Very high	4 Å²	4	46.1 Å²	46.1	2%	0.021	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	137.5	164.9	-70.6	178.2	0	0	0	109.9	I243 I244 S264 V265 S266 W280 L301 L304	I243-L256 CarbonylContact O-C 3.6Å; I243-L256 WeakPolarHBondContact O-CA 3.44Å; I244-L256 HydrophobicContact CB-CD2 3.65Å; I244-L256 HydrophobicContact CD1-CD2 3.83Å; I244-L256 HydrophobicContact CG1-CD2 3.66Å; I244-L256 HydrophobicContact CG1-CG 4.49Å; L256-S264 CarbonylContact O-C 3.24Å; L256-V265 HydrophobicContact CB-CB 4.46Å; L256-V265 PolarHBondContact O-N 3.04Å; L256-S266 WeakPolarHBondContact CD1-OG 3.36Å; L256-S266 PolarHBondContact N-O 3.14Å; L256-S266 PolarHBondContact O-N 3.37Å; L256-W280 HydrophobicContact CD2-CH2 4.38Å; L256-W280 HydrophobicContact CD2-CZ2 4.03Å; L256-L301 HydrophobicContact CD1-CD1 3.82Å; L256-L304 HydrophobicContact CD1-CD1 3.76Å; L256-L304 HydrophobicContact CD1-CD2 4.44Å
257	W	95.9	Very high	92	Very high	3 Å²	3	48 Å²	48	1%	0.011	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	143.5	-178	-53.4	91.7	0	0	0	111	L224 R225 H227 I243 S245 K255 E263	L224-W257 HydrophobicContact CB-CD2 3.89Å; L224-W257 HydrophobicContact CB-CE3 3.81Å; L224-W257 HydrophobicContact CB-CG 4.49Å; L224-W257 HydrophobicContact CB-CH2 4.22Å; L224-W257 HydrophobicContact CB-CZ2 4.28Å; L224-W257 HydrophobicContact CB-CZ3 3.97Å; L224-W257 HydrophobicContact CD1-CB 3.78Å; L224-W257 HydrophobicContact CD1-CD2 3.98Å; L224-W257 HydrophobicContact CD1-CE3 4.45Å; L224-W257 HydrophobicContact CD1-CG 3.68Å; L224-W257 HydrophobicContact CD2-CB 4.27Å; L224-W257 HydrophobicContact CD2-CD2 4.27Å; L224-W257 HydrophobicContact CD2-CE3 3.92Å; L224-W257 HydrophobicContact CD2-CG 4.45Å; L224-W257 HydrophobicContact CG-CD2 4.27Å; L224-W257 HydrophobicContact CG-CE3 4.27Å; L224-W257 HydrophobicContact CG-CG 4.43Å; R225-W257 WeakPolarHBondContact O-CH2 3.47Å; H227-W257 AromaticContact CD2-CZ2 3.97Å; H227-W257 AromaticContact NE2-NE1 3.96Å; I243-W257 HydrophobicContact CB-CB 4.36Å; I243-W257 PolarHBondContact N-O 2.93Å; I243-W257 PolarHBondContact O-N 2.87Å; S245-W257 PolarHBondContact OG-NE1 2.81Å; K255-W257 HydrophobicContact CB-CZ2 4.04Å; K255-W257 HydrophobicContact CD-CH2 4.05Å; K255-W257 HydrophobicContact CD-CZ2 3.58Å; K255-W257 HydrophobicContact CG-CZ2 4.45Å; W257-E263 WeakPolarHBondContact CA-O 2.98Å
258	D	95.5	Very high	91.9	Very high	30 Å²	30	48.6 Å²	48.6	16%	0.16	27%	0.266	C	S	.	.			trans	-87.9	118.8	164.6	167	27.6	0	0	0	109.3	K260 T261 G262 E263 V265	D258-K260 PolarHBondContact O-N 2.85Å; D258-K260 WeakPolarHBondContact OD1-CB 3.48Å; D258-K260 PolarHBondContact OD1-N 2.76Å; D258-T261 WeakPolarHBondContact CB-OG1 3.3Å; D258-T261 VanDerWaalsContact OD2-CB 3.31Å; D258-T261 WeakPolarHBondContact OD2-CB 3.49Å; D258-T261 WeakPolarHBondContact OD2-CG2 3.37Å; D258-T261 PolarHBondContact OD2-N 3.42Å; D258-T261 PolarHBondContact OD2-OG1 3Å; D258-G262 WeakPolarHBondContact O-CA 3.23Å; D258-G262 PolarHBondContact O-N 3.17Å; D258-E263 PolarHBondContact N-O 3.45Å; D258-E263 VanDerWaalsContact N-O 3.15Å; D258-V265 HydrophobicContact CB-CG2 3.85Å
259	P	93.8	Very high	91.8	Very high	2 Å²	2	52.6 Å²	52.6	1%	0.013	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-12.2	178.8	29.7	-36.9	0	0	0	114.9	I212 W236 S241 I243	I212-P259 VanDerWaalsContact CD1-CA 3.44Å; I212-P259 HydrophobicContact CD1-CB 3.61Å; W236-P259 HydrophobicContact CH2-CB 3.6Å; W236-P259 HydrophobicContact CH2-CG 4.2Å; W236-P259 HydrophobicContact CZ2-CB 3.57Å; W236-P259 HydrophobicContact CZ2-CG 3.63Å; S241-P259 WeakPolarHBondContact O-CD 3.36Å; S241-P259 WeakPolarHBondContact O-CG 3.11Å; I243-P259 HydrophobicContact CD1-CB 3.85Å; I243-P259 HydrophobicContact CG1-CB 4.45Å
260	K	92.2	Very high	91.7	Very high	140 Å²	140	52.3 Å²	52.3	61%	0.609	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.2	-52.6	179.1	-64.5	178.5	179.2	177.1	0	111.8	D258	D258-K260 PolarHBondContact O-N 2.85Å; D258-K260 WeakPolarHBondContact OD1-CB 3.48Å; D258-K260 PolarHBondContact OD1-N 2.76Å
261	T	92.5	Very high	91.9	Very high	75 Å²	75	49.7 Å²	49.7	46%	0.46	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-35.7	177.1	55.2	0	0	0	0	112.3	D258 E263	D258-T261 WeakPolarHBondContact CB-OG1 3.3Å; D258-T261 VanDerWaalsContact OD2-CB 3.31Å; D258-T261 WeakPolarHBondContact OD2-CB 3.49Å; D258-T261 WeakPolarHBondContact OD2-CG2 3.37Å; D258-T261 PolarHBondContact OD2-N 3.42Å; D258-T261 PolarHBondContact OD2-OG1 3Å; T261-E263 VanDerWaalsContact C-N 3.32Å; T261-E263 PolarHBondContact OG1-N 2.79Å
262	G	90.6	Very high	92	Very high	19 Å²	19	51.3 Å²	51.3	20%	0.196	26%	0.26	C	S	.	.			trans	84	7.3	-168.8	0	0	0	0	0	113.5	L224 D258	L224-G262 WeakPolarHBondContact CD2-O 3.18Å; D258-G262 WeakPolarHBondContact O-CA 3.23Å; D258-G262 PolarHBondContact O-N 3.17Å
263	E	93.8	Very high	92.5	Very high	135 Å²	135	52.8 Å²	52.8	63%	0.631	27%	0.27	S	S	*	.			trans	-82.5	147.7	-178.3	-66.1	179.7	-179.8	0	0	112.6	W257 D258 T261 V265	W257-E263 WeakPolarHBondContact CA-O 2.98Å; D258-E263 PolarHBondContact N-O 3.45Å; D258-E263 VanDerWaalsContact N-O 3.15Å; T261-E263 VanDerWaalsContact C-N 3.32Å; T261-E263 PolarHBondContact OG1-N 2.79Å; E263-V265 PolarHBondContact O-N 2.72Å
264	S	92.8	Very high	92.9	Very high	62 Å²	62	54 Å²	54	43%	0.434	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	103	171.1	60.2	0	0	0	0	110.2	L256	L256-S264 CarbonylContact O-C 3.24Å
265	V	93.2	Very high	92.9	Very high	91 Å²	91	54 Å²	54	55%	0.552	28%	0.277	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.5	-43.2	-176.5	177.4	0	0	0	0	111.3	L256 D258 E263	L256-V265 HydrophobicContact CB-CB 4.46Å; L256-V265 PolarHBondContact O-N 3.04Å; D258-V265 HydrophobicContact CB-CG2 3.85Å; E263-V265 PolarHBondContact O-N 2.72Å
266	S	93.1	Very high	93	Very high	29 Å²	29	54.4 Å²	54.4	20%	0.203	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.1	151.5	174.5	69.4	0	0	0	0	112.2	K255 L256	K255-S266 WeakPolarHBondContact CA-O 3.46Å; L256-S266 WeakPolarHBondContact CD1-OG 3.36Å; L256-S266 PolarHBondContact N-O 3.14Å; L256-S266 PolarHBondContact O-N 3.37Å
267	T	93.2	Very high	93	Very high	38 Å²	38	54.4 Å²	54.4	23%	0.233	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	128.8	170.1	-56.5	0	0	0	0	108.6	Q252 K255 Y269	Q252-T267 HydrophobicContact CB-CG2 4.11Å; Q252-T267 HydrophobicContact CG-CG2 4.17Å; K255-T267 WeakPolarHBondContact CE-OG1 2.99Å; K255-T267 HydrophobicContact CG-CG2 4.09Å; T267-Y269 HydrophobicContact CG2-CE2 4.01Å
268	L	92.9	Very high	92.9	Very high	13 Å²	13	54.4 Å²	54.4	7%	0.068	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	122.5	-175.2	-53.4	176.6	0	0	0	109.9	P253 I254 V270 F287 L304	P253-L268 WeakPolarHBondContact CG-O 3.47Å; I254-L268 HydrophobicContact CB-CB 4.23Å; I254-L268 HydrophobicContact CG2-CB 4.38Å; I254-L268 HydrophobicContact CG2-CD1 4.08Å; I254-L268 HydrophobicContact CG2-CG 4.5Å; I254-L268 PolarHBondContact O-N 3.13Å; L268-V270 HydrophobicContact CB-CG2 3.75Å; L268-V270 PolarHBondContact O-N 3.35Å; L268-F287 HydrophobicContact CD1-CE2 4.06Å; L268-F287 HydrophobicContact CD1-CZ 3.65Å; L268-L304 HydrophobicContact CD1-CD2 4.1Å; L268-L304 HydrophobicContact CD2-CB 3.93Å; L268-L304 HydrophobicContact CD2-CD1 4.25Å; L268-L304 HydrophobicContact CD2-CD2 4.35Å; L268-L304 HydrophobicContact CD2-CG 4.41Å
269	Y	92.3	Very high	93	Very high	172 Å²	172	54.3 Å²	54.3	68%	0.675	28%	0.283	S	S	*	.			trans	-96.9	69.5	-176	-62.2	-97.7	0	0	0	110.2	Q251 T267	Q251-Y269 VanDerWaalsContact O-CD1 3.31Å; Q251-Y269 WeakPolarHBondContact O-CD1 3.31Å; Q251-Y269 WeakPolarHBondContact O-CE1 3.4Å; T267-Y269 HydrophobicContact CG2-CE2 4.01Å
270	V	88.3	Confident	93.1	Very high	18 Å²	18	55 Å²	55	11%	0.109	29%	0.285	C	S	.	.			trans	-96.7	-45.3	-163.4	170.6	0	0	0	0	113.9	I254 L268 K297 F299	I254-V270 HydrophobicContact CD1-CB 4.03Å; I254-V270 HydrophobicContact CD1-CG1 4.37Å; I254-V270 HydrophobicContact CD1-CG2 4.12Å; L268-V270 HydrophobicContact CB-CG2 3.75Å; L268-V270 PolarHBondContact O-N 3.35Å; V270-K297 HydrophobicContact CG1-CB 4.24Å; V270-K297 HydrophobicContact CG1-CD 3.45Å; V270-K297 VanDerWaalsContact CG1-CD 3.45Å; V270-K297 HydrophobicContact CG1-CG 4.39Å; V270-K297 PolarHBondContact O-NZ 2.85Å; V270-F299 HydrophobicContact CB-CE2 4.36Å; V270-F299 HydrophobicContact CB-CZ 4.11Å; V270-F299 HydrophobicContact CG1-CE2 3.55Å; V270-F299 HydrophobicContact CG1-CZ 3.53Å; V270-F299 HydrophobicContact CG2-CE1 4.09Å; V270-F299 HydrophobicContact CG2-CE2 3.84Å; V270-F299 HydrophobicContact CG2-CZ 3.43Å; V270-F299 VanDerWaalsContact CG2-CZ 3.43Å
271	H	90.9	Very high	93.2	Very high	9 Å²	9	48.6 Å²	48.6	4%	0.042	26%	0.257	C	S	.	.			trans	-114.3	150	-172.4	-71.4	-71.6	0	0	0	110.5	T289 S291 D293	H271-T289 PolarHBondContact NE2-OG1 2.92Å; H271-S291 VanDerWaalsContact CE1-CB 3.42Å; H271-S291 WeakPolarHBondContact CE1-CB 2.98Å; H271-S291 VanDerWaalsContact CG-CB 3.42Å; H271-S291 WeakPolarHBondContact ND1-CB 3.4Å; H271-D293 WeakPolarHBondContact CA-OD2 3.47Å; H271-D293 WeakPolarHBondContact CB-OD2 3.42Å; H271-D293 IonicContact CE1-OD1 2.66Å; H271-D293 IonicContact CG-OD2 2.68Å; H271-D293 IonicContact ND1-OD1 3.66Å; H271-D293 PolarHBondContact ND1-OD1 2.91Å; H271-D293 VanDerWaalsContact ND1-OD1 3.14Å; H271-D293 IonicContact ND1-OD2 3.52Å; H271-D293 PolarHBondContact ND1-OD2 3.45Å
272	K	90.7	Very high	93.2	Very high	179 Å²	179	50.3 Å²	50.3	78%	0.778	26%	0.264	S	S	*	.	S	Bend	trans	-87.1	-27.1	174.8	-65	179	-178.9	176.8	0	112.4	D293	K272-D293 PolarHBondContact N-OD2 3.43Å
273	N	92.2	Very high	93.3	Very high	78 Å²	78	51.6 Å²	51.6	42%	0.417	27%	0.266	S	S	.	.	S	Bend	trans	-111.5	175.8	-179.7	-68.2	-6.3	0	0	0	110.6	C275 S291 R292 D293	N273-C275 PolarHBondContact O-N 2.72Å; N273-S291 PolarHBondContact O-OG 2.74Å; N273-R292 HydrophobicContact CB-CB 4.09Å; N273-R292 PolarHBondContact ND2-O 3.46Å; N273-D293 HydrophobicContact CB-CB 4.13Å
274	T	93.4	Very high	93.2	Very high	26 Å²	26	45.2 Å²	45.2	16%	0.16	24%	0.236	C	C	.	.			trans	-56	125.2	-175.8	71.9	0	0	0	0	111.9	K248 T276 S291 R292	K248-T274 HydrophobicContact CB-CG2 4.19Å; K248-T274 HydrophobicContact CG-CG2 3.5Å; T274-T276 PolarHBondContact O-N 3.48Å; T274-S291 WeakPolarHBondContact O-CA 3.47Å; T274-S291 PolarHBondContact O-OG 3.34Å; T274-S291 VanDerWaalsContact O-OG 3.09Å; T274-R292 PolarHBondContact O-N 3.15Å; T274-R292 WeakPolarHBondContact OG1-CD 3.4Å; T274-R292 VanDerWaalsContact OG1-CG 3.25Å; T274-R292 WeakPolarHBondContact OG1-CG 3.46Å; T274-R292 PolarHBondContact OG1-NE 3.26Å
275	C	94.8	Very high	93.3	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	123.6	169.5	-173.4	0	0	0	0	108.9	S247 N273 D277 V278 A290	S247-C275 PolarHBondContact O-N 3.37Å; N273-C275 PolarHBondContact O-N 2.72Å; C275-D277 PolarHBondContact SG-O 3.34Å; C275-V278 WeakPolarHBondContact SG-CG2 3.39Å; C275-A290 WeakPolarHBondContact CA-O 3.43Å; C275-A290 PolarHBondContact SG-O 2.69Å
276	T	94.8	Very high	93.4	Very high	19 Å²	19	43.5 Å²	43.5	12%	0.117	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	-41.3	-177.6	42.1	0	0	0	0	111.2	T274 A290 S291 R292 V318 M319	T274-T276 PolarHBondContact O-N 3.48Å; T276-A290 PolarHBondContact N-O 2.9Å; T276-A290 VanDerWaalsContact OG1-C 3.23Å; T276-A290 PolarHBondContact OG1-O 3.09Å; T276-A290 VanDerWaalsContact OG1-O 3.11Å; T276-S291 PolarHBondContact OG1-N 2.85Å; T276-R292 HydrophobicContact CG2-CG 3.68Å; T276-V318 WeakPolarHBondContact CB-O 3.5Å; T276-V318 WeakPolarHBondContact CG2-O 3.38Å; T276-V318 PolarHBondContact OG1-O 3.17Å; T276-M319 HydrophobicContact CG2-SD 4.28Å
277	D	95.5	Very high	93.5	Very high	4 Å²	4	42.1 Å²	42.1	2%	0.021	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	148.8	-175.9	-156	3.1	0	0	0	112.2	C275 A290 R320 V321	C275-D277 PolarHBondContact SG-O 3.34Å; D277-A290 HydrophobicContact CB-CB 4.09Å; D277-A290 PolarHBondContact N-O 3.39Å; D277-A290 PolarHBondContact O-N 3.5Å; D277-R320 IonicContact OD1-CZ 3.77Å; D277-R320 IonicContact OD1-NH1 2.79Å; D277-R320 PolarHBondContact OD1-NH1 3.36Å; D277-R320 WeakPolarHBondContact OD2-CA 3.42Å; D277-R320 WeakPolarHBondContact OD2-CD 3.45Å; D277-R320 IonicContact OD2-CZ 3.92Å; D277-R320 IonicContact OD2-NE 2.75Å; D277-R320 IonicContact OD2-NH1 3.66Å; D277-R320 PolarHBondContact OD2-NH1 2.7Å; D277-V321 PolarHBondContact OD2-N 2.84Å
278	V	95.6	Very high	93.6	Very high	4 Å²	4	40.4 Å²	40.4	2%	0.024	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	130.1	173	-175.3	0	0	0	0	108.4	S233 I244 I254 C275 F287 L288 T289	S233-V278 WeakPolarHBondContact OG-CG2 3.45Å; S233-V278 PolarHBondContact OG-N 3.46Å; I244-V278 HydrophobicContact CB-CG1 4.26Å; I244-V278 HydrophobicContact CD1-CG1 3.66Å; I244-V278 HydrophobicContact CG1-CG1 3.87Å; I244-V278 HydrophobicContact CG2-CB 4.28Å; I244-V278 HydrophobicContact CG2-CG1 3.4Å; I254-V278 HydrophobicContact CG1-CG2 4.49Å; C275-V278 WeakPolarHBondContact SG-CG2 3.39Å; V278-F287 HydrophobicContact CG1-CD2 4.49Å; V278-L288 WeakPolarHBondContact CA-O 3.48Å; V278-T289 HydrophobicContact CG1-CG2 4.32Å; V278-T289 HydrophobicContact CG2-CG2 4.41Å
279	S	95.8	Very high	93.8	Very high	28 Å²	28	39.8 Å²	39.8	20%	0.196	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	122.6	-172.4	-156.8	0	0	0	0	111.9	F287 L288 W323	S279-F287 WeakPolarHBondContact O-CA 3.29Å; S279-L288 PolarHBondContact N-O 3.33Å; S279-L288 PolarHBondContact O-N 2.94Å; S279-W323 PolarHBondContact O-NE1 3.25Å
280	W	95.9	Very high	93.9	Very high	17 Å²	17	31.6 Å²	31.6	6%	0.064	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	142	172.2	-73.2	107.5	0	0	0	111	A235 W236 H237 I244 L256 F287 L301 W323	A235-W280 PolarHBondContact O-NE1 3.33Å; W236-W280 VanDerWaalsContact C-CD1 3.43Å; H237-W280 HydrophobicContact CB-CD2 4.35Å; H237-W280 HydrophobicContact CB-CZ2 4.22Å; H237-W280 AromaticContact CD2-CE3 3.7Å; H237-W280 AromaticContact CD2-CH2 3.73Å; H237-W280 AromaticContact CD2-CZ3 3.55Å; I244-W280 HydrophobicContact CB-CZ2 4Å; I244-W280 HydrophobicContact CD1-CZ2 4.49Å; I244-W280 HydrophobicContact CG2-CZ2 4.16Å; I244-W280 VanDerWaalsContact CG2-NE1 3.34Å; L256-W280 HydrophobicContact CD2-CH2 4.38Å; L256-W280 HydrophobicContact CD2-CZ2 4.03Å; W280-F287 HydrophobicContact CD2-CB 4.11Å; W280-F287 HydrophobicContact CE3-CB 3.75Å; W280-F287 HydrophobicContact CE3-CD1 4.34Å; W280-F287 HydrophobicContact CE3-CG 4.47Å; W280-F287 HydrophobicContact CH2-CB 4.44Å; W280-F287 AromaticContact CH2-CD1 3.82Å; W280-F287 HydrophobicContact CH2-CD1 3.82Å; W280-F287 HydrophobicContact CH2-CE1 4.46Å; W280-F287 HydrophobicContact CH2-CG 4.36Å; W280-F287 HydrophobicContact CZ3-CB 3.92Å; W280-F287 AromaticContact CZ3-CD1 3.63Å; W280-F287 HydrophobicContact CZ3-CD1 3.63Å; W280-F287 HydrophobicContact CZ3-CG 4.16Å; W280-L301 HydrophobicContact CH2-CB 4.46Å; W280-L301 HydrophobicContact CH2-CD1 3.99Å; W280-L301 HydrophobicContact CH2-CD2 3.86Å; W280-L301 HydrophobicContact CH2-CG 4.32Å; W280-L301 HydrophobicContact CZ3-CB 4.25Å; W280-L301 HydrophobicContact CZ3-CD2 3.97Å; W280-W323 VanDerWaalsContact C-NE1 3.31Å; W280-W323 PolarHBondContact O-NE1 3.06Å
281	N	95.4	Very high	94.2	Very high	5 Å²	5	30.8 Å²	30.8	3%	0.027	16%	0.155	C	C	.	.			trans	-75.5	145.5	161.9	-167	-17.7	0	0	0	109	N283 G284 W286 W323 E328	N281-N283 PolarHBondContact ND2-ND2 2.99Å; N281-N283 PolarHBondContact O-N 3.18Å; N281-N283 VanDerWaalsContact O-N 3.16Å; N281-N283 PolarHBondContact OD1-N 3.48Å; N281-G284 PolarHBondContact O-N 3.08Å; N281-W286 HydrophobicContact CB-CB 3.97Å; N281-W286 WeakPolarHBondContact CB-O 3.46Å; N281-W286 PolarHBondContact N-O 3.41Å; N281-W323 HydrophobicContact CB-CD2 4.23Å; N281-W323 HydrophobicContact CB-CH2 4.16Å; N281-W323 HydrophobicContact CB-CZ2 3.69Å; N281-E328 PolarHBondContact ND2-O 3Å
282	D	91.9	Very high	94.4	Very high	111 Å²	111	34.5 Å²	34.5	59%	0.594	17%	0.168	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-20.3	178.6	-65.1	-36.1	0	0	0	112.5	G284	D282-G284 PolarHBondContact O-N 2.8Å
283	N	92.6	Very high	94.6	Very high	46 Å²	46	27.5 Å²	27.5	25%	0.246	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-12.3	170.9	77.1	13.9	0	0	0	114.1	N281 N285 W286 E328	N281-N283 PolarHBondContact ND2-ND2 2.99Å; N281-N283 PolarHBondContact O-N 3.18Å; N281-N283 VanDerWaalsContact O-N 3.16Å; N281-N283 PolarHBondContact OD1-N 3.48Å; N283-N285 PolarHBondContact O-N 3.35Å; N283-N285 PolarHBondContact OD1-N 2.9Å; N283-W286 PolarHBondContact OD1-N 3.46Å; N283-E328 PolarHBondContact ND2-OE2 2.81Å
284	G	92.1	Very high	94.7	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.135	C	C	.	.	S	Bend	trans	69.4	-10.7	179.4	0	0	0	0	0	116.1	H237 N281 D282	H237-G284 VanDerWaalsContact CE1-CA 3.41Å; H237-G284 WeakPolarHBondContact CE1-CA 3.38Å; H237-G284 WeakPolarHBondContact NE2-CA 3.47Å; H237-G284 CovalentContact NE2-O 1.81Å; H237-G284 PolarHBondContact NE2-O 3.4Å; N281-G284 PolarHBondContact O-N 3.08Å; D282-G284 PolarHBondContact O-N 2.8Å
285	N	94.6	Very high	94.8	Very high	64 Å²	64	27.8 Å²	27.8	34%	0.342	14%	0.137	S	C	.	.	S	Bend	trans	-80.1	-36	178.5	-64.9	-51.8	0	0	0	111.3	N283 D300 L301	N283-N285 PolarHBondContact O-N 3.35Å; N283-N285 PolarHBondContact OD1-N 2.9Å; N285-D300 WeakPolarHBondContact O-CA 3.3Å; N285-L301 PolarHBondContact O-N 2.91Å
286	W	95.3	Very high	94.8	Very high	54 Å²	54	27.8 Å²	27.8	21%	0.205	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	146.7	-173.6	-64.1	-16.6	0	0	0	113.5	N281 N283 L298 F299 L308 W323 A345	N281-W286 HydrophobicContact CB-CB 3.97Å; N281-W286 WeakPolarHBondContact CB-O 3.46Å; N281-W286 PolarHBondContact N-O 3.41Å; N283-W286 PolarHBondContact OD1-N 3.46Å; W286-L298 HydrophobicContact CB-CD1 3.89Å; W286-L298 HydrophobicContact CD2-CD1 4.39Å; W286-L298 HydrophobicContact CG-CD1 4.14Å; W286-F299 VanDerWaalsContact CA-O 3.32Å; W286-F299 WeakPolarHBondContact CA-O 3.44Å; W286-L308 HydrophobicContact CZ2-CD2 4.46Å; W286-W323 HydrophobicContact CB-CH2 4.44Å; W286-W323 HydrophobicContact CB-CZ2 4.37Å; W286-W323 HydrophobicContact CE3-CH2 4.17Å; W286-A345 HydrophobicContact CE3-CB 4.44Å; W286-A345 HydrophobicContact CH2-CB 4.27Å; W286-A345 HydrophobicContact CZ3-CB 3.81Å
287	F	95.5	Very high	94.8	Very high	0 Å²	0	28 Å²	28	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	144.3	163.3	62.2	-84.5	0	0	0	111	I244 L268 V278 S279 W280 T289 F299 L304	I244-F287 HydrophobicContact CD1-CD1 4.41Å; I244-F287 HydrophobicContact CD1-CD2 3.38Å; I244-F287 HydrophobicContact CD1-CE1 4.47Å; I244-F287 HydrophobicContact CD1-CE2 3.46Å; I244-F287 VanDerWaalsContact CD1-CE2 3.46Å; I244-F287 HydrophobicContact CD1-CG 3.89Å; I244-F287 HydrophobicContact CD1-CZ 4.02Å; L268-F287 HydrophobicContact CD1-CE2 4.06Å; L268-F287 HydrophobicContact CD1-CZ 3.65Å; V278-F287 HydrophobicContact CG1-CD2 4.49Å; S279-F287 WeakPolarHBondContact O-CA 3.29Å; W280-F287 HydrophobicContact CD2-CB 4.11Å; W280-F287 HydrophobicContact CE3-CB 3.75Å; W280-F287 HydrophobicContact CE3-CD1 4.34Å; W280-F287 HydrophobicContact CE3-CG 4.47Å; W280-F287 HydrophobicContact CH2-CB 4.44Å; W280-F287 AromaticContact CH2-CD1 3.82Å; W280-F287 HydrophobicContact CH2-CD1 3.82Å; W280-F287 HydrophobicContact CH2-CE1 4.46Å; W280-F287 HydrophobicContact CH2-CG 4.36Å; W280-F287 HydrophobicContact CZ3-CB 3.92Å; W280-F287 AromaticContact CZ3-CD1 3.63Å; W280-F287 HydrophobicContact CZ3-CD1 3.63Å; W280-F287 HydrophobicContact CZ3-CG 4.16Å; F287-T289 HydrophobicContact CD2-CG2 3.74Å; F287-T289 HydrophobicContact CE2-CG2 3.83Å; F287-F299 HydrophobicContact CD1-CB 4.02Å; F287-F299 HydrophobicContact CD2-CB 4.17Å; F287-F299 HydrophobicContact CD2-CD2 4.36Å; F287-F299 HydrophobicContact CE1-CB 3.47Å; F287-F299 VanDerWaalsContact CE1-CB 3.47Å; F287-F299 HydrophobicContact CE1-CG 4.42Å; F287-F299 HydrophobicContact CE2-CB 3.64Å; F287-F299 AromaticContact CE2-CD2 3.73Å; F287-F299 HydrophobicContact CE2-CD2 3.73Å; F287-F299 AromaticContact CE2-CG 3.86Å; F287-F299 HydrophobicContact CE2-CG 3.86Å; F287-F299 HydrophobicContact CG-CB 4.35Å; F287-F299 HydrophobicContact CZ-CB 3.25Å; F287-F299 HydrophobicContact CZ-CD2 4.11Å; F287-F299 AromaticContact CZ-CG 3.73Å; F287-F299 HydrophobicContact CZ-CG 3.73Å; F287-F299 PolarHBondContact N-O 2.99Å; F287-F299 VanDerWaalsContact N-O 3.15Å; F287-F299 PolarHBondContact O-N 2.9Å; F287-F299 VanDerWaalsContact O-N 3.08Å; F287-L304 HydrophobicContact CE1-CD2 3.72Å; F287-L304 HydrophobicContact CZ-CD2 3.78Å
288	L	95.6	Very high	94.8	Very high	1 Å²	1	27.9 Å²	27.9	1%	0.005	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	146.3	172.3	-76.2	166.4	0	0	0	110.4	V278 S279 I296 L298 F311 V321 W323 F331	V278-L288 WeakPolarHBondContact CA-O 3.48Å; S279-L288 PolarHBondContact N-O 3.33Å; S279-L288 PolarHBondContact O-N 2.94Å; L288-I296 HydrophobicContact CD2-CG2 3.78Å; L288-L298 HydrophobicContact CD2-CB 3.93Å; L288-L298 HydrophobicContact CD2-CD1 3.81Å; L288-L298 HydrophobicContact CD2-CG 4.46Å; L288-L298 HydrophobicContact CG-CD1 4.1Å; L288-F311 HydrophobicContact CD2-CE2 3.99Å; L288-V321 HydrophobicContact CB-CG1 4.12Å; L288-V321 HydrophobicContact CD1-CG1 3.68Å; L288-W323 HydrophobicContact CB-CZ2 4.22Å; L288-W323 HydrophobicContact CD1-CD2 3.87Å; L288-W323 VanDerWaalsContact CD1-CE2 3.41Å; L288-W323 HydrophobicContact CD1-CE3 4.13Å; L288-W323 HydrophobicContact CD1-CH2 3.63Å; L288-W323 HydrophobicContact CD1-CZ2 3.33Å; L288-W323 HydrophobicContact CD1-CZ3 4Å; L288-W323 HydrophobicContact CD2-CZ2 4.47Å; L288-W323 HydrophobicContact CG-CH2 3.85Å; L288-W323 HydrophobicContact CG-CZ2 3.36Å; L288-F331 HydrophobicContact CD1-CB 3.9Å; L288-F331 HydrophobicContact CD1-CD1 3.5Å; L288-F331 VanDerWaalsContact CD1-CD1 3.5Å; L288-F331 HydrophobicContact CD1-CD2 3.58Å; L288-F331 HydrophobicContact CD1-CE1 3.81Å; L288-F331 HydrophobicContact CD1-CE2 3.88Å; L288-F331 HydrophobicContact CD1-CG 3.36Å; L288-F331 HydrophobicContact CD1-CZ 3.98Å; L288-F331 HydrophobicContact CD2-CE1 4.05Å; L288-F331 HydrophobicContact CD2-CE2 4.33Å; L288-F331 HydrophobicContact CD2-CZ 3.92Å
289	T	95.7	Very high	94.8	Very high	0 Å²	0	28 Å²	28	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	130	179.5	54.1	0	0	0	0	108.2	I254 H271 V278 F287 I296 K297 F299	I254-T289 HydrophobicContact CD1-CG2 3.41Å; I254-T289 VanDerWaalsContact CD1-CG2 3.41Å; I254-T289 HydrophobicContact CG1-CG2 4.48Å; H271-T289 PolarHBondContact NE2-OG1 2.92Å; V278-T289 HydrophobicContact CG1-CG2 4.32Å; V278-T289 HydrophobicContact CG2-CG2 4.41Å; F287-T289 HydrophobicContact CD2-CG2 3.74Å; F287-T289 HydrophobicContact CE2-CG2 3.83Å; T289-I296 CarbonylContact O-C 3.6Å; T289-I296 VanDerWaalsContact O-CA 3.3Å; T289-I296 WeakPolarHBondContact O-CA 3.48Å; T289-I296 WeakPolarHBondContact O-CG2 3.24Å; T289-K297 PolarHBondContact N-O 3.18Å; T289-K297 PolarHBondContact O-N 3.37Å; T289-K297 WeakPolarHBondContact OG1-CB 3.37Å; T289-K297 PolarHBondContact OG1-O 2.89Å; T289-F299 HydrophobicContact CG2-CD2 4.27Å; T289-F299 HydrophobicContact CG2-CE2 4.43Å
290	A	95.5	Very high	94.7	Very high	1 Å²	1	27.8 Å²	27.8	1%	0.008	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	148.8	179.6	0	0	0	0	0	110.5	C275 T276 D277 V318 V321	C275-A290 WeakPolarHBondContact CA-O 3.43Å; C275-A290 PolarHBondContact SG-O 2.69Å; T276-A290 PolarHBondContact N-O 2.9Å; T276-A290 VanDerWaalsContact OG1-C 3.23Å; T276-A290 PolarHBondContact OG1-O 3.09Å; T276-A290 VanDerWaalsContact OG1-O 3.11Å; D277-A290 HydrophobicContact CB-CB 4.09Å; D277-A290 PolarHBondContact N-O 3.39Å; D277-A290 PolarHBondContact O-N 3.5Å; A290-V318 HydrophobicContact CB-CB 4.2Å; A290-V318 HydrophobicContact CB-CG1 3.87Å; A290-V321 HydrophobicContact CB-CG2 3.75Å
291	S	95.3	Very high	94.6	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.8	166.1	-172.7	179.7	0	0	0	0	113.6	H271 N273 T274 T276 D293 H294 L295 V318	H271-S291 VanDerWaalsContact CE1-CB 3.42Å; H271-S291 WeakPolarHBondContact CE1-CB 2.98Å; H271-S291 VanDerWaalsContact CG-CB 3.42Å; H271-S291 WeakPolarHBondContact ND1-CB 3.4Å; N273-S291 PolarHBondContact O-OG 2.74Å; T274-S291 WeakPolarHBondContact O-CA 3.47Å; T274-S291 PolarHBondContact O-OG 3.34Å; T274-S291 VanDerWaalsContact O-OG 3.09Å; T276-S291 PolarHBondContact OG1-N 2.85Å; S291-D293 VanDerWaalsContact CB-OD1 3.29Å; S291-D293 WeakPolarHBondContact CB-OD1 3.36Å; S291-D293 PolarHBondContact O-N 3.13Å; S291-D293 PolarHBondContact OG-N 3.44Å; S291-D293 PolarHBondContact OG-OD1 3.29Å; S291-H294 PolarHBondContact O-N 2.9Å; S291-L295 PolarHBondContact N-O 2.99Å; S291-V318 PolarHBondContact O-N 3.37Å
292	R	94.7	Very high	94.4	Very high	88 Å²	88	36.9 Å²	36.9	33%	0.332	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.4	15.9	170.3	-57.4	-170.1	-173.8	-176.5	-2.7	113.8	N273 T274 T276 H294 D317	N273-R292 HydrophobicContact CB-CB 4.09Å; N273-R292 PolarHBondContact ND2-O 3.46Å; T274-R292 PolarHBondContact O-N 3.15Å; T274-R292 WeakPolarHBondContact OG1-CD 3.4Å; T274-R292 VanDerWaalsContact OG1-CG 3.25Å; T274-R292 WeakPolarHBondContact OG1-CG 3.46Å; T274-R292 PolarHBondContact OG1-NE 3.26Å; T276-R292 HydrophobicContact CG2-CG 3.68Å; R292-H294 VanDerWaalsContact C-N 3.27Å; R292-D317 HydrophobicContact CB-CB 4.21Å; R292-D317 VanDerWaalsContact CD-OD2 3.23Å; R292-D317 WeakPolarHBondContact CD-OD2 3.49Å; R292-D317 HydrophobicContact CG-CB 3.96Å; R292-D317 WeakPolarHBondContact CG-OD2 3.44Å; R292-D317 IonicContact NE-OD2 4Å
293	D	93.8	Very high	94.4	Very high	32 Å²	32	35.1 Å²	35.1	17%	0.171	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.3	11	163.9	58.5	15.8	0	0	0	112.2	H271 K272 N273 S291 L295	H271-D293 WeakPolarHBondContact CA-OD2 3.47Å; H271-D293 WeakPolarHBondContact CB-OD2 3.42Å; H271-D293 IonicContact CE1-OD1 2.66Å; H271-D293 IonicContact CG-OD2 2.68Å; H271-D293 IonicContact ND1-OD1 3.66Å; H271-D293 PolarHBondContact ND1-OD1 2.91Å; H271-D293 VanDerWaalsContact ND1-OD1 3.14Å; H271-D293 IonicContact ND1-OD2 3.52Å; H271-D293 PolarHBondContact ND1-OD2 3.45Å; K272-D293 PolarHBondContact N-OD2 3.43Å; N273-D293 HydrophobicContact CB-CB 4.13Å; S291-D293 VanDerWaalsContact CB-OD1 3.29Å; S291-D293 WeakPolarHBondContact CB-OD1 3.36Å; S291-D293 PolarHBondContact O-N 3.13Å; S291-D293 PolarHBondContact OG-N 3.44Å; S291-D293 PolarHBondContact OG-OD1 3.29Å; D293-L295 PolarHBondContact O-N 2.7Å; D293-L295 WeakPolarHBondContact OD1-CB 3.49Å; D293-L295 PolarHBondContact OD1-N 2.71Å
294	H	94.5	Very high	94.2	Very high	71 Å²	71	35.3 Å²	35.3	33%	0.329	16%	0.16	S	C	.	.	S	Bend	trans	65.4	11.3	-176.9	-46.7	-179.4	0	0	0	113.8	S291 R292 H314 K315 D317	S291-H294 PolarHBondContact O-N 2.9Å; R292-H294 VanDerWaalsContact C-N 3.27Å; H294-H314 HydrophobicContact CB-CB 4.46Å; H294-K315 PolarHBondContact CE1-O 2.88Å; H294-K315 VanDerWaalsContact CE1-O 3.23Å; H294-K315 PolarHBondContact ND1-O 2.93Å; H294-D317 PolarHBondContact CD2-N 3.15Å; H294-D317 IonicContact CD2-OD1 3.35Å; H294-D317 IonicContact NE2-OD1 2.68Å
295	L	95.2	Very high	94.1	Very high	39 Å²	39	45.1 Å²	45.1	20%	0.204	20%	0.203	C	C	.	.			trans	-104.4	150.2	-179.7	-54.7	177.9	0	0	0	111.7	S291 D293 R312	S291-L295 PolarHBondContact N-O 2.99Å; D293-L295 PolarHBondContact O-N 2.7Å; D293-L295 WeakPolarHBondContact OD1-CB 3.49Å; D293-L295 PolarHBondContact OD1-N 2.71Å; L295-R312 HydrophobicContact CD2-CG 3.73Å
296	I	95.8	Very high	93.8	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	134.4	162.1	-56	164.2	0	0	0	106.8	L288 T289 F311 V318 V321 F331	L288-I296 HydrophobicContact CD2-CG2 3.78Å; T289-I296 CarbonylContact O-C 3.6Å; T289-I296 VanDerWaalsContact O-CA 3.3Å; T289-I296 WeakPolarHBondContact O-CA 3.48Å; T289-I296 WeakPolarHBondContact O-CG2 3.24Å; I296-F311 HydrophobicContact CB-CB 4.25Å; I296-F311 HydrophobicContact CB-CD2 4.14Å; I296-F311 HydrophobicContact CG2-CD2 4.07Å; I296-F311 PolarHBondContact N-O 3.18Å; I296-F311 PolarHBondContact O-N 3.07Å; I296-V318 HydrophobicContact CD1-CG1 3.95Å; I296-V318 HydrophobicContact CD1-CG2 4.34Å; I296-V318 HydrophobicContact CG1-CB 4.32Å; I296-V318 HydrophobicContact CG1-CG1 3.91Å; I296-V318 HydrophobicContact CG1-CG2 3.98Å; I296-V321 HydrophobicContact CD1-CG2 4.24Å; I296-V321 HydrophobicContact CG1-CG2 4.45Å; I296-V321 HydrophobicContact CG2-CG2 4.42Å; I296-F331 HydrophobicContact CD1-CE2 4.17Å; I296-F331 HydrophobicContact CG2-CE2 4.06Å; I296-F331 HydrophobicContact CG2-CZ 4.34Å
297	K	95.1	Very high	93.6	Very high	22 Å²	22	46.4 Å²	46.4	10%	0.096	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	135.5	-178.6	-60.4	-174.5	160.2	-164.7	0	111.3	V270 T289 F299 E307 T310	V270-K297 HydrophobicContact CG1-CB 4.24Å; V270-K297 HydrophobicContact CG1-CD 3.45Å; V270-K297 VanDerWaalsContact CG1-CD 3.45Å; V270-K297 HydrophobicContact CG1-CG 4.39Å; V270-K297 PolarHBondContact O-NZ 2.85Å; T289-K297 PolarHBondContact N-O 3.18Å; T289-K297 PolarHBondContact O-N 3.37Å; T289-K297 WeakPolarHBondContact OG1-CB 3.37Å; T289-K297 PolarHBondContact OG1-O 2.89Å; K297-F299 HydrophobicContact CB-CD2 4.48Å; K297-F299 HydrophobicContact CB-CE2 3.63Å; K297-F299 HydrophobicContact CB-CZ 4.21Å; K297-E307 WeakPolarHBondContact CD-OE2 3.43Å; K297-E307 WeakPolarHBondContact CE-OE2 3.39Å; K297-E307 IonicContact NZ-OE1 3.86Å; K297-E307 IonicContact NZ-OE2 2.66Å; K297-E307 PolarHBondContact NZ-OE2 3.49Å; K297-T310 HydrophobicContact CD-CG2 4.13Å; K297-T310 HydrophobicContact CG-CG2 3.86Å
298	L	95.8	Very high	93.4	Very high	2 Å²	2	50.9 Å²	50.9	1%	0.01	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	134.5	179.7	-178.9	63.6	0	0	0	109.9	W286 L288 L308 Q309 F311 W323 A345	W286-L298 HydrophobicContact CB-CD1 3.89Å; W286-L298 HydrophobicContact CD2-CD1 4.39Å; W286-L298 HydrophobicContact CG-CD1 4.14Å; L288-L298 HydrophobicContact CD2-CB 3.93Å; L288-L298 HydrophobicContact CD2-CD1 3.81Å; L288-L298 HydrophobicContact CD2-CG 4.46Å; L288-L298 HydrophobicContact CG-CD1 4.1Å; L298-L308 HydrophobicContact CD2-CD2 3.88Å; L298-L308 HydrophobicContact CD2-CG 4.4Å; L298-L308 HydrophobicContact CG-CB 4.35Å; L298-L308 HydrophobicContact CG-CD2 4.13Å; L298-L308 WeakPolarHBondContact O-CB 3.44Å; L298-L308 PolarHBondContact O-N 3.14Å; L298-Q309 HydrophobicContact CB-CB 4.26Å; L298-Q309 HydrophobicContact CD2-CB 4.36Å; L298-Q309 PolarHBondContact N-O 2.92Å; L298-F311 HydrophobicContact CB-CE2 4.01Å; L298-F311 HydrophobicContact CD2-CZ 4.49Å; L298-W323 HydrophobicContact CD1-CH2 3.9Å; L298-W323 HydrophobicContact CD1-CZ2 4.17Å; L298-A345 HydrophobicContact CD2-CB 3.87Å
299	F	94.9	Very high	93.3	Very high	8 Å²	8	51.8 Å²	51.8	4%	0.035	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	145.9	179.2	-70.4	-84.7	0	0	0	111.4	V270 W286 F287 T289 K297 E307	V270-F299 HydrophobicContact CB-CE2 4.36Å; V270-F299 HydrophobicContact CB-CZ 4.11Å; V270-F299 HydrophobicContact CG1-CE2 3.55Å; V270-F299 HydrophobicContact CG1-CZ 3.53Å; V270-F299 HydrophobicContact CG2-CE1 4.09Å; V270-F299 HydrophobicContact CG2-CE2 3.84Å; V270-F299 HydrophobicContact CG2-CZ 3.43Å; V270-F299 VanDerWaalsContact CG2-CZ 3.43Å; W286-F299 VanDerWaalsContact CA-O 3.32Å; W286-F299 WeakPolarHBondContact CA-O 3.44Å; F287-F299 HydrophobicContact CD1-CB 4.02Å; F287-F299 HydrophobicContact CD2-CB 4.17Å; F287-F299 HydrophobicContact CD2-CD2 4.36Å; F287-F299 HydrophobicContact CE1-CB 3.47Å; F287-F299 VanDerWaalsContact CE1-CB 3.47Å; F287-F299 HydrophobicContact CE1-CG 4.42Å; F287-F299 HydrophobicContact CE2-CB 3.64Å; F287-F299 AromaticContact CE2-CD2 3.73Å; F287-F299 HydrophobicContact CE2-CD2 3.73Å; F287-F299 AromaticContact CE2-CG 3.86Å; F287-F299 HydrophobicContact CE2-CG 3.86Å; F287-F299 HydrophobicContact CG-CB 4.35Å; F287-F299 HydrophobicContact CZ-CB 3.25Å; F287-F299 HydrophobicContact CZ-CD2 4.11Å; F287-F299 AromaticContact CZ-CG 3.73Å; F287-F299 HydrophobicContact CZ-CG 3.73Å; F287-F299 PolarHBondContact N-O 2.99Å; F287-F299 VanDerWaalsContact N-O 3.15Å; F287-F299 PolarHBondContact O-N 2.9Å; F287-F299 VanDerWaalsContact O-N 3.08Å; T289-F299 HydrophobicContact CG2-CD2 4.27Å; T289-F299 HydrophobicContact CG2-CE2 4.43Å; K297-F299 HydrophobicContact CB-CD2 4.48Å; K297-F299 HydrophobicContact CB-CE2 3.63Å; K297-F299 HydrophobicContact CB-CZ 4.21Å; F299-E307 HydrophobicContact CD1-CB 4.4Å; F299-E307 HydrophobicContact CE1-CB 3.64Å; F299-E307 HydrophobicContact CZ-CB 3.79Å
300	D	94.5	Very high	93.3	Very high	23 Å²	23	52.9 Å²	52.9	12%	0.123	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	124.1	164.7	-169.6	-36.2	0	0	0	108.9	N285 R302 N303	N285-D300 WeakPolarHBondContact O-CA 3.3Å; D300-R302 PolarHBondContact O-N 2.98Å; D300-R302 VanDerWaalsContact O-N 3.15Å; D300-R302 WeakPolarHBondContact OD1-CB 3.26Å; D300-R302 WeakPolarHBondContact OD1-CG 3.39Å; D300-R302 IonicContact OD1-CZ 3.27Å; D300-R302 PolarHBondContact OD1-N 3.17Å; D300-R302 IonicContact OD1-NE 2.66Å; D300-R302 PolarHBondContact OD1-NE 3.11Å; D300-R302 IonicContact OD1-NH2 3.15Å; D300-R302 IonicContact OD2-CZ 2.67Å; D300-R302 IonicContact OD2-NE 3.68Å; D300-R302 PolarHBondContact OD2-NE 3.43Å; D300-R302 IonicContact OD2-NH2 3.34Å; D300-R302 PolarHBondContact OD2-NH2 3.02Å; D300-N303 CarbonylContact O-C 3.46Å; D300-N303 VanDerWaalsContact O-C 3.24Å; D300-N303 PolarHBondContact O-N 3.38Å
301	L	92.5	Very high	93.2	Very high	29 Å²	29	52.8 Å²	52.8	15%	0.152	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-28.9	177.9	178.9	56.4	0	0	0	112.6	H237 L240 L242 L256 W280 N285 N303 L304	H237-L301 WeakPolarHBondContact NE2-CD2 3.38Å; L240-L301 HydrophobicContact CD1-CD2 3.92Å; L242-L301 HydrophobicContact CD1-CD2 4.32Å; L256-L301 HydrophobicContact CD1-CD1 3.82Å; W280-L301 HydrophobicContact CH2-CB 4.46Å; W280-L301 HydrophobicContact CH2-CD1 3.99Å; W280-L301 HydrophobicContact CH2-CD2 3.86Å; W280-L301 HydrophobicContact CH2-CG 4.32Å; W280-L301 HydrophobicContact CZ3-CB 4.25Å; W280-L301 HydrophobicContact CZ3-CD2 3.97Å; N285-L301 PolarHBondContact O-N 2.91Å; L301-N303 VanDerWaalsContact C-N 3.34Å; L301-L304 HydrophobicContact CD1-CD2 4.46Å
302	R	91	Very high	93.1	Very high	184 Å²	184	59.7 Å²	59.7	69%	0.694	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.9	-23.6	-179.3	-54.6	171	-64.2	174.8	3.6	112.3	D300	D300-R302 PolarHBondContact O-N 2.98Å; D300-R302 VanDerWaalsContact O-N 3.15Å; D300-R302 WeakPolarHBondContact OD1-CB 3.26Å; D300-R302 WeakPolarHBondContact OD1-CG 3.39Å; D300-R302 IonicContact OD1-CZ 3.27Å; D300-R302 PolarHBondContact OD1-N 3.17Å; D300-R302 IonicContact OD1-NE 2.66Å; D300-R302 PolarHBondContact OD1-NE 3.11Å; D300-R302 IonicContact OD1-NH2 3.15Å; D300-R302 IonicContact OD2-CZ 2.67Å; D300-R302 IonicContact OD2-NE 3.68Å; D300-R302 PolarHBondContact OD2-NE 3.43Å; D300-R302 IonicContact OD2-NH2 3.34Å; D300-R302 PolarHBondContact OD2-NH2 3.02Å
303	N	91.6	Very high	92.9	Very high	73 Å²	73	57 Å²	57	39%	0.39	28%	0.275	S	S	.	.			trans	-138.3	80.1	178.8	-178.9	16.8	0	0	0	111.8	D300 L301 K305 S306	D300-N303 CarbonylContact O-C 3.46Å; D300-N303 VanDerWaalsContact O-C 3.24Å; D300-N303 PolarHBondContact O-N 3.38Å; L301-N303 VanDerWaalsContact C-N 3.34Å; N303-K305 PolarHBondContact O-N 2.73Å; N303-K305 PolarHBondContact OD1-N 3.44Å; N303-S306 PolarHBondContact ND2-OG 2.84Å
304	L	90.4	Very high	92.8	Very high	51 Å²	51	56 Å²	56	27%	0.267	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-3.7	178.6	-60.4	172.4	0	0	0	114.5	L256 L268 F287 L301	L256-L304 HydrophobicContact CD1-CD1 3.76Å; L256-L304 HydrophobicContact CD1-CD2 4.44Å; L268-L304 HydrophobicContact CD1-CD2 4.1Å; L268-L304 HydrophobicContact CD2-CB 3.93Å; L268-L304 HydrophobicContact CD2-CD1 4.25Å; L268-L304 HydrophobicContact CD2-CD2 4.35Å; L268-L304 HydrophobicContact CD2-CG 4.41Å; F287-L304 HydrophobicContact CE1-CD2 3.72Å; F287-L304 HydrophobicContact CZ-CD2 3.78Å; L301-L304 HydrophobicContact CD1-CD2 4.46Å
305	K	88	Confident	92.7	Very high	206 Å²	206	58.3 Å²	58.3	90%	0.896	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.7	-26.2	-177.7	-68.5	-177.6	179.5	175.6	0	113.2	N303	N303-K305 PolarHBondContact O-N 2.73Å; N303-K305 PolarHBondContact OD1-N 3.44Å
306	S	88.9	Confident	92.7	Very high	57 Å²	57	63.4 Å²	63.4	40%	0.399	30%	0.295	S	S	.	.	S	Bend	trans	-123.1	134.1	179.8	52	0	0	0	0	109.8	N303	N303-S306 PolarHBondContact ND2-OG 2.84Å
307	E	91.6	Very high	92.6	Very high	87 Å²	87	65.4 Å²	65.4	41%	0.407	31%	0.306	S	S	.	.			trans	-66.2	137.1	163.2	56.2	-166.3	-161.2	0	0	109.8	K297 F299 T310	K297-E307 WeakPolarHBondContact CD-OE2 3.43Å; K297-E307 WeakPolarHBondContact CE-OE2 3.39Å; K297-E307 IonicContact NZ-OE1 3.86Å; K297-E307 IonicContact NZ-OE2 2.66Å; K297-E307 PolarHBondContact NZ-OE2 3.49Å; F299-E307 HydrophobicContact CD1-CB 4.4Å; F299-E307 HydrophobicContact CE1-CB 3.64Å; F299-E307 HydrophobicContact CZ-CB 3.79Å; E307-T310 HydrophobicContact CB-CG2 4.38Å; E307-T310 HydrophobicContact CG-CG2 3.93Å; E307-T310 WeakPolarHBondContact OE1-CG2 3.41Å
308	L	92	Very high	92.7	Very high	95 Å²	95	64.3 Å²	64.3	50%	0.497	30%	0.301	S	S	.	.	S	Bend	trans	-80.3	-44.9	-177.8	-177.6	62.9	0	0	0	110.6	W286 L298	W286-L308 HydrophobicContact CZ2-CD2 4.46Å; L298-L308 HydrophobicContact CD2-CD2 3.88Å; L298-L308 HydrophobicContact CD2-CG 4.4Å; L298-L308 HydrophobicContact CG-CB 4.35Å; L298-L308 HydrophobicContact CG-CD2 4.13Å; L298-L308 WeakPolarHBondContact O-CB 3.44Å; L298-L308 PolarHBondContact O-N 3.14Å
309	Q	93.1	Very high	92.7	Very high	19 Å²	19	65 Å²	65	9%	0.089	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	151.5	177.8	-154.4	179.6	4.3	0	0	111.1	L298 F311 T347 D348	L298-Q309 HydrophobicContact CB-CB 4.26Å; L298-Q309 HydrophobicContact CD2-CB 4.36Å; L298-Q309 PolarHBondContact N-O 2.92Å; Q309-F311 HydrophobicContact CB-CE2 4.43Å; Q309-F311 HydrophobicContact CB-CZ 4.19Å; Q309-F311 VanDerWaalsContact CD-CE1 3.48Å; Q309-F311 HydrophobicContact CG-CE1 4.21Å; Q309-F311 HydrophobicContact CG-CZ 4.21Å; Q309-F311 VanDerWaalsContact OE1-CE1 3.26Å; Q309-T347 PolarHBondContact NE2-O 3.2Å; Q309-D348 PolarHBondContact NE2-OD1 2.85Å
310	T	94.6	Very high	92.7	Very high	23 Å²	23	69 Å²	69	14%	0.141	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	107.1	179.4	56.2	0	0	0	0	110.8	K297 E307 R312	K297-T310 HydrophobicContact CD-CG2 4.13Å; K297-T310 HydrophobicContact CG-CG2 3.86Å; E307-T310 HydrophobicContact CB-CG2 4.38Å; E307-T310 HydrophobicContact CG-CG2 3.93Å; E307-T310 WeakPolarHBondContact OE1-CG2 3.41Å; T310-R312 PolarHBondContact O-NH1 2.94Å; T310-R312 PolarHBondContact OG1-NH1 2.93Å; T310-R312 PolarHBondContact OG1-NH2 2.9Å; T310-R312 VanDerWaalsContact OG1-NH2 3.13Å
311	F	94.9	Very high	92.8	Very high	0 Å²	0	68.2 Å²	68.2	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	130.7	-176.2	-53.1	-80.9	0	0	0	110.6	L288 I296 L298 Q309 F331 W343	L288-F311 HydrophobicContact CD2-CE2 3.99Å; I296-F311 HydrophobicContact CB-CB 4.25Å; I296-F311 HydrophobicContact CB-CD2 4.14Å; I296-F311 HydrophobicContact CG2-CD2 4.07Å; I296-F311 PolarHBondContact N-O 3.18Å; I296-F311 PolarHBondContact O-N 3.07Å; L298-F311 HydrophobicContact CB-CE2 4.01Å; L298-F311 HydrophobicContact CD2-CZ 4.49Å; Q309-F311 HydrophobicContact CB-CE2 4.43Å; Q309-F311 HydrophobicContact CB-CZ 4.19Å; Q309-F311 VanDerWaalsContact CD-CE1 3.48Å; Q309-F311 HydrophobicContact CG-CE1 4.21Å; Q309-F311 HydrophobicContact CG-CZ 4.21Å; Q309-F311 VanDerWaalsContact OE1-CE1 3.26Å; F311-F331 HydrophobicContact CD1-CZ 4.33Å; F311-F331 HydrophobicContact CD2-CE1 4.38Å; F311-F331 AromaticContact CD2-CZ 3.61Å; F311-F331 HydrophobicContact CD2-CZ 3.61Å; F311-F331 HydrophobicContact CE1-CE1 4.26Å; F311-F331 HydrophobicContact CE1-CZ 4.16Å; F311-F331 AromaticContact CE2-CE1 3.73Å; F311-F331 HydrophobicContact CE2-CE1 3.73Å; F311-F331 AromaticContact CE2-CZ 3.4Å; F311-F331 HydrophobicContact CE2-CZ 3.4Å; F311-F331 VanDerWaalsContact CE2-CZ 3.4Å; F311-F331 HydrophobicContact CG-CZ 4.07Å; F311-F331 AromaticContact CZ-CE1 3.66Å; F311-F331 HydrophobicContact CZ-CE1 3.66Å; F311-F331 AromaticContact CZ-CZ 3.7Å; F311-F331 HydrophobicContact CZ-CZ 3.7Å; F311-W343 HydrophobicContact CB-CD2 4.03Å; F311-W343 HydrophobicContact CB-CE3 3.78Å; F311-W343 HydrophobicContact CB-CH2 4.18Å; F311-W343 HydrophobicContact CB-CZ2 4.39Å; F311-W343 HydrophobicContact CB-CZ3 3.85Å; F311-W343 HydrophobicContact CD1-CB 4.38Å; F311-W343 HydrophobicContact CD1-CD2 4.02Å; F311-W343 AromaticContact CD1-CE3 3.48Å; F311-W343 HydrophobicContact CD1-CE3 3.48Å; F311-W343 VanDerWaalsContact CD1-CE3 3.48Å; F311-W343 HydrophobicContact CD1-CG 4.42Å; F311-W343 HydrophobicContact CD1-CZ3 4.14Å; F311-W343 HydrophobicContact CE1-CB 4.42Å; F311-W343 HydrophobicContact CE1-CE3 4.42Å; F311-W343 HydrophobicContact CG-CD2 4.19Å; F311-W343 AromaticContact CG-CE3 3.95Å; F311-W343 HydrophobicContact CG-CE3 3.95Å; F311-W343 HydrophobicContact CG-CZ3 4.45Å
312	R	93.3	Very high	93	Very high	144 Å²	144	67.4 Å²	67.4	54%	0.543	31%	0.313	S	S	.	.			trans	-129.4	132.4	-179.3	-67.5	176.6	-172.9	71.5	5.8	108.7	L295 T310 W343	L295-R312 HydrophobicContact CD2-CG 3.73Å; T310-R312 PolarHBondContact O-NH1 2.94Å; T310-R312 PolarHBondContact OG1-NH1 2.93Å; T310-R312 PolarHBondContact OG1-NH2 2.9Å; T310-R312 VanDerWaalsContact OG1-NH2 3.13Å; R312-W343 WeakPolarHBondContact O-CH2 3.17Å
313	G	88.5	Confident	93.2	Very high	33 Å²	33	59.7 Å²	59.7	34%	0.34	28%	0.283	S	S	.	.			trans	167.8	-29	178.4	0	0	0	0	0	112.7	K315	G313-K315 PolarHBondContact O-N 3.25Å
314	H	92.9	Very high	93.4	Very high	11 Å²	11	56.4 Å²	56.4	5%	0.051	27%	0.266	C	S	.	.			trans	-60.2	129.2	174.7	-73.4	-82.2	0	0	0	112.8	H294 V318 S333 S335 F341 W343	H294-H314 HydrophobicContact CB-CB 4.46Å; H314-V318 HydrophobicContact CB-CG2 3.96Å; H314-V318 VanDerWaalsContact CD2-CG2 3.49Å; H314-V318 WeakPolarHBondContact CD2-CG2 3.43Å; H314-S333 PolarHBondContact CE1-OG 3.49Å; H314-S333 PolarHBondContact NE2-OG 3.36Å; H314-S335 WeakPolarHBondContact ND1-CB 3.34Å; H314-F341 AromaticContact CE1-CD2 3.34Å; H314-F341 WeakPolarHBondContact CE1-CD2 3.38Å; H314-F341 AromaticContact CE1-CG 3.88Å; H314-F341 AromaticContact ND1-CD2 3.5Å; H314-F341 WeakPolarHBondContact ND1-CD2 3.35Å; H314-F341 AromaticContact ND1-CE2 3.76Å; H314-F341 AromaticContact NE2-CD2 3.98Å; H314-W343 AromaticContact CD2-CZ2 3.98Å; H314-W343 AromaticContact NE2-NE1 3.76Å
315	K	92.7	Very high	93.5	Very high	119 Å²	119	56 Å²	56	52%	0.517	27%	0.266	S	S	.	.	S	Bend	trans	-81.8	-21.4	178.7	-61.8	161.3	-173.1	153	0	112.4	H294 G313 D355	H294-K315 PolarHBondContact CE1-O 2.88Å; H294-K315 VanDerWaalsContact CE1-O 3.23Å; H294-K315 PolarHBondContact ND1-O 2.93Å; G313-K315 PolarHBondContact O-N 3.25Å; K315-D355 IonicContact NZ-OD1 3.63Å; K315-D355 PolarHBondContact NZ-OD1 3.14Å; K315-D355 IonicContact NZ-OD2 3.81Å; K315-D355 PolarHBondContact NZ-OD2 2.87Å
316	R	94.2	Very high	93.6	Very high	145 Å²	145	48.9 Å²	48.9	55%	0.547	24%	0.235	S	C	.	.	S	Bend	trans	-138.2	173.1	177	-61.7	-162.2	-171.1	168.6	1.5	111.9	V318 S335 A336 D337	R316-V318 PolarHBondContact O-N 3.17Å; R316-S335 PolarHBondContact O-OG 2.89Å; R316-S335 VanDerWaalsContact O-OG 3.07Å; R316-A336 HydrophobicContact CB-CB 4.27Å; R316-D337 HydrophobicContact CB-CB 4.32Å; R316-D337 HydrophobicContact CG-CB 3.96Å
317	D	94.9	Very high	93.8	Very high	42 Å²	42	46.5 Å²	46.5	23%	0.225	22%	0.218	C	C	.	.			trans	-33.4	129.3	173	-64.3	-1.9	0	0	0	113.9	R292 H294 M319 S335 A336	R292-D317 HydrophobicContact CB-CB 4.21Å; R292-D317 VanDerWaalsContact CD-OD2 3.23Å; R292-D317 WeakPolarHBondContact CD-OD2 3.49Å; R292-D317 HydrophobicContact CG-CB 3.96Å; R292-D317 WeakPolarHBondContact CG-OD2 3.44Å; R292-D317 IonicContact NE-OD2 4Å; H294-D317 PolarHBondContact CD2-N 3.15Å; H294-D317 IonicContact CD2-OD1 3.35Å; H294-D317 IonicContact NE2-OD1 2.68Å; D317-M319 HydrophobicContact CB-SD 4.15Å; D317-S335 CarbonylContact O-C 3.57Å; D317-S335 WeakPolarHBondContact O-CA 3.48Å; D317-S335 PolarHBondContact O-OG 3.09Å; D317-A336 HydrophobicContact CB-CB 3.81Å; D317-A336 WeakPolarHBondContact O-CB 3.3Å; D317-A336 PolarHBondContact O-N 2.81Å
318	V	96.1	Very high	93.8	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	127	170.9	-171.6	0	0	0	0	108.3	T276 A290 S291 I296 H314 R316 V321	T276-V318 WeakPolarHBondContact CB-O 3.5Å; T276-V318 WeakPolarHBondContact CG2-O 3.38Å; T276-V318 PolarHBondContact OG1-O 3.17Å; A290-V318 HydrophobicContact CB-CB 4.2Å; A290-V318 HydrophobicContact CB-CG1 3.87Å; S291-V318 PolarHBondContact O-N 3.37Å; I296-V318 HydrophobicContact CD1-CG1 3.95Å; I296-V318 HydrophobicContact CD1-CG2 4.34Å; I296-V318 HydrophobicContact CG1-CB 4.32Å; I296-V318 HydrophobicContact CG1-CG1 3.91Å; I296-V318 HydrophobicContact CG1-CG2 3.98Å; H314-V318 HydrophobicContact CB-CG2 3.96Å; H314-V318 VanDerWaalsContact CD2-CG2 3.49Å; H314-V318 WeakPolarHBondContact CD2-CG2 3.43Å; R316-V318 PolarHBondContact O-N 3.17Å; V318-V321 HydrophobicContact CG1-CG2 4.31Å
319	M	95.5	Very high	93.9	Very high	17 Å²	17	44.2 Å²	44.2	8%	0.084	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	-34.6	-169.7	-66.1	-58.3	-64.9	0	0	113.5	T276 D317 G334 A336 I362 W363	T276-M319 HydrophobicContact CG2-SD 4.28Å; D317-M319 HydrophobicContact CB-SD 4.15Å; M319-G334 PolarHBondContact N-O 2.66Å; M319-A336 HydrophobicContact CG-CB 3.86Å; M319-A336 HydrophobicContact SD-CB 4.19Å; M319-I362 WeakPolarHBondContact CB-O 3.42Å; M319-W363 HydrophobicContact CE-CE3 3.75Å; M319-W363 HydrophobicContact CE-CH2 3.76Å; M319-W363 HydrophobicContact CE-CZ3 3.22Å
320	R	96	Very high	93.9	Very high	92 Å²	92	43.3 Å²	43.3	35%	0.347	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	146.5	-179.1	-164.8	81.4	179.3	137.8	-10.9	111.1	D277 S333 G334 W363 L365	D277-R320 IonicContact OD1-CZ 3.77Å; D277-R320 IonicContact OD1-NH1 2.79Å; D277-R320 PolarHBondContact OD1-NH1 3.36Å; D277-R320 WeakPolarHBondContact OD2-CA 3.42Å; D277-R320 WeakPolarHBondContact OD2-CD 3.45Å; D277-R320 IonicContact OD2-CZ 3.92Å; D277-R320 IonicContact OD2-NE 2.75Å; D277-R320 IonicContact OD2-NH1 3.66Å; D277-R320 PolarHBondContact OD2-NH1 2.7Å; R320-S333 WeakPolarHBondContact O-CA 3.46Å; R320-G334 PolarHBondContact N-O 3.05Å; R320-G334 PolarHBondContact O-N 3.42Å; R320-W363 WeakPolarHBondContact CD-O 3.32Å; R320-L365 HydrophobicContact CG-CB 4.45Å
321	V	96.1	Very high	94	Very high	5 Å²	5	42.2 Å²	42.2	3%	0.03	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	140.1	171.2	171.1	0	0	0	0	110.7	D277 L288 A290 I296 V318 F331 V332	D277-V321 PolarHBondContact OD2-N 2.84Å; L288-V321 HydrophobicContact CB-CG1 4.12Å; L288-V321 HydrophobicContact CD1-CG1 3.68Å; A290-V321 HydrophobicContact CB-CG2 3.75Å; I296-V321 HydrophobicContact CD1-CG2 4.24Å; I296-V321 HydrophobicContact CG1-CG2 4.45Å; I296-V321 HydrophobicContact CG2-CG2 4.42Å; V318-V321 HydrophobicContact CG1-CG2 4.31Å; V321-F331 HydrophobicContact CG1-CD2 3.91Å; V321-V332 CarbonylContact C-O 3.55Å; V321-V332 WeakPolarHBondContact CA-O 3.49Å
322	A	96.3	Very high	94	Very high	12 Å²	12	42.2 Å²	42.2	10%	0.099	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	111.3	178.2	0	0	0	0	0	111.7	F331 V332 L365 W367	A322-F331 WeakPolarHBondContact O-CA 3.33Å; A322-V332 PolarHBondContact N-O 3.1Å; A322-V332 PolarHBondContact O-N 3.19Å; A322-L365 HydrophobicContact CB-CB 3.88Å; A322-W367 PolarHBondContact O-NE1 2.79Å; A322-W367 VanDerWaalsContact O-NE1 3.14Å
323	W	96.4	Very high	94.2	Very high	22 Å²	22	35.3 Å²	35.3	8%	0.083	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.1	142.5	168.7	-70.4	109.2	0	0	0	111.4	S279 W280 N281 W286 L288 L298 E328 F331 W367	S279-W323 PolarHBondContact O-NE1 3.25Å; W280-W323 VanDerWaalsContact C-NE1 3.31Å; W280-W323 PolarHBondContact O-NE1 3.06Å; N281-W323 HydrophobicContact CB-CD2 4.23Å; N281-W323 HydrophobicContact CB-CH2 4.16Å; N281-W323 HydrophobicContact CB-CZ2 3.69Å; W286-W323 HydrophobicContact CB-CH2 4.44Å; W286-W323 HydrophobicContact CB-CZ2 4.37Å; W286-W323 HydrophobicContact CE3-CH2 4.17Å; L288-W323 HydrophobicContact CB-CZ2 4.22Å; L288-W323 HydrophobicContact CD1-CD2 3.87Å; L288-W323 VanDerWaalsContact CD1-CE2 3.41Å; L288-W323 HydrophobicContact CD1-CE3 4.13Å; L288-W323 HydrophobicContact CD1-CH2 3.63Å; L288-W323 HydrophobicContact CD1-CZ2 3.33Å; L288-W323 HydrophobicContact CD1-CZ3 4Å; L288-W323 HydrophobicContact CD2-CZ2 4.47Å; L288-W323 HydrophobicContact CG-CH2 3.85Å; L288-W323 HydrophobicContact CG-CZ2 3.36Å; L298-W323 HydrophobicContact CD1-CH2 3.9Å; L298-W323 HydrophobicContact CD1-CZ2 4.17Å; W323-E328 WeakPolarHBondContact CZ3-O 3.44Å; W323-F331 HydrophobicContact CD2-CB 4.24Å; W323-F331 HydrophobicContact CE3-CB 3.85Å; W323-F331 HydrophobicContact CE3-CD1 4.31Å; W323-F331 HydrophobicContact CE3-CG 4.47Å; W323-F331 HydrophobicContact CZ3-CB 4.39Å; W323-F331 AromaticContact CZ3-CD1 3.99Å; W323-F331 HydrophobicContact CZ3-CD1 3.99Å; W323-W367 PolarHBondContact O-NE1 2.88Å
324	H	95.4	Very high	94.5	Very high	4 Å²	4	33.8 Å²	33.8	2%	0.019	16%	0.155	C	C	.	.			trans	-81.5	136	175.7	172.6	-85.1	0	0	0	110.9	F326 H327 L330 W367 G371	H324-F326 VanDerWaalsContact C-N 3.26Å; H324-F326 PolarHBondContact ND1-N 3.39Å; H324-F326 PolarHBondContact O-N 2.77Å; H324-H327 AromaticContact CE1-CD2 3.13Å; H324-H327 PolarHBondContact CE1-CD2 2.89Å; H324-H327 AromaticContact CE1-CG 3.81Å; H324-H327 AromaticContact CE1-NE2 3.7Å; H324-H327 AromaticContact ND1-CD2 3.35Å; H324-H327 PolarHBondContact ND1-CD2 2.84Å; H324-H327 VanDerWaalsContact ND1-CD2 3.35Å; H324-H327 AromaticContact ND1-CG 3.71Å; H324-H327 PolarHBondContact ND1-N 3.21Å; H324-H327 AromaticContact NE2-CD2 3.82Å; H324-L330 HydrophobicContact CB-CB 4.09Å; H324-L330 HydrophobicContact CB-CD2 3.97Å; H324-L330 HydrophobicContact CB-CG 4.13Å; H324-L330 WeakPolarHBondContact CB-O 3.45Å; H324-L330 PolarHBondContact N-O 2.61Å; H324-W367 HydrophobicContact CB-CZ2 3.87Å; H324-W367 AromaticContact CD2-CE2 3.96Å; H324-W367 AromaticContact CD2-CE3 3.99Å; H324-W367 AromaticContact CD2-CH2 3.79Å; H324-W367 AromaticContact CD2-CZ2 3.79Å; H324-W367 AromaticContact CD2-CZ3 3.91Å; H324-G371 WeakPolarHBondContact NE2-CA 3.38Å; H324-G371 PolarHBondContact NE2-O 3.43Å
325	P	92.8	Very high	94.7	Very high	42 Å²	42	33.2 Å²	33.2	27%	0.273	15%	0.152	S	C	.	.	S	Bend	trans	-72.2	-0.9	-166	28.2	-38.1	0	0	0	117.1	W367	P325-W367 HydrophobicContact CG-CB 4.38Å
326	F	90.6	Very high	94.8	Very high	58 Å²	58	27.8 Å²	27.8	25%	0.254	13%	0.13	S	C	.	.	S	Bend	trans	-130	-54.1	176.4	-54.2	-57.9	0	0	0	112.8	P79 R80 M83 H324 E328 P369	P79-F326 HydrophobicContact CB-CD2 4.08Å; R80-F326 HydrophobicContact CB-CD2 4.38Å; M83-F326 HydrophobicContact SD-CB 4.29Å; H324-F326 VanDerWaalsContact C-N 3.26Å; H324-F326 PolarHBondContact ND1-N 3.39Å; H324-F326 PolarHBondContact O-N 2.77Å; F326-E328 PolarHBondContact O-N 3.05Å; F326-E328 VanDerWaalsContact O-N 3.13Å; F326-P369 WeakPolarHBondContact CZ-O 3.49Å
327	H	92.2	Very high	94.7	Very high	6 Å²	6	22.5 Å²	22.5	3%	0.028	11%	0.112	C	C	.	.			trans	-70.1	100	171.5	-49.9	-53.5	0	0	0	111	P79 Y82 P86 C89 H324 S329 L330	P79-H327 PolarHBondContact O-CE1 3.38Å; Y82-H327 PolarHBondContact O-CE1 2.76Å; P86-H327 HydrophobicContact CB-CB 4.17Å; C89-H327 PolarHBondContact SG-NE2 3.45Å; H324-H327 AromaticContact CE1-CD2 3.13Å; H324-H327 PolarHBondContact CE1-CD2 2.89Å; H324-H327 AromaticContact CE1-CG 3.81Å; H324-H327 AromaticContact CE1-NE2 3.7Å; H324-H327 AromaticContact ND1-CD2 3.35Å; H324-H327 PolarHBondContact ND1-CD2 2.84Å; H324-H327 VanDerWaalsContact ND1-CD2 3.35Å; H324-H327 AromaticContact ND1-CG 3.71Å; H324-H327 PolarHBondContact ND1-N 3.21Å; H324-H327 AromaticContact NE2-CD2 3.82Å; H327-S329 PolarHBondContact O-N 3.34Å; H327-S329 VanDerWaalsContact O-N 3.12Å; H327-L330 HydrophobicContact CB-CB 3.79Å; H327-L330 HydrophobicContact CB-CD2 4.5Å; H327-L330 PolarHBondContact O-N 3.5Å; H327-L330 VanDerWaalsContact O-N 3.15Å
328	E	92.5	Very high	94.7	Very high	104 Å²	104	20.5 Å²	20.5	49%	0.486	10%	0.102	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-21.6	-178.1	65.7	171.9	161.3	0	0	114.8	N281 N283 W323 F326	N281-E328 PolarHBondContact ND2-O 3Å; N283-E328 PolarHBondContact ND2-OE2 2.81Å; W323-E328 WeakPolarHBondContact CZ3-O 3.44Å; F326-E328 PolarHBondContact O-N 3.05Å; F326-E328 VanDerWaalsContact O-N 3.13Å
329	S	92.8	Very high	94.6	Very high	30 Å²	30	20.5 Å²	20.5	21%	0.21	10%	0.102	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.3	-14.7	-178.1	48.7	0	0	0	0	113.2	H327 L344 A345	H327-S329 PolarHBondContact O-N 3.34Å; H327-S329 VanDerWaalsContact O-N 3.12Å; S329-L344 CarbonylContact O-C 3.53Å; S329-L344 WeakPolarHBondContact O-CA 2.57Å; S329-L344 VanDerWaalsContact OG-CD1 3.27Å; S329-L344 WeakPolarHBondContact OG-CD1 3.33Å; S329-A345 PolarHBondContact O-N 2.91Å
330	L	94.3	Very high	94.6	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	131.7	-176.2	-178	72.6	0	0	0	110.9	C89 H324 H327 W343 L344 L351	C89-L330 HydrophobicContact CB-CD2 3.46Å; C89-L330 VanDerWaalsContact CB-CD2 3.46Å; H324-L330 HydrophobicContact CB-CB 4.09Å; H324-L330 HydrophobicContact CB-CD2 3.97Å; H324-L330 HydrophobicContact CB-CG 4.13Å; H324-L330 WeakPolarHBondContact CB-O 3.45Å; H324-L330 PolarHBondContact N-O 2.61Å; H327-L330 HydrophobicContact CB-CB 3.79Å; H327-L330 HydrophobicContact CB-CD2 4.5Å; H327-L330 PolarHBondContact O-N 3.5Å; H327-L330 VanDerWaalsContact O-N 3.15Å; L330-W343 WeakPolarHBondContact CA-O 3.49Å; L330-L344 HydrophobicContact CB-CD1 4.44Å; L330-L351 HydrophobicContact CD1-CD1 3.8Å
331	F	95.8	Very high	94.6	Very high	0 Å²	0	15.5 Å²	15.5	0%	0	8%	0.082	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144	163.6	170.6	66.1	-87.2	0	0	0	112.3	L288 I296 F311 V321 A322 W323 W343	L288-F331 HydrophobicContact CD1-CB 3.9Å; L288-F331 HydrophobicContact CD1-CD1 3.5Å; L288-F331 VanDerWaalsContact CD1-CD1 3.5Å; L288-F331 HydrophobicContact CD1-CD2 3.58Å; L288-F331 HydrophobicContact CD1-CE1 3.81Å; L288-F331 HydrophobicContact CD1-CE2 3.88Å; L288-F331 HydrophobicContact CD1-CG 3.36Å; L288-F331 HydrophobicContact CD1-CZ 3.98Å; L288-F331 HydrophobicContact CD2-CE1 4.05Å; L288-F331 HydrophobicContact CD2-CE2 4.33Å; L288-F331 HydrophobicContact CD2-CZ 3.92Å; I296-F331 HydrophobicContact CD1-CE2 4.17Å; I296-F331 HydrophobicContact CG2-CE2 4.06Å; I296-F331 HydrophobicContact CG2-CZ 4.34Å; F311-F331 HydrophobicContact CD1-CZ 4.33Å; F311-F331 HydrophobicContact CD2-CE1 4.38Å; F311-F331 AromaticContact CD2-CZ 3.61Å; F311-F331 HydrophobicContact CD2-CZ 3.61Å; F311-F331 HydrophobicContact CE1-CE1 4.26Å; F311-F331 HydrophobicContact CE1-CZ 4.16Å; F311-F331 AromaticContact CE2-CE1 3.73Å; F311-F331 HydrophobicContact CE2-CE1 3.73Å; F311-F331 AromaticContact CE2-CZ 3.4Å; F311-F331 HydrophobicContact CE2-CZ 3.4Å; F311-F331 VanDerWaalsContact CE2-CZ 3.4Å; F311-F331 HydrophobicContact CG-CZ 4.07Å; F311-F331 AromaticContact CZ-CE1 3.66Å; F311-F331 HydrophobicContact CZ-CE1 3.66Å; F311-F331 AromaticContact CZ-CZ 3.7Å; F311-F331 HydrophobicContact CZ-CZ 3.7Å; V321-F331 HydrophobicContact CG1-CD2 3.91Å; A322-F331 WeakPolarHBondContact O-CA 3.33Å; W323-F331 HydrophobicContact CD2-CB 4.24Å; W323-F331 HydrophobicContact CE3-CB 3.85Å; W323-F331 HydrophobicContact CE3-CD1 4.31Å; W323-F331 HydrophobicContact CE3-CG 4.47Å; W323-F331 HydrophobicContact CZ3-CB 4.39Å; W323-F331 AromaticContact CZ3-CD1 3.99Å; W323-F331 HydrophobicContact CZ3-CD1 3.99Å; F331-W343 HydrophobicContact CD1-CB 4.04Å; F331-W343 HydrophobicContact CD2-CB 4.09Å; F331-W343 AromaticContact CD2-CD1 3.93Å; F331-W343 HydrophobicContact CD2-CG 4.34Å; F331-W343 HydrophobicContact CE1-CB 3.5Å; F331-W343 VanDerWaalsContact CE1-CB 3.5Å; F331-W343 HydrophobicContact CE1-CG 4.37Å; F331-W343 HydrophobicContact CE2-CB 3.55Å; F331-W343 AromaticContact CE2-CD1 3.36Å; F331-W343 AromaticContact CE2-CG 3.6Å; F331-W343 HydrophobicContact CE2-CG 3.6Å; F331-W343 HydrophobicContact CG-CB 4.32Å; F331-W343 HydrophobicContact CZ-CB 3.22Å; F331-W343 AromaticContact CZ-CD1 3.89Å; F331-W343 AromaticContact CZ-CG 3.62Å; F331-W343 HydrophobicContact CZ-CG 3.62Å; F331-W343 PolarHBondContact N-O 3.48Å; F331-W343 PolarHBondContact O-N 3.07Å
332	V	95.8	Very high	94.5	Very high	0 Å²	0	15.3 Å²	15.3	0%	0	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	149.3	176.6	-164.3	0	0	0	0	109.5	V321 A322 I340 F341 Y342 L365 W367 L374	V321-V332 CarbonylContact C-O 3.55Å; V321-V332 WeakPolarHBondContact CA-O 3.49Å; A322-V332 PolarHBondContact N-O 3.1Å; A322-V332 PolarHBondContact O-N 3.19Å; V332-I340 HydrophobicContact CG1-CG2 3.38Å; V332-F341 WeakPolarHBondContact CA-O 3.42Å; V332-Y342 HydrophobicContact CB-CE1 4.48Å; V332-Y342 HydrophobicContact CG1-CD1 4.31Å; V332-Y342 HydrophobicContact CG1-CE1 4.04Å; V332-Y342 HydrophobicContact CG2-CD1 3.7Å; V332-Y342 HydrophobicContact CG2-CE1 3.6Å; V332-L365 HydrophobicContact CB-CD1 4.15Å; V332-L365 HydrophobicContact CG1-CD1 3.86Å; V332-W367 HydrophobicContact CG2-CH2 3.95Å; V332-W367 HydrophobicContact CG2-CZ2 3.11Å; V332-L374 HydrophobicContact CB-CD2 4.46Å; V332-L374 HydrophobicContact CG1-CD2 3.81Å; V332-L374 HydrophobicContact CG2-CD1 4.21Å; V332-L374 HydrophobicContact CG2-CD2 4.2Å
333	S	96.3	Very high	94.5	Very high	0 Å²	0	14.7 Å²	14.7	0%	0	8%	0.076	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	138.5	174.4	54.1	0	0	0	0	111	H314 R320 I340 F341 W343	H314-S333 PolarHBondContact CE1-OG 3.49Å; H314-S333 PolarHBondContact NE2-OG 3.36Å; R320-S333 WeakPolarHBondContact O-CA 3.46Å; S333-I340 WeakPolarHBondContact O-CA 3.28Å; S333-F341 PolarHBondContact N-O 2.98Å; S333-F341 PolarHBondContact O-N 3.31Å; S333-F341 PolarHBondContact OG-O 3.42Å; S333-W343 PolarHBondContact OG-NE1 3.38Å
334	G	95.6	Very high	94.3	Very high	0 Å²	0	15.1 Å²	15.1	0%	0	8%	0.079	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	130.2	177.7	0	0	0	0	0	110.3	M319 R320	M319-G334 PolarHBondContact N-O 2.66Å; R320-G334 PolarHBondContact N-O 3.05Å; R320-G334 PolarHBondContact O-N 3.42Å
335	S	95.7	Very high	94.1	Very high	0 Å²	0	15.8 Å²	15.8	0%	0	9%	0.086	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	165.6	-178.6	-169.1	0	0	0	0	113.1	H314 R316 D317 D337 G338 A339 I362	H314-S335 WeakPolarHBondContact ND1-CB 3.34Å; R316-S335 PolarHBondContact O-OG 2.89Å; R316-S335 VanDerWaalsContact O-OG 3.07Å; D317-S335 CarbonylContact O-C 3.57Å; D317-S335 WeakPolarHBondContact O-CA 3.48Å; D317-S335 PolarHBondContact O-OG 3.09Å; S335-D337 VanDerWaalsContact C-N 3.32Å; S335-D337 WeakPolarHBondContact CB-OD1 3.36Å; S335-D337 PolarHBondContact OG-OD1 3.25Å; S335-G338 PolarHBondContact O-N 3.48Å; S335-A339 PolarHBondContact N-O 2.9Å; S335-I362 PolarHBondContact O-N 2.93Å
336	A	95.1	Very high	93.9	Very high	5 Å²	5	17 Å²	17	4%	0.041	11%	0.106	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75	-13	174	0	0	0	0	0	114.4	R316 D317 M319 M361	R316-A336 HydrophobicContact CB-CB 4.27Å; D317-A336 HydrophobicContact CB-CB 3.81Å; D317-A336 WeakPolarHBondContact O-CB 3.3Å; D317-A336 PolarHBondContact O-N 2.81Å; M319-A336 HydrophobicContact CG-CB 3.86Å; M319-A336 HydrophobicContact SD-CB 4.19Å; A336-M361 HydrophobicContact CB-CE 4.38Å; A336-M361 HydrophobicContact CB-CG 3.93Å; A336-M361 VanDerWaalsContact O-CG 3.26Å; A336-M361 WeakPolarHBondContact O-CG 3.15Å
337	D	93.7	Very high	93.9	Very high	34 Å²	34	16.2 Å²	16.2	18%	0.182	11%	0.106	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-14.2	168.3	53.3	20.8	0	0	0	113.5	R316 S335 A339	R316-D337 HydrophobicContact CB-CB 4.32Å; R316-D337 HydrophobicContact CG-CB 3.96Å; S335-D337 VanDerWaalsContact C-N 3.32Å; S335-D337 WeakPolarHBondContact CB-OD1 3.36Å; S335-D337 PolarHBondContact OG-OD1 3.25Å; D337-A339 WeakPolarHBondContact OD1-CB 3.45Å; D337-A339 PolarHBondContact OD1-N 3.42Å
338	G	93.1	Very high	93.7	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	14%	0.136	C	C	.	.	S	Bend	trans	100.5	4.2	-174.1	0	0	0	0	0	114.3	S335 A357 H358 S360	S335-G338 PolarHBondContact O-N 3.48Å; G338-A357 WeakPolarHBondContact O-CB 3.49Å; G338-A357 PolarHBondContact O-N 3.43Å; G338-H358 PolarHBondContact O-N 3.03Å; G338-S360 VanDerWaalsContact CA-O 3.3Å; G338-S360 WeakPolarHBondContact CA-O 3.22Å
339	A	95.1	Very high	93.6	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	13%	0.134	C	C	.	.			trans	-77.8	146.7	175.9	0	0	0	0	0	113.2	S335 D337 F341 V354 D355 I362	S335-A339 PolarHBondContact N-O 2.9Å; D337-A339 WeakPolarHBondContact OD1-CB 3.45Å; D337-A339 PolarHBondContact OD1-N 3.42Å; A339-F341 HydrophobicContact CB-CD2 4.1Å; A339-F341 HydrophobicContact CB-CE2 3.62Å; A339-V354 WeakPolarHBondContact CA-O 3.21Å; A339-D355 WeakPolarHBondContact CA-O 3.42Å; A339-D355 WeakPolarHBondContact CB-O 3.12Å; A339-I362 WeakPolarHBondContact O-CD1 3.39Å
340	I	95.6	Very high	93.5	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	123.7	171.8	-63.6	175.8	0	0	0	109	V332 S333 Y342 A353 V354 A357 I362 L365 L374 W386	V332-I340 HydrophobicContact CG1-CG2 3.38Å; S333-I340 WeakPolarHBondContact O-CA 3.28Å; I340-Y342 HydrophobicContact CG2-CE2 3.86Å; I340-A353 CarbonylContact O-C 3.41Å; I340-A353 WeakPolarHBondContact O-CA 2.66Å; I340-V354 HydrophobicContact CB-CB 4.46Å; I340-V354 PolarHBondContact N-O 2.8Å; I340-V354 PolarHBondContact O-N 3.04Å; I340-A357 HydrophobicContact CB-CB 4.24Å; I340-A357 HydrophobicContact CD1-CB 3.69Å; I340-A357 HydrophobicContact CG1-CB 3.73Å; I340-I362 HydrophobicContact CD1-CD1 4.1Å; I340-I362 HydrophobicContact CG1-CD1 3.43Å; I340-I362 VanDerWaalsContact CG1-CD1 3.43Å; I340-L365 HydrophobicContact CD1-CD2 4.46Å; I340-L374 HydrophobicContact CG2-CD2 4.14Å; I340-W386 HydrophobicContact CD1-CZ2 4.14Å
341	F	95	Very high	93.3	Very high	3 Å²	3	23.7 Å²	23.7	1%	0.013	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	136.6	177.3	-72.9	-103.8	0	0	0	111.4	H314 V332 S333 A339 W343 E350 A353	H314-F341 AromaticContact CE1-CD2 3.34Å; H314-F341 WeakPolarHBondContact CE1-CD2 3.38Å; H314-F341 AromaticContact CE1-CG 3.88Å; H314-F341 AromaticContact ND1-CD2 3.5Å; H314-F341 WeakPolarHBondContact ND1-CD2 3.35Å; H314-F341 AromaticContact ND1-CE2 3.76Å; H314-F341 AromaticContact NE2-CD2 3.98Å; V332-F341 WeakPolarHBondContact CA-O 3.42Å; S333-F341 PolarHBondContact N-O 2.98Å; S333-F341 PolarHBondContact O-N 3.31Å; S333-F341 PolarHBondContact OG-O 3.42Å; A339-F341 HydrophobicContact CB-CD2 4.1Å; A339-F341 HydrophobicContact CB-CE2 3.62Å; F341-W343 HydrophobicContact CB-CZ2 3.94Å; F341-W343 AromaticContact CD1-CZ2 3.96Å; F341-W343 HydrophobicContact CD1-CZ2 3.96Å; F341-W343 HydrophobicContact CG-CZ2 4.17Å; F341-E350 HydrophobicContact CD1-CB 4.01Å; F341-E350 HydrophobicContact CD1-CG 4.06Å; F341-E350 HydrophobicContact CE1-CG 4.33Å; F341-A353 HydrophobicContact CD1-CB 3.59Å; F341-A353 HydrophobicContact CE1-CB 3.49Å; F341-A353 VanDerWaalsContact CE1-CB 3.49Å; F341-A353 HydrophobicContact CG-CB 4.19Å; F341-A353 HydrophobicContact CZ-CB 4.03Å
342	Y	95.2	Very high	92.9	Very high	1 Å²	1	24.7 Å²	24.7	0%	0.004	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	134	175	-61	-91	0	0	0	110.2	V90 M91 V332 I340 L351 G352 V354 W367 L374	V90-Y342 HydrophobicContact CG1-CD2 3.84Å; V90-Y342 HydrophobicContact CG1-CE2 4.32Å; V90-Y342 HydrophobicContact CG1-CG 4.03Å; V90-Y342 HydrophobicContact CG2-CG 4.45Å; M91-Y342 HydrophobicContact CB-CE1 4.21Å; M91-Y342 WeakPolarHBondContact CB-OH 3.44Å; M91-Y342 HydrophobicContact CG-CE1 4.44Å; M91-Y342 PolarHBondContact O-OH 3.46Å; V332-Y342 HydrophobicContact CB-CE1 4.48Å; V332-Y342 HydrophobicContact CG1-CD1 4.31Å; V332-Y342 HydrophobicContact CG1-CE1 4.04Å; V332-Y342 HydrophobicContact CG2-CD1 3.7Å; V332-Y342 HydrophobicContact CG2-CE1 3.6Å; I340-Y342 HydrophobicContact CG2-CE2 3.86Å; Y342-L351 PolarHBondContact O-N 2.84Å; Y342-G352 PolarHBondContact N-O 3.23Å; Y342-V354 HydrophobicContact CE2-CG2 4.39Å; Y342-W367 HydrophobicContact CE1-CH2 4.22Å; Y342-L374 HydrophobicContact CE1-CD2 4.16Å; Y342-L374 VanDerWaalsContact OH-CD2 3.23Å; Y342-L374 WeakPolarHBondContact OH-CD2 3.23Å
343	W	95	Very high	92.5	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	147.4	-173.9	-57.9	95.1	0	0	0	111.4	F311 R312 H314 L330 F331 S333 F341 E350	F311-W343 HydrophobicContact CB-CD2 4.03Å; F311-W343 HydrophobicContact CB-CE3 3.78Å; F311-W343 HydrophobicContact CB-CH2 4.18Å; F311-W343 HydrophobicContact CB-CZ2 4.39Å; F311-W343 HydrophobicContact CB-CZ3 3.85Å; F311-W343 HydrophobicContact CD1-CB 4.38Å; F311-W343 HydrophobicContact CD1-CD2 4.02Å; F311-W343 AromaticContact CD1-CE3 3.48Å; F311-W343 HydrophobicContact CD1-CE3 3.48Å; F311-W343 VanDerWaalsContact CD1-CE3 3.48Å; F311-W343 HydrophobicContact CD1-CG 4.42Å; F311-W343 HydrophobicContact CD1-CZ3 4.14Å; F311-W343 HydrophobicContact CE1-CB 4.42Å; F311-W343 HydrophobicContact CE1-CE3 4.42Å; F311-W343 HydrophobicContact CG-CD2 4.19Å; F311-W343 AromaticContact CG-CE3 3.95Å; F311-W343 HydrophobicContact CG-CE3 3.95Å; F311-W343 HydrophobicContact CG-CZ3 4.45Å; R312-W343 WeakPolarHBondContact O-CH2 3.17Å; H314-W343 AromaticContact CD2-CZ2 3.98Å; H314-W343 AromaticContact NE2-NE1 3.76Å; L330-W343 WeakPolarHBondContact CA-O 3.49Å; F331-W343 HydrophobicContact CD1-CB 4.04Å; F331-W343 HydrophobicContact CD2-CB 4.09Å; F331-W343 AromaticContact CD2-CD1 3.93Å; F331-W343 HydrophobicContact CD2-CG 4.34Å; F331-W343 HydrophobicContact CE1-CB 3.5Å; F331-W343 VanDerWaalsContact CE1-CB 3.5Å; F331-W343 HydrophobicContact CE1-CG 4.37Å; F331-W343 HydrophobicContact CE2-CB 3.55Å; F331-W343 AromaticContact CE2-CD1 3.36Å; F331-W343 AromaticContact CE2-CG 3.6Å; F331-W343 HydrophobicContact CE2-CG 3.6Å; F331-W343 HydrophobicContact CG-CB 4.32Å; F331-W343 HydrophobicContact CZ-CB 3.22Å; F331-W343 AromaticContact CZ-CD1 3.89Å; F331-W343 AromaticContact CZ-CG 3.62Å; F331-W343 HydrophobicContact CZ-CG 3.62Å; F331-W343 PolarHBondContact N-O 3.48Å; F331-W343 PolarHBondContact O-N 3.07Å; S333-W343 PolarHBondContact OG-NE1 3.38Å; F341-W343 HydrophobicContact CB-CZ2 3.94Å; F341-W343 AromaticContact CD1-CZ2 3.96Å; F341-W343 HydrophobicContact CD1-CZ2 3.96Å; F341-W343 HydrophobicContact CG-CZ2 4.17Å; W343-E350 HydrophobicContact CD2-CB 4.38Å; W343-E350 HydrophobicContact CE3-CB 4Å; W343-E350 HydrophobicContact CH2-CB 3.76Å; W343-E350 HydrophobicContact CZ2-CB 4.17Å; W343-E350 HydrophobicContact CZ3-CB 3.69Å; W343-E350 VanDerWaalsContact CZ3-N 3.28Å
344	L	93.8	Very high	92.3	Very high	30 Å²	30	26 Å²	26	16%	0.157	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	129.6	171.6	-166.1	69.2	0	0	0	109.3	P86 S329 L330 G346 T347 L351	P86-L344 HydrophobicContact CB-CD1 3.91Å; P86-L344 HydrophobicContact CG-CD1 3.62Å; P86-L344 HydrophobicContact CG-CD2 4.11Å; S329-L344 CarbonylContact O-C 3.53Å; S329-L344 WeakPolarHBondContact O-CA 2.57Å; S329-L344 VanDerWaalsContact OG-CD1 3.27Å; S329-L344 WeakPolarHBondContact OG-CD1 3.33Å; L330-L344 HydrophobicContact CB-CD1 4.44Å; L344-G346 PolarHBondContact O-N 3.13Å; L344-T347 HydrophobicContact CB-CG2 4.28Å; L344-T347 WeakPolarHBondContact CB-OG1 3.31Å; L344-T347 HydrophobicContact CD2-CG2 4.12Å; L344-T347 PolarHBondContact O-N 3.12Å; L344-T347 VanDerWaalsContact O-N 3.09Å; L344-T347 PolarHBondContact O-OG1 3.26Å; L344-T347 VanDerWaalsContact O-OG1 3.06Å; L344-L351 HydrophobicContact CB-CD1 3.72Å; L344-L351 HydrophobicContact CB-CD2 3.93Å; L344-L351 HydrophobicContact CB-CG 3.97Å
345	A	90.4	Very high	91.9	Very high	19 Å²	19	27.5 Å²	27.5	16%	0.157	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.9	121.5	169.4	0	0	0	0	0	109.4	W286 L298 S329	W286-A345 HydrophobicContact CE3-CB 4.44Å; W286-A345 HydrophobicContact CH2-CB 4.27Å; W286-A345 HydrophobicContact CZ3-CB 3.81Å; L298-A345 HydrophobicContact CD2-CB 3.87Å; S329-A345 PolarHBondContact O-N 2.91Å
346	G	89.1	Confident	91.5	Very high	68 Å²	68	34.6 Å²	34.6	70%	0.701	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	104.3	-11.4	-174.2	0	0	0	0	0	115.4	L344	L344-G346 PolarHBondContact O-N 3.13Å
347	T	90.7	Very high	91.2	Very high	40 Å²	40	34.4 Å²	34.4	25%	0.245	21%	0.211	C	C	.	.			trans	-108.5	124.7	170.4	61.3	0	0	0	0	110.4	Q309 L344 T349 L351	Q309-T347 PolarHBondContact NE2-O 3.2Å; L344-T347 HydrophobicContact CB-CG2 4.28Å; L344-T347 WeakPolarHBondContact CB-OG1 3.31Å; L344-T347 HydrophobicContact CD2-CG2 4.12Å; L344-T347 PolarHBondContact O-N 3.12Å; L344-T347 VanDerWaalsContact O-N 3.09Å; L344-T347 PolarHBondContact O-OG1 3.26Å; L344-T347 VanDerWaalsContact O-OG1 3.06Å; T347-T349 VanDerWaalsContact C-N 3.32Å; T347-T349 PolarHBondContact OG1-O 3.15Å; T347-L351 HydrophobicContact CG2-CD2 4.39Å
348	D	87.3	Confident	91.2	Very high	123 Å²	123	33.1 Å²	33.1	66%	0.658	21%	0.205	S	C	*	.	S	Bend	trans	-75.4	-22	-178.5	-71.8	-28.6	0	0	0	113.6	Q309	Q309-D348 PolarHBondContact NE2-OD1 2.85Å
349	T	89.8	Confident	91.2	Very high	74 Å²	74	41.6 Å²	41.6	45%	0.454	24%	0.244	S	C	.	.	S	Bend	trans	-91.2	152.7	172.3	57.7	0	0	0	0	111.3	T347	T347-T349 VanDerWaalsContact C-N 3.32Å; T347-T349 PolarHBondContact OG1-O 3.15Å
350	E	90.7	Very high	91.1	Very high	73 Å²	73	43.2 Å²	43.2	34%	0.341	26%	0.255	S	S	.	.			trans	-58.6	146.3	165.7	61.1	-86.4	-153.3	0	0	111.6	F341 W343 G352	F341-E350 HydrophobicContact CD1-CB 4.01Å; F341-E350 HydrophobicContact CD1-CG 4.06Å; F341-E350 HydrophobicContact CE1-CG 4.33Å; W343-E350 HydrophobicContact CD2-CB 4.38Å; W343-E350 HydrophobicContact CE3-CB 4Å; W343-E350 HydrophobicContact CH2-CB 3.76Å; W343-E350 HydrophobicContact CZ2-CB 4.17Å; W343-E350 HydrophobicContact CZ3-CB 3.69Å; W343-E350 VanDerWaalsContact CZ3-N 3.28Å; E350-G352 VanDerWaalsContact C-N 3.33Å
351	L	89.5	Confident	91.1	Very high	28 Å²	28	46.6 Å²	46.6	15%	0.147	27%	0.272	C	S	.	.	S	Bend	trans	-77.5	-25.3	172.5	-62.6	-172.9	0	0	0	112.3	M87 V90 L330 Y342 L344 T347	M87-L351 HydrophobicContact CE-CB 4.09Å; M87-L351 HydrophobicContact CE-CD2 4.45Å; M87-L351 HydrophobicContact SD-CB 4.01Å; M87-L351 HydrophobicContact SD-CD1 3.48Å; M87-L351 WeakPolarHBondContact SD-CD1 3.33Å; M87-L351 HydrophobicContact SD-CD2 3.61Å; M87-L351 HydrophobicContact SD-CG 3.88Å; V90-L351 HydrophobicContact CG2-CB 4.13Å; V90-L351 HydrophobicContact CG2-CD1 4.36Å; L330-L351 HydrophobicContact CD1-CD1 3.8Å; Y342-L351 PolarHBondContact O-N 2.84Å; L344-L351 HydrophobicContact CB-CD1 3.72Å; L344-L351 HydrophobicContact CB-CD2 3.93Å; L344-L351 HydrophobicContact CB-CG 3.97Å; T347-L351 HydrophobicContact CG2-CD2 4.39Å
352	G	87.7	Confident	91.2	Very high	21 Å²	21	46.4 Å²	46.4	22%	0.216	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	176.9	148.3	-178.6	0	0	0	0	0	111.1	Y342 E350	Y342-G352 PolarHBondContact N-O 3.23Å; E350-G352 VanDerWaalsContact C-N 3.33Å
353	A	88.9	Confident	91.3	Very high	14 Å²	14	49.2 Å²	49.2	12%	0.116	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	138.6	-179.9	0	0	0	0	0	110.4	I340 F341	I340-A353 CarbonylContact O-C 3.41Å; I340-A353 WeakPolarHBondContact O-CA 2.66Å; F341-A353 HydrophobicContact CD1-CB 3.59Å; F341-A353 HydrophobicContact CE1-CB 3.49Å; F341-A353 VanDerWaalsContact CE1-CB 3.49Å; F341-A353 HydrophobicContact CG-CB 4.19Å; F341-A353 HydrophobicContact CZ-CB 4.03Å
354	V	90.8	Very high	91.3	Very high	13 Å²	13	49.5 Å²	49.5	8%	0.079	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	83.1	169.3	-170.7	0	0	0	0	106.5	A339 I340 Y342 N356 A357 W386	A339-V354 WeakPolarHBondContact CA-O 3.21Å; I340-V354 HydrophobicContact CB-CB 4.46Å; I340-V354 PolarHBondContact N-O 2.8Å; I340-V354 PolarHBondContact O-N 3.04Å; Y342-V354 HydrophobicContact CE2-CG2 4.39Å; V354-N356 VanDerWaalsContact C-N 3.33Å; V354-N356 PolarHBondContact O-N 2.91Å; V354-A357 HydrophobicContact CB-CB 4.07Å; V354-A357 HydrophobicContact CG1-CB 3.7Å; V354-A357 WeakPolarHBondContact O-CB 3.43Å; V354-A357 PolarHBondContact O-N 2.99Å; V354-W386 HydrophobicContact CG1-CH2 4.18Å; V354-W386 HydrophobicContact CG1-CZ3 3.99Å
355	D	88	Confident	91.4	Very high	31 Å²	31	48.5 Å²	48.5	17%	0.166	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-42.1	-171.5	-87.4	-29.2	0	0	0	113	K315 A339 S400	K315-D355 IonicContact NZ-OD1 3.63Å; K315-D355 PolarHBondContact NZ-OD1 3.14Å; K315-D355 IonicContact NZ-OD2 3.81Å; K315-D355 PolarHBondContact NZ-OD2 2.87Å; A339-D355 WeakPolarHBondContact CA-O 3.42Å; A339-D355 WeakPolarHBondContact CB-O 3.12Å; D355-S400 PolarHBondContact OD2-OG 2.96Å
356	N	87.5	Confident	91.7	Very high	149 Å²	149	48.2 Å²	48.2	80%	0.797	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.5	38.4	-178.3	-65.5	-24.7	0	0	0	112	V354 H358	V354-N356 VanDerWaalsContact C-N 3.33Å; V354-N356 PolarHBondContact O-N 2.91Å; N356-H358 PolarHBondContact O-N 2.86Å
357	A	88.8	Confident	92.1	Very high	1 Å²	1	46 Å²	46	1%	0.008	25%	0.247	C	C	.	.	S	Bend	trans	-64	-40.7	-177.9	0	0	0	0	0	112.2	G338 I340 V354 K384 W386	G338-A357 WeakPolarHBondContact O-CB 3.49Å; G338-A357 PolarHBondContact O-N 3.43Å; I340-A357 HydrophobicContact CB-CB 4.24Å; I340-A357 HydrophobicContact CD1-CB 3.69Å; I340-A357 HydrophobicContact CG1-CB 3.73Å; V354-A357 HydrophobicContact CB-CB 4.07Å; V354-A357 HydrophobicContact CG1-CB 3.7Å; V354-A357 WeakPolarHBondContact O-CB 3.43Å; V354-A357 PolarHBondContact O-N 2.99Å; A357-K384 WeakPolarHBondContact O-CD 3.29Å; A357-K384 WeakPolarHBondContact O-CE 3.36Å; A357-K384 PolarHBondContact O-NZ 2.95Å; A357-W386 HydrophobicContact CB-CH2 3.7Å; A357-W386 HydrophobicContact CB-CZ2 3.64Å
358	H	92.9	Very high	92.3	Very high	8 Å²	8	44.4 Å²	44.4	4%	0.037	24%	0.236	C	C	.	.			trans	-129.9	160.9	175.3	-83	-88.1	0	0	0	112	G338 N356 S360 I362 S376 A378 D380 A382	G338-H358 PolarHBondContact O-N 3.03Å; N356-H358 PolarHBondContact O-N 2.86Å; H358-S360 VanDerWaalsContact C-N 3.28Å; H358-I362 HydrophobicContact CB-CG1 4.25Å; H358-S376 PolarHBondContact CD2-OG 2.96Å; H358-S376 WeakPolarHBondContact NE2-CB 3.25Å; H358-S376 PolarHBondContact NE2-OG 2.88Å; H358-A378 HydrophobicContact CB-CB 4.06Å; H358-A378 VanDerWaalsContact ND1-CB 3.26Å; H358-A378 WeakPolarHBondContact ND1-CB 3.48Å; H358-D380 WeakPolarHBondContact CB-OD2 3.45Å; H358-D380 IonicContact CE1-OD1 3.12Å; H358-D380 IonicContact CE1-OD2 3.57Å; H358-D380 IonicContact CG-OD2 3.95Å; H358-D380 VanDerWaalsContact ND1-CG 3.33Å; H358-D380 IonicContact ND1-OD1 2.93Å; H358-D380 PolarHBondContact ND1-OD1 3Å; H358-D380 VanDerWaalsContact ND1-OD1 3.12Å; H358-D380 IonicContact ND1-OD2 3.49Å; H358-D380 PolarHBondContact ND1-OD2 3.24Å; H358-A382 PolarHBondContact CE1-O 2.81Å
359	E	93	Very high	92.7	Very high	178 Å²	178	40.8 Å²	40.8	83%	0.832	22%	0.219	S	C	*	.	S	Bend	trans	-83.6	-7.9	176.1	-64.4	177.9	-165.3	0	0	112.5	D380	E359-D380 HydrophobicContact CB-CB 4.05Å; E359-D380 PolarHBondContact N-OD2 3.45Å; E359-D380 VanDerWaalsContact N-OD2 3.08Å
360	S	93.8	Very high	92.8	Very high	33 Å²	33	39.5 Å²	39.5	23%	0.231	21%	0.208	C	C	.	.	S	Bend	trans	-155.6	178.1	-173.9	-154.3	0	0	0	0	111.9	G338 H358 I362 N379	G338-S360 VanDerWaalsContact CA-O 3.3Å; G338-S360 WeakPolarHBondContact CA-O 3.22Å; H358-S360 VanDerWaalsContact C-N 3.28Å; S360-I362 PolarHBondContact O-N 2.78Å; S360-N379 PolarHBondContact OG-ND2 2.23Å
361	M	95.7	Very high	92.8	Very high	71 Å²	71	36 Å²	36	35%	0.35	19%	0.191	S	C	.	.			trans	-50.3	129	-175.3	-58.3	174.6	174.6	0	0	112.8	A336 W363 A378 N379	A336-M361 HydrophobicContact CB-CE 4.38Å; A336-M361 HydrophobicContact CB-CG 3.93Å; A336-M361 VanDerWaalsContact O-CG 3.26Å; A336-M361 WeakPolarHBondContact O-CG 3.15Å; M361-W363 HydrophobicContact SD-CZ2 4.34Å; M361-A378 CarbonylContact O-C 3.56Å; M361-A378 VanDerWaalsContact O-CA 3.3Å; M361-A378 WeakPolarHBondContact O-CA 3.3Å; M361-A378 WeakPolarHBondContact O-CB 3.38Å; M361-N379 HydrophobicContact CB-CB 4.2Å; M361-N379 WeakPolarHBondContact O-CB 3.45Å; M361-N379 PolarHBondContact O-N 3.16Å
362	I	96.9	Very high	93	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	118.7	172.2	-63.2	166.8	0	0	0	108.5	M319 S335 A339 I340 H358 S360 L365 A378	M319-I362 WeakPolarHBondContact CB-O 3.42Å; S335-I362 PolarHBondContact O-N 2.93Å; A339-I362 WeakPolarHBondContact O-CD1 3.39Å; I340-I362 HydrophobicContact CD1-CD1 4.1Å; I340-I362 HydrophobicContact CG1-CD1 3.43Å; I340-I362 VanDerWaalsContact CG1-CD1 3.43Å; H358-I362 HydrophobicContact CB-CG1 4.25Å; S360-I362 PolarHBondContact O-N 2.78Å; I362-L365 HydrophobicContact CG2-CD2 3.98Å; I362-L365 HydrophobicContact CG2-CG 4.05Å; I362-A378 HydrophobicContact CG1-CB 4.26Å
363	W	96.1	Very high	93.4	Very high	59 Å²	59	33.9 Å²	33.9	22%	0.223	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	-32.1	179.3	-70.4	115.1	0	0	0	112.7	Y107 M319 R320 M361 G377 N379	Y107-W363 HydrophobicContact CD1-CB 4.38Å; Y107-W363 AromaticContact CD1-CD1 3.69Å; Y107-W363 AromaticContact CD1-CD2 3.77Å; Y107-W363 HydrophobicContact CD1-CD2 3.77Å; Y107-W363 AromaticContact CD1-CE2 3.83Å; Y107-W363 HydrophobicContact CD1-CE3 4.42Å; Y107-W363 AromaticContact CD1-CG 3.72Å; Y107-W363 HydrophobicContact CD1-CG 3.72Å; Y107-W363 AromaticContact CD1-NE1 3.73Å; Y107-W363 HydrophobicContact CE1-CD2 4.06Å; Y107-W363 AromaticContact CE1-CE2 3.63Å; Y107-W363 HydrophobicContact CE1-CG 4.32Å; Y107-W363 HydrophobicContact CE1-CZ2 4.01Å; Y107-W363 AromaticContact CE1-NE1 3.57Å; Y107-W363 WeakPolarHBondContact O-CB 3.44Å; M319-W363 HydrophobicContact CE-CE3 3.75Å; M319-W363 HydrophobicContact CE-CH2 3.76Å; M319-W363 HydrophobicContact CE-CZ3 3.22Å; R320-W363 WeakPolarHBondContact CD-O 3.32Å; M361-W363 HydrophobicContact SD-CZ2 4.34Å; W363-G377 PolarHBondContact N-O 2.69Å; W363-N379 PolarHBondContact NE1-OD1 2.78Å
364	S	95.8	Very high	93.7	Very high	6 Å²	6	33.2 Å²	33.2	4%	0.042	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	141	-174.8	-158.4	0	0	0	0	112.1	Y107 V109 S376 G377	Y107-S364 WeakPolarHBondContact O-CB 3.4Å; V109-S364 PolarHBondContact N-OG 2.9Å; V109-S364 VanDerWaalsContact N-OG 3.11Å; S364-S376 WeakPolarHBondContact O-CA 3.11Å; S364-G377 PolarHBondContact N-O 2.8Å; S364-G377 VanDerWaalsContact N-O 3.15Å; S364-G377 PolarHBondContact O-N 3.18Å
365	L	96.4	Very high	94	Very high	9 Å²	9	32.6 Å²	32.6	5%	0.047	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	134.9	172.2	-71.2	175.1	0	0	0	107.8	R320 A322 V332 I340 I362 L374 V375	R320-L365 HydrophobicContact CG-CB 4.45Å; A322-L365 HydrophobicContact CB-CB 3.88Å; V332-L365 HydrophobicContact CB-CD1 4.15Å; V332-L365 HydrophobicContact CG1-CD1 3.86Å; I340-L365 HydrophobicContact CD1-CD2 4.46Å; I362-L365 HydrophobicContact CG2-CD2 3.98Å; I362-L365 HydrophobicContact CG2-CG 4.05Å; L365-L374 HydrophobicContact CB-CD1 4.46Å; L365-L374 HydrophobicContact CD2-CD1 4.39Å; L365-L374 HydrophobicContact CD2-CD2 4.36Å; L365-V375 WeakPolarHBondContact CA-O 3.35Å
366	A	96.8	Very high	94.4	Very high	13 Å²	13	31.1 Å²	31.1	11%	0.107	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	119	178	0	0	0	0	0	110.9	V109 W111 V375	V109-A366 HydrophobicContact CB-CB 4.42Å; V109-A366 HydrophobicContact CG1-CB 3.94Å; W111-A366 PolarHBondContact NE1-O 2.86Å; A366-V375 PolarHBondContact N-O 2.83Å; A366-V375 PolarHBondContact O-N 2.99Å
367	W	96.5	Very high	94.8	Very high	23 Å²	23	24 Å²	24	9%	0.087	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73	139	168.6	-72.6	107.1	0	0	0	110.7	C89 M91 A322 W323 H324 P325 V332 Y342 L374	C89-W367 WeakPolarHBondContact O-CH2 3.07Å; M91-W367 HydrophobicContact CE-CH2 4.14Å; M91-W367 HydrophobicContact CE-CZ3 3.54Å; M91-W367 HydrophobicContact CG-CH2 3.87Å; M91-W367 HydrophobicContact CG-CZ3 3.55Å; M91-W367 HydrophobicContact SD-CZ3 4.4Å; A322-W367 PolarHBondContact O-NE1 2.79Å; A322-W367 VanDerWaalsContact O-NE1 3.14Å; W323-W367 PolarHBondContact O-NE1 2.88Å; H324-W367 HydrophobicContact CB-CZ2 3.87Å; H324-W367 AromaticContact CD2-CE2 3.96Å; H324-W367 AromaticContact CD2-CE3 3.99Å; H324-W367 AromaticContact CD2-CH2 3.79Å; H324-W367 AromaticContact CD2-CZ2 3.79Å; H324-W367 AromaticContact CD2-CZ3 3.91Å; P325-W367 HydrophobicContact CG-CB 4.38Å; V332-W367 HydrophobicContact CG2-CH2 3.95Å; V332-W367 HydrophobicContact CG2-CZ2 3.11Å; Y342-W367 HydrophobicContact CE1-CH2 4.22Å; W367-L374 HydrophobicContact CD2-CD1 3.9Å; W367-L374 HydrophobicContact CE3-CB 3.93Å; W367-L374 HydrophobicContact CE3-CD1 4.18Å; W367-L374 HydrophobicContact CG-CD1 4.25Å; W367-L374 HydrophobicContact CH2-CB 4.48Å; W367-L374 HydrophobicContact CZ3-CB 3.88Å
368	H	95.9	Very high	95.1	Very high	6 Å²	6	24 Å²	24	3%	0.028	12%	0.12	C	C	.	.			trans	-61	142.3	163.9	-177.3	-81.9	0	0	0	108.9	Y43 W111 F370 G371 H372 I373	Y43-H368 AromaticContact CE1-NE2 3.68Å; Y43-H368 AromaticContact CZ-NE2 3.92Å; W111-H368 HydrophobicContact CD2-CB 4.34Å; W111-H368 AromaticContact CE3-CD2 3.73Å; W111-H368 AromaticContact CH2-CD2 3.76Å; W111-H368 HydrophobicContact CZ2-CB 4.11Å; W111-H368 AromaticContact CZ3-CD2 3.62Å; H368-F370 WeakPolarHBondContact CE1-CA 3.18Å; H368-F370 WeakPolarHBondContact CE1-CB 3.32Å; H368-F370 PolarHBondContact CE1-N 3.47Å; H368-F370 VanDerWaalsContact ND1-CB 3.31Å; H368-F370 WeakPolarHBondContact ND1-CB 3.31Å; H368-F370 PolarHBondContact ND1-N 2.95Å; H368-F370 WeakPolarHBondContact NE2-CB 3.33Å; H368-F370 PolarHBondContact O-N 2.9Å; H368-G371 PolarHBondContact CE1-N 3.05Å; H368-G371 WeakPolarHBondContact O-CA 3.46Å; H368-G371 PolarHBondContact O-N 3.02Å; H368-H372 AromaticContact CE1-CE1 3.49Å; H368-H372 PolarHBondContact CE1-CE1 2.82Å; H368-H372 VanDerWaalsContact CE1-CE1 3.49Å; H368-H372 AromaticContact CE1-ND1 3.25Å; H368-H372 PolarHBondContact CE1-ND1 3.48Å; H368-H372 AromaticContact CG-CE1 3.72Å; H368-H372 AromaticContact ND1-CE1 3.37Å; H368-H372 PolarHBondContact ND1-CE1 3.03Å; H368-H372 AromaticContact ND1-ND1 3.51Å; H368-H372 AromaticContact NE2-CE1 3.91Å; H368-I373 HydrophobicContact CB-CB 3.98Å; H368-I373 WeakPolarHBondContact CB-O 3.47Å; H368-I373 PolarHBondContact N-O 3.21Å
369	P	94.3	Very high	95.2	Very high	46 Å²	46	26 Å²	26	30%	0.299	13%	0.13	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.4	-33.6	-178.7	-29.8	35.9	0	0	0	114.1	W111 P113 F326 G371	W111-P369 HydrophobicContact CB-CG 4.43Å; P113-P369 WeakPolarHBondContact O-CG 3.2Å; F326-P369 WeakPolarHBondContact CZ-O 3.49Å; P369-G371 VanDerWaalsContact C-N 3.29Å; P369-G371 PolarHBondContact O-N 3.31Å
370	F	91.8	Very high	95.3	Very high	47 Å²	47	18.7 Å²	18.7	21%	0.206	10%	0.097	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.9	12.5	174.1	-157.5	-116.4	0	0	0	115.3	Y43 A47 P78 H368 H372	Y43-F370 HydrophobicContact CD2-CD1 4.19Å; Y43-F370 HydrophobicContact CD2-CE1 4.22Å; Y43-F370 HydrophobicContact CG-CD1 4.08Å; Y43-F370 HydrophobicContact CG-CE1 4.34Å; A47-F370 HydrophobicContact CB-CZ 4Å; P78-F370 HydrophobicContact CB-CD1 4.23Å; P78-F370 HydrophobicContact CB-CE1 3.32Å; P78-F370 HydrophobicContact CB-CE2 4.29Å; P78-F370 HydrophobicContact CB-CZ 3.36Å; P78-F370 HydrophobicContact CG-CE1 4.28Å; P78-F370 HydrophobicContact CG-CZ 3.85Å; H368-F370 WeakPolarHBondContact CE1-CA 3.18Å; H368-F370 WeakPolarHBondContact CE1-CB 3.32Å; H368-F370 PolarHBondContact CE1-N 3.47Å; H368-F370 VanDerWaalsContact ND1-CB 3.31Å; H368-F370 WeakPolarHBondContact ND1-CB 3.31Å; H368-F370 PolarHBondContact ND1-N 2.95Å; H368-F370 WeakPolarHBondContact NE2-CB 3.33Å; H368-F370 PolarHBondContact O-N 2.9Å; F370-H372 AromaticContact CD1-ND1 3.65Å; F370-H372 PolarHBondContact O-N 3.41Å
371	G	92.5	Very high	95.3	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	10%	0.104	C	C	.	.	S	Bend	trans	65.4	-7.2	171.9	0	0	0	0	0	117.9	M91 H324 H368 P369	M91-G371 WeakPolarHBondContact CE-O 3.35Å; H324-G371 WeakPolarHBondContact NE2-CA 3.38Å; H324-G371 PolarHBondContact NE2-O 3.43Å; H368-G371 PolarHBondContact CE1-N 3.05Å; H368-G371 WeakPolarHBondContact O-CA 3.46Å; H368-G371 PolarHBondContact O-N 3.02Å; P369-G371 VanDerWaalsContact C-N 3.29Å; P369-G371 PolarHBondContact O-N 3.31Å
372	H	93.3	Very high	95.3	Very high	5 Å²	5	18 Å²	18	2%	0.023	9%	0.089	C	C	.	.	S	Bend	trans	-93	-6.7	-166.9	75	-68.5	0	0	0	115.6	Y43 P79 H368 F370 T387	Y43-H372 AromaticContact CD1-CE1 3.49Å; Y43-H372 VanDerWaalsContact CD1-CE1 3.49Å; Y43-H372 WeakPolarHBondContact CD1-CE1 3.41Å; Y43-H372 AromaticContact CD1-NE2 3.61Å; Y43-H372 AromaticContact CG-CE1 3.91Å; P79-H372 HydrophobicContact CG-CB 4.1Å; H368-H372 AromaticContact CE1-CE1 3.49Å; H368-H372 PolarHBondContact CE1-CE1 2.82Å; H368-H372 VanDerWaalsContact CE1-CE1 3.49Å; H368-H372 AromaticContact CE1-ND1 3.25Å; H368-H372 PolarHBondContact CE1-ND1 3.48Å; H368-H372 AromaticContact CG-CE1 3.72Å; H368-H372 AromaticContact ND1-CE1 3.37Å; H368-H372 PolarHBondContact ND1-CE1 3.03Å; H368-H372 AromaticContact ND1-ND1 3.51Å; H368-H372 AromaticContact NE2-CE1 3.91Å; F370-H372 AromaticContact CD1-ND1 3.65Å; F370-H372 PolarHBondContact O-N 3.41Å; H372-T387 PolarHBondContact O-OG1 2.95Å
373	I	95.2	Very high	95.2	Very high	0 Å²	0	18 Å²	18	0%	0	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	135.2	176.1	-67.8	161.9	0	0	0	107.8	I41 W111 F135 H368 V375 F385 W386	I41-I373 HydrophobicContact CB-CD1 4.3Å; I41-I373 HydrophobicContact CG2-CD1 4.04Å; I41-I373 HydrophobicContact CG2-CG1 4.29Å; W111-I373 HydrophobicContact CZ2-CG2 3.92Å; F135-I373 HydrophobicContact CE1-CD1 4.08Å; F135-I373 HydrophobicContact CZ-CD1 3.78Å; H368-I373 HydrophobicContact CB-CB 3.98Å; H368-I373 WeakPolarHBondContact CB-O 3.47Å; H368-I373 PolarHBondContact N-O 3.21Å; I373-V375 HydrophobicContact CG2-CG2 4.16Å; I373-F385 HydrophobicContact CG2-CD1 4.31Å; I373-W386 CarbonylContact C-O 3.56Å; I373-W386 VanDerWaalsContact CA-O 3.28Å; I373-W386 WeakPolarHBondContact CA-O 3.35Å
374	L	96	Very high	95.2	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	143.8	165	175.5	74.4	0	0	0	108.9	M91 V332 I340 Y342 L365 W367 W386	M91-L374 HydrophobicContact CB-CB 4.21Å; M91-L374 HydrophobicContact CG-CB 4.03Å; V332-L374 HydrophobicContact CB-CD2 4.46Å; V332-L374 HydrophobicContact CG1-CD2 3.81Å; V332-L374 HydrophobicContact CG2-CD1 4.21Å; V332-L374 HydrophobicContact CG2-CD2 4.2Å; I340-L374 HydrophobicContact CG2-CD2 4.14Å; Y342-L374 HydrophobicContact CE1-CD2 4.16Å; Y342-L374 VanDerWaalsContact OH-CD2 3.23Å; Y342-L374 WeakPolarHBondContact OH-CD2 3.23Å; L365-L374 HydrophobicContact CB-CD1 4.46Å; L365-L374 HydrophobicContact CD2-CD1 4.39Å; L365-L374 HydrophobicContact CD2-CD2 4.36Å; W367-L374 HydrophobicContact CD2-CD1 3.9Å; W367-L374 HydrophobicContact CE3-CB 3.93Å; W367-L374 HydrophobicContact CE3-CD1 4.18Å; W367-L374 HydrophobicContact CG-CD1 4.25Å; W367-L374 HydrophobicContact CH2-CB 4.48Å; W367-L374 HydrophobicContact CZ3-CB 3.88Å; L374-W386 HydrophobicContact CB-CB 4.27Å; L374-W386 PolarHBondContact N-O 2.87Å; L374-W386 PolarHBondContact O-N 3.09Å
375	V	96.5	Very high	95.1	Very high	0 Å²	0	16.5 Å²	16.5	0%	0	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	137.7	170.4	-172.2	0	0	0	0	110.6	V109 W111 L118 L365 A366 I373 T383 K384 F385	V109-V375 HydrophobicContact CG1-CB 4.16Å; V109-V375 HydrophobicContact CG1-CG1 3.8Å; W111-V375 HydrophobicContact CH2-CG2 4.45Å; W111-V375 HydrophobicContact CZ2-CG2 3.33Å; L118-V375 HydrophobicContact CD1-CB 4.39Å; L118-V375 HydrophobicContact CD1-CG1 4.42Å; L118-V375 HydrophobicContact CD1-CG2 4.19Å; L118-V375 HydrophobicContact CD2-CB 4.46Å; L118-V375 HydrophobicContact CD2-CG1 3.69Å; L118-V375 HydrophobicContact CD2-CG2 4.32Å; L365-V375 WeakPolarHBondContact CA-O 3.35Å; A366-V375 PolarHBondContact N-O 2.83Å; A366-V375 PolarHBondContact O-N 2.99Å; I373-V375 HydrophobicContact CG2-CG2 4.16Å; V375-T383 HydrophobicContact CG1-CG2 3.35Å; V375-K384 WeakPolarHBondContact CA-O 3.19Å; V375-F385 HydrophobicContact CG1-CD1 4.36Å; V375-F385 HydrophobicContact CG1-CE1 4.22Å; V375-F385 HydrophobicContact CG2-CD1 3.46Å; V375-F385 VanDerWaalsContact CG2-CD1 3.46Å; V375-F385 HydrophobicContact CG2-CE1 3.59Å; V375-F385 HydrophobicContact CG2-CG 4.39Å
376	S	96.2	Very high	95.1	Very high	0 Å²	0	16.7 Å²	16.7	0%	0	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	130.6	171.2	51.9	0	0	0	0	111.1	H358 S364 T383 K384 W386	H358-S376 PolarHBondContact CD2-OG 2.96Å; H358-S376 WeakPolarHBondContact NE2-CB 3.25Å; H358-S376 PolarHBondContact NE2-OG 2.88Å; S364-S376 WeakPolarHBondContact O-CA 3.11Å; S376-T383 CarbonylContact O-C 3.57Å; S376-T383 WeakPolarHBondContact O-CA 3.44Å; S376-K384 PolarHBondContact N-O 2.84Å; S376-K384 PolarHBondContact O-N 2.72Å; S376-K384 PolarHBondContact OG-O 2.96Å; S376-W386 PolarHBondContact OG-NE1 3.29Å
377	G	95.5	Very high	94.9	Very high	0 Å²	0	16.4 Å²	16.4	0%	0	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	127	169.8	0	0	0	0	0	109.8	W363 S364	W363-G377 PolarHBondContact N-O 2.69Å; S364-G377 PolarHBondContact N-O 2.8Å; S364-G377 VanDerWaalsContact N-O 3.15Å; S364-G377 PolarHBondContact O-N 3.18Å
378	A	96	Very high	94.7	Very high	0 Å²	0	15.8 Å²	15.8	0%	0	8%	0.078	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	173.3	-170.4	0	0	0	0	0	113.5	I106 H358 M361 I362 D380 A382	I106-A378 PolarHBondContact N-O 3.37Å; H358-A378 HydrophobicContact CB-CB 4.06Å; H358-A378 VanDerWaalsContact ND1-CB 3.26Å; H358-A378 WeakPolarHBondContact ND1-CB 3.48Å; M361-A378 CarbonylContact O-C 3.56Å; M361-A378 VanDerWaalsContact O-CA 3.3Å; M361-A378 WeakPolarHBondContact O-CA 3.3Å; M361-A378 WeakPolarHBondContact O-CB 3.38Å; I362-A378 HydrophobicContact CG1-CB 4.26Å; A378-D380 WeakPolarHBondContact CB-OD1 3.11Å; A378-D380 PolarHBondContact O-N 3.03Å; A378-A382 PolarHBondContact N-O 3.49Å
379	N	95.7	Very high	94.4	Very high	49 Å²	49	18 Å²	18	26%	0.262	9%	0.09	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-7.2	-179.1	-160.6	64.5	0	0	0	113.6	S360 M361 W363 F381	S360-N379 PolarHBondContact OG-ND2 2.23Å; M361-N379 HydrophobicContact CB-CB 4.2Å; M361-N379 WeakPolarHBondContact O-CB 3.45Å; M361-N379 PolarHBondContact O-N 3.16Å; W363-N379 PolarHBondContact NE1-OD1 2.78Å; N379-F381 PolarHBondContact O-N 3.25Å
380	D	94.1	Very high	94.2	Very high	26 Å²	26	19 Å²	19	14%	0.139	9%	0.088	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.9	15.1	174.5	65.7	0	0	0	0	113.4	H358 E359 A378 A382	H358-D380 WeakPolarHBondContact CB-OD2 3.45Å; H358-D380 IonicContact CE1-OD1 3.12Å; H358-D380 IonicContact CE1-OD2 3.57Å; H358-D380 IonicContact CG-OD2 3.95Å; H358-D380 VanDerWaalsContact ND1-CG 3.33Å; H358-D380 IonicContact ND1-OD1 2.93Å; H358-D380 PolarHBondContact ND1-OD1 3Å; H358-D380 VanDerWaalsContact ND1-OD1 3.12Å; H358-D380 IonicContact ND1-OD2 3.49Å; H358-D380 PolarHBondContact ND1-OD2 3.24Å; E359-D380 HydrophobicContact CB-CB 4.05Å; E359-D380 PolarHBondContact N-OD2 3.45Å; E359-D380 VanDerWaalsContact N-OD2 3.08Å; A378-D380 WeakPolarHBondContact CB-OD1 3.11Å; A378-D380 PolarHBondContact O-N 3.03Å; D380-A382 PolarHBondContact O-N 3.12Å; D380-A382 WeakPolarHBondContact OD1-CB 3.48Å; D380-A382 PolarHBondContact OD1-N 3Å; D380-A382 VanDerWaalsContact OD1-N 3.13Å
381	F	94.4	Very high	94	Very high	83 Å²	83	17.7 Å²	17.7	36%	0.364	8%	0.084	S	C	.	.	S	Bend	trans	65.8	8.7	-178.1	-30.1	-60.5	0	0	0	114.6	K103 P105 N379	K103-F381 HydrophobicContact CB-CB 4.25Å; K103-F381 HydrophobicContact CB-CD2 3.95Å; K103-F381 HydrophobicContact CB-CE2 4.45Å; K103-F381 HydrophobicContact CB-CG 4Å; K103-F381 HydrophobicContact CD-CD2 4.39Å; K103-F381 HydrophobicContact CG-CD2 4.48Å; P105-F381 HydrophobicContact CG-CD1 3.99Å; P105-F381 HydrophobicContact CG-CE1 3.87Å; N379-F381 PolarHBondContact O-N 3.25Å
382	A	94.6	Very high	93.6	Very high	5 Å²	5	19.5 Å²	19.5	4%	0.041	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	141.8	-177.6	0	0	0	0	0	113.2	T97 T99 I106 H358 A378 D380	T97-A382 HydrophobicContact CG2-CB 3.77Å; T99-A382 HydrophobicContact CG2-CB 4.04Å; I106-A382 WeakPolarHBondContact CD1-O 3.37Å; H358-A382 PolarHBondContact CE1-O 2.81Å; A378-A382 PolarHBondContact N-O 3.49Å; D380-A382 PolarHBondContact O-N 3.12Å; D380-A382 WeakPolarHBondContact OD1-CB 3.48Å; D380-A382 PolarHBondContact OD1-N 3Å; D380-A382 VanDerWaalsContact OD1-N 3.13Å
383	T	95.5	Very high	93.1	Very high	1 Å²	1	21.6 Å²	21.6	1%	0.006	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	120.1	161	-56.2	0	0	0	0	107.6	S98 I106 L118 T120 V375 S376 F385	S98-T383 PolarHBondContact N-O 3.26Å; S98-T383 PolarHBondContact O-N 3.31Å; I106-T383 VanDerWaalsContact CD1-OG1 3.3Å; I106-T383 WeakPolarHBondContact CD1-OG1 3.44Å; L118-T383 HydrophobicContact CD2-CG2 3.77Å; T120-T383 HydrophobicContact CG2-CG2 4.04Å; V375-T383 HydrophobicContact CG1-CG2 3.35Å; S376-T383 CarbonylContact O-C 3.57Å; S376-T383 WeakPolarHBondContact O-CA 3.44Å; T383-F385 HydrophobicContact CG2-CE2 4.03Å; T383-F385 HydrophobicContact CG2-CZ 4.15Å
384	K	95.2	Very high	92.2	Very high	33 Å²	33	27.3 Å²	27.3	14%	0.143	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	137.8	178	-66.8	-178.3	-171.3	-179.2	0	110.9	T97 A357 V375 S376 W386	T97-K384 HydrophobicContact CG2-CG 3.97Å; A357-K384 WeakPolarHBondContact O-CD 3.29Å; A357-K384 WeakPolarHBondContact O-CE 3.36Å; A357-K384 PolarHBondContact O-NZ 2.95Å; V375-K384 WeakPolarHBondContact CA-O 3.19Å; S376-K384 PolarHBondContact N-O 2.84Å; S376-K384 PolarHBondContact O-N 2.72Å; S376-K384 PolarHBondContact OG-O 2.96Å; K384-W386 HydrophobicContact CB-CZ2 3.81Å; K384-W386 HydrophobicContact CD-CH2 4.46Å; K384-W386 HydrophobicContact CD-CZ2 3.91Å; K384-W386 HydrophobicContact CG-CZ2 4.49Å
385	F	95.7	Very high	90.8	Very high	1 Å²	1	31.9 Å²	31.9	0%	0.004	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	130.7	178.9	-64.7	-93.5	0	0	0	109.6	V95 R96 W111 L118 W130 F135 I373 V375 T383	V95-F385 HydrophobicContact CB-CB 4.09Å; V95-F385 WeakPolarHBondContact CB-O 3.29Å; V95-F385 WeakPolarHBondContact CG2-O 3.4Å; V95-F385 PolarHBondContact N-O 3.15Å; R96-F385 HydrophobicContact CB-CD2 4.25Å; R96-F385 PolarHBondContact O-N 3.48Å; W111-F385 HydrophobicContact CH2-CE1 4.14Å; W111-F385 HydrophobicContact CZ2-CD1 4.37Å; W111-F385 HydrophobicContact CZ2-CE1 4.14Å; L118-F385 HydrophobicContact CD2-CE1 3.74Å; L118-F385 HydrophobicContact CD2-CZ 3.56Å; W130-F385 HydrophobicContact CB-CZ 4.22Å; W130-F385 HydrophobicContact CG-CZ 4.44Å; F135-F385 HydrophobicContact CB-CD2 4.21Å; F135-F385 HydrophobicContact CB-CE2 4.15Å; F135-F385 HydrophobicContact CB-CZ 4.47Å; F135-F385 HydrophobicContact CD1-CB 4.22Å; F135-F385 AromaticContact CD1-CD1 3.24Å; F135-F385 HydrophobicContact CD1-CD1 3.24Å; F135-F385 AromaticContact CD1-CD2 3.94Å; F135-F385 HydrophobicContact CD1-CD2 3.94Å; F135-F385 AromaticContact CD1-CE1 3.4Å; F135-F385 HydrophobicContact CD1-CE1 3.4Å; F135-F385 VanDerWaalsContact CD1-CE1 3.4Å; F135-F385 HydrophobicContact CD1-CE2 4.07Å; F135-F385 AromaticContact CD1-CG 3.53Å; F135-F385 HydrophobicContact CD1-CG 3.53Å; F135-F385 AromaticContact CD1-CZ 3.82Å; F135-F385 HydrophobicContact CD1-CZ 3.82Å; F135-F385 HydrophobicContact CE1-CB 4.29Å; F135-F385 AromaticContact CE1-CD1 3.41Å; F135-F385 HydrophobicContact CE1-CD1 3.41Å; F135-F385 VanDerWaalsContact CE1-CD1 3.41Å; F135-F385 AromaticContact CE1-CE1 3.86Å; F135-F385 HydrophobicContact CE1-CE1 3.86Å; F135-F385 AromaticContact CE1-CG 3.92Å; F135-F385 HydrophobicContact CE1-CG 3.92Å; F135-F385 HydrophobicContact CG-CD1 4.22Å; F135-F385 HydrophobicContact CG-CD2 4.19Å; F135-F385 HydrophobicContact CG-CE1 4.47Å; F135-F385 HydrophobicContact CG-CE2 4.43Å; F135-F385 HydrophobicContact CG-CG 4.08Å; I373-F385 HydrophobicContact CG2-CD1 4.31Å; V375-F385 HydrophobicContact CG1-CD1 4.36Å; V375-F385 HydrophobicContact CG1-CE1 4.22Å; V375-F385 HydrophobicContact CG2-CD1 3.46Å; V375-F385 VanDerWaalsContact CG2-CD1 3.46Å; V375-F385 HydrophobicContact CG2-CE1 3.59Å; V375-F385 HydrophobicContact CG2-CG 4.39Å; T383-F385 HydrophobicContact CG2-CE2 4.03Å; T383-F385 HydrophobicContact CG2-CZ 4.15Å
386	W	94.5	Very high	88.8	Confident	12 Å²	12	39.7 Å²	39.7	5%	0.045	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	142.2	-176.7	-49.5	90.8	0	0	0	109.8	M91 K93 P94 I340 V354 A357 I373 L374 S376 K384	M91-W386 HydrophobicContact CB-CB 3.81Å; M91-W386 WeakPolarHBondContact O-CB 3.46Å; K93-W386 WeakPolarHBondContact O-CA 3.46Å; P94-W386 HydrophobicContact CB-CE3 4.06Å; P94-W386 HydrophobicContact CB-CH2 4.43Å; P94-W386 HydrophobicContact CB-CZ3 3.74Å; P94-W386 HydrophobicContact CG-CZ3 4.47Å; I340-W386 HydrophobicContact CD1-CZ2 4.14Å; V354-W386 HydrophobicContact CG1-CH2 4.18Å; V354-W386 HydrophobicContact CG1-CZ3 3.99Å; A357-W386 HydrophobicContact CB-CH2 3.7Å; A357-W386 HydrophobicContact CB-CZ2 3.64Å; I373-W386 CarbonylContact C-O 3.56Å; I373-W386 VanDerWaalsContact CA-O 3.28Å; I373-W386 WeakPolarHBondContact CA-O 3.35Å; L374-W386 HydrophobicContact CB-CB 4.27Å; L374-W386 PolarHBondContact N-O 2.87Å; L374-W386 PolarHBondContact O-N 3.09Å; S376-W386 PolarHBondContact OG-NE1 3.29Å; K384-W386 HydrophobicContact CB-CZ2 3.81Å; K384-W386 HydrophobicContact CD-CH2 4.46Å; K384-W386 HydrophobicContact CD-CZ2 3.91Å; K384-W386 HydrophobicContact CG-CZ2 4.49Å
387	T	93.3	Very high	85.9	Confident	7 Å²	7	47.4 Å²	47.4	4%	0.043	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	175.3	178.2	-160.7	0	0	0	0	112	I41 M91 K93 V95 H372	I41-T387 HydrophobicContact CD1-CG2 3.54Å; M91-T387 CarbonylContact C-O 3.58Å; M91-T387 VanDerWaalsContact CA-O 3.3Å; M91-T387 WeakPolarHBondContact CA-O 3.18Å; K93-T387 HydrophobicContact CB-CG2 4Å; K93-T387 WeakPolarHBondContact CB-O 3.31Å; K93-T387 HydrophobicContact CD-CG2 4.4Å; K93-T387 HydrophobicContact CG-CG2 4.22Å; K93-T387 PolarHBondContact N-O 3.17Å; K93-T387 VanDerWaalsContact N-O 3.14Å; K93-T387 PolarHBondContact O-N 3.44Å; V95-T387 HydrophobicContact CG2-CG2 3.54Å; H372-T387 PolarHBondContact O-OG1 2.95Å
388	R	91.9	Very high	83.2	Confident	10 Å²	10	52.8 Å²	52.8	4%	0.038	28%	0.281	C	S	.	.	P	Polyproline II helix	trans	-64.6	141.2	178.2	-61.5	-172.2	-76.1	160.6	-4.9	109.7	C77 N88 M91 R390	C77-R388 VanDerWaalsContact O-CZ 3.28Å; C77-R388 PolarHBondContact O-NH1 3.35Å; C77-R388 PolarHBondContact O-NH2 3.35Å; N88-R388 PolarHBondContact ND2-NH1 3.29Å; N88-R388 WeakPolarHBondContact O-CD 3.25Å; N88-R388 WeakPolarHBondContact O-CG 3.45Å; N88-R388 WeakPolarHBondContact OD1-CD 3.44Å; N88-R388 PolarHBondContact OD1-NH1 2.85Å; M91-R388 HydrophobicContact CE-CG 3.49Å; M91-R388 VanDerWaalsContact CE-CG 3.49Å; M91-R388 HydrophobicContact SD-CB 4.11Å; M91-R388 HydrophobicContact SD-CG 3.3Å; M91-R388 WeakPolarHBondContact SD-CG 3.4Å; M91-R388 PolarHBondContact SD-N 3.21Å; R388-R390 PolarHBondContact O-N 3.06Å
389	N	90.1	Very high	80.6	Confident	53 Å²	53	55.3 Å²	55.3	28%	0.283	29%	0.294	S	S	.	.	P	Polyproline II helix	trans	-56.2	140.6	167.1	-58.8	-28	0	0	0	109	S92 K93	S92-N389 PolarHBondContact OG-ND2 2.87Å; S92-N389 PolarHBondContact OG-OD1 3.41Å; K93-N389 PolarHBondContact N-OD1 2.88Å
390	R	89.4	Confident	77.6	Confident	66 Å²	66	55.4 Å²	55.4	25%	0.249	30%	0.299	C	S	.	.	P	Polyproline II helix	trans	-78.8	146.2	169.8	-56.5	-55.6	-170.1	171	0.7	108.4	R388 G392 D393	R388-R390 PolarHBondContact O-N 3.06Å; R390-G392 PolarHBondContact O-N 3.35Å; R390-D393 WeakPolarHBondContact CA-OD2 3.44Å; R390-D393 WeakPolarHBondContact CB-OD2 3.48Å; R390-D393 PolarHBondContact N-OD2 3.05Å; R390-D393 WeakPolarHBondContact O-CB 3.31Å; R390-D393 PolarHBondContact O-N 3.42Å
391	P	88.7	Confident	74.6	Confident	20 Å²	20	58.6 Å²	58.6	13%	0.13	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.7	132.5	168.7	-22.7	33.3	0	0	0	110	L66 Q67 D69 Y70 W72	L66-P391 HydrophobicContact CD1-CG 4.36Å; Q67-P391 WeakPolarHBondContact O-CB 3.22Å; D69-P391 CarbonylContact C-O 3.59Å; Y70-P391 WeakPolarHBondContact CA-O 3.33Å; Y70-P391 PolarHBondContact N-O 3.03Å; W72-P391 HydrophobicContact CB-CB 4.45Å
392	G	83.6	Confident	71.8	Confident	39 Å²	39	61 Å²	61	40%	0.402	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.1	-4.1	-176.3	0	0	0	0	0	116.5	P68 R390 V394	P68-G392 VanDerWaalsContact O-CA 3.3Å; P68-G392 WeakPolarHBondContact O-CA 3.41Å; P68-G392 PolarHBondContact O-N 2.86Å; R390-G392 PolarHBondContact O-N 3.35Å; G392-V394 PolarHBondContact O-N 2.57Å; G392-V394 VanDerWaalsContact O-N 3.16Å
393	D	84	Confident	69	Low	49 Å²	49	62.4 Å²	62.4	26%	0.262	37%	0.365	S	S	.	.			trans	-65.3	113.8	172.2	-80.3	-30	0	0	0	110.6	K93 R390 L395	K93-D393 WeakPolarHBondContact CD-OD2 3.11Å; K93-D393 WeakPolarHBondContact CE-OD2 3.34Å; K93-D393 IonicContact NZ-OD1 2.69Å; K93-D393 PolarHBondContact NZ-OD1 3.46Å; K93-D393 IonicContact NZ-OD2 3.18Å; K93-D393 PolarHBondContact NZ-OD2 3.04Å; R390-D393 WeakPolarHBondContact CA-OD2 3.44Å; R390-D393 WeakPolarHBondContact CB-OD2 3.48Å; R390-D393 PolarHBondContact N-OD2 3.05Å; R390-D393 WeakPolarHBondContact O-CB 3.31Å; R390-D393 PolarHBondContact O-N 3.42Å; D393-L395 PolarHBondContact O-N 2.88Å
394	V	74.8	Confident	66.1	Low	120 Å²	120	65.3 Å²	65.3	73%	0.727	39%	0.385	S	S	*	.			trans	-74.7	117.3	169.6	-177.9	0	0	0	0	109.2	G392 K396	G392-V394 PolarHBondContact O-N 2.57Å; G392-V394 VanDerWaalsContact O-N 3.16Å; V394-K396 VanDerWaalsContact C-N 3.32Å; V394-K396 HydrophobicContact CG1-CG 4.23Å; V394-K396 PolarHBondContact O-N 3.43Å
395	L	67.5	Low	63.2	Low	96 Å²	96	69.8 Å²	69.8	50%	0.503	41%	0.411	S	S	.	.			trans	-72	81.1	177.8	-59.6	176.4	0	0	0	110.9	D393 D397 I399	D393-L395 PolarHBondContact O-N 2.88Å; L395-D397 PolarHBondContact O-N 2.81Å; L395-I399 HydrophobicContact CB-CD1 4.49Å; L395-I399 HydrophobicContact CD2-CD1 3.87Å
396	K	54.1	Low	60.4	Low	164 Å²	164	73.7 Å²	73.7	71%	0.713	43%	0.432	S	S	*	.			trans	-73.3	113.2	177.4	-71.1	-175.9	175.2	-179.1	0	112.1	V394 T398	V394-K396 VanDerWaalsContact C-N 3.32Å; V394-K396 HydrophobicContact CG1-CG 4.23Å; V394-K396 PolarHBondContact O-N 3.43Å; K396-T398 VanDerWaalsContact C-N 3.33Å; K396-T398 PolarHBondContact O-N 3.35Å; K396-T398 PolarHBondContact O-OG1 2.91Å
397	D	36.3	Very low	57.9	Low	161 Å²	161	78.7 Å²	78.7	86%	0.861	46%	0.459	S	S	*	.	S	Bend	trans	43.8	36.1	148.3	-56.7	-19.2	0	0	0	119.3	L395	L395-D397 PolarHBondContact O-N 2.81Å
398	T	37.2	Very low	55.2	Low	113 Å²	113	83 Å²	83	69%	0.693	49%	0.485	S	S	*	.	S	Bend	trans	-137.2	-2	165	43.8	0	0	0	0	114.3	K396	K396-T398 VanDerWaalsContact C-N 3.33Å; K396-T398 PolarHBondContact O-N 3.35Å; K396-T398 PolarHBondContact O-OG1 2.91Å
399	I	41.5	Very low	52.3	Low	53 Å²	53	89 Å²	89	27%	0.272	51%	0.513	S	S	.	.	S	Bend	trans	-115.9	126.8	178.6	-65	156.5	0	0	0	107.1	L395 A401	L395-I399 HydrophobicContact CB-CD1 4.49Å; L395-I399 HydrophobicContact CD2-CD1 3.87Å; I399-A401 PolarHBondContact O-N 2.9Å
400	S	33.4	Very low	49.5	Very low	51 Å²	51	89.5 Å²	89.5	36%	0.357	53%	0.525	S	S	.	.			trans	-60.3	117.2	-161.3	-59	0	0	0	0	113.5	D355 V402	D355-S400 PolarHBondContact OD2-OG 2.96Å; S400-V402 PolarHBondContact O-N 3.26Å
401	A	31.6	Very low	46.9	Very low	93 Å²	93	88.8 Å²	88.8	77%	0.769	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72	46.4	173.8	0	0	0	0	0	112.9	I399	I399-A401 PolarHBondContact O-N 2.9Å
402	V	34.7	Very low	44.3	Very low	134 Å²	134	90.5 Å²	90.5	81%	0.812	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.3	-4.5	-177.2	-174	0	0	0	0	111.1	S400	S400-V402 PolarHBondContact O-N 3.26Å
403	G	35.3	Very low	41.9	Very low	34 Å²	34	91.1 Å²	91.1	35%	0.351	55%	0.547	S	S	.	.	S	Bend	trans	-119.8	-0.4	179.8	0	0	0	0	0	116.1	D405 N406 L407	G403-D405 PolarHBondContact O-N 3.25Å; G403-N406 PolarHBondContact O-N 3.04Å; G403-L407 PolarHBondContact O-N 3.05Å
404	S	36.1	Very low	39.8	Very low	62 Å²	62	93.1 Å²	93.1	43%	0.434	56%	0.561	S	S	.	*	H	α-helix	trans	-56.5	-36.9	-176.3	47.2	0	0	0	0	113.4	L407 V408	S404-L407 VanDerWaalsContact O-CB 3.25Å; S404-L407 WeakPolarHBondContact O-CB 3.33Å; S404-L407 PolarHBondContact O-N 2.92Å; S404-V408 PolarHBondContact O-N 3.49Å
405	D	33.6	Very low	38	Very low	127 Å²	127	92.2 Å²	92.2	68%	0.679	55%	0.552	S	S	*	*	H	α-helix	trans	-77.4	-29.5	-174.2	-57.5	4.3	0	0	0	110.8	G403	G403-D405 PolarHBondContact O-N 3.25Å
406	N	37.2	Very low	36.4	Very low	83 Å²	83	93.2 Å²	93.2	44%	0.444	56%	0.558	S	S	.	*	H	α-helix	trans	-78	-28.5	170.3	-66.9	-8	0	0	0	112	G403 V408 Q409 A410	G403-N406 PolarHBondContact O-N 3.04Å; N406-V408 VanDerWaalsContact C-N 3.26Å; N406-V408 PolarHBondContact O-N 2.82Å; N406-Q409 PolarHBondContact O-N 2.9Å; N406-Q409 VanDerWaalsContact O-N 3.11Å; N406-A410 PolarHBondContact O-N 2.84Å
407	L	41.3	Very low	35.4	Very low	117 Å²	117	90.7 Å²	90.7	61%	0.613	55%	0.551	S	S	*	*	H	α-helix	trans	-60	-37.6	179.1	-151	82.5	0	0	0	111.7	G403 S404 A411	G403-L407 PolarHBondContact O-N 3.05Å; S404-L407 VanDerWaalsContact O-CB 3.25Å; S404-L407 WeakPolarHBondContact O-CB 3.33Å; S404-L407 PolarHBondContact O-N 2.92Å; L407-A411 WeakPolarHBondContact O-CB 3.39Å; L407-A411 PolarHBondContact O-N 3.01Å
408	V	37.2	Very low	35.3	Very low	99 Å²	99	86.3 Å²	86.3	60%	0.6	54%	0.537	S	S	*	.	H	α-helix	trans	-69.6	-39.7	175.1	-179.4	0	0	0	0	111.2	S404 N406 S412	S404-V408 PolarHBondContact O-N 3.49Å; N406-V408 VanDerWaalsContact C-N 3.26Å; N406-V408 PolarHBondContact O-N 2.82Å; V408-S412 WeakPolarHBondContact O-CB 3.3Å; V408-S412 PolarHBondContact O-N 2.93Å; V408-S412 PolarHBondContact O-OG 2.82Å
409	Q	30.5	Very low	35.1	Very low	135 Å²	135	86.7 Å²	86.7	63%	0.631	54%	0.535	S	S	*	.	H	α-helix	trans	-70.3	-43.7	-179.2	-68.3	-175.5	-8.6	0	0	112.5	N406 A411 S412 A413	N406-Q409 PolarHBondContact O-N 2.9Å; N406-Q409 VanDerWaalsContact O-N 3.11Å; Q409-A411 PolarHBondContact O-N 2.86Å; Q409-S412 PolarHBondContact O-N 3.46Å; Q409-A413 PolarHBondContact O-N 2.85Å
410	A	32.4	Very low	34.8	Very low	63 Å²	63	88.9 Å²	88.9	52%	0.521	55%	0.551	S	S	.	*	H	α-helix	trans	-64.4	-40.1	177.8	0	0	0	0	0	112.5	N406 S412 T414	N406-A410 PolarHBondContact O-N 2.84Å; A410-S412 VanDerWaalsContact C-N 3.31Å; A410-T414 PolarHBondContact O-N 3Å; A410-T414 PolarHBondContact O-OG1 3.4Å
411	A	34.9	Very low	34.8	Very low	51 Å²	51	96.4 Å²	96.4	42%	0.421	57%	0.573	S	S	.	*	H	α-helix	trans	-71	-25	174.6	0	0	0	0	0	113.1	L407 Q409 T414 N415	L407-A411 WeakPolarHBondContact O-CB 3.39Å; L407-A411 PolarHBondContact O-N 3.01Å; Q409-A411 PolarHBondContact O-N 2.86Å; A411-T414 PolarHBondContact O-OG1 3.24Å; A411-N415 PolarHBondContact O-ND2 2.87Å
412	S	33.1	Very low	34.7	Very low	56 Å²	56	95.4 Å²	95.4	39%	0.392	56%	0.561	S	S	.	*	H	α-helix	trans	-77.5	-40.4	175.1	-60.7	0	0	0	0	111.9	V408 Q409 A410 N415 L416	V408-S412 WeakPolarHBondContact O-CB 3.3Å; V408-S412 PolarHBondContact O-N 2.93Å; V408-S412 PolarHBondContact O-OG 2.82Å; Q409-S412 PolarHBondContact O-N 3.46Å; A410-S412 VanDerWaalsContact C-N 3.31Å; S412-N415 PolarHBondContact O-N 3.01Å; S412-L416 WeakPolarHBondContact O-CB 3.45Å; S412-L416 PolarHBondContact O-N 3.34Å
413	A	32.3	Very low	34.6	Very low	53 Å²	53	99 Å²	99	44%	0.438	57%	0.566	S	S	.	*	H	α-helix	trans	-64.3	-41.3	-178.9	0	0	0	0	0	112.9	Q409 L417	Q409-A413 PolarHBondContact O-N 2.85Å; A413-L417 PolarHBondContact O-N 3.06Å
414	T	41.6	Very low	34.3	Very low	90 Å²	90	101 Å²	101	55%	0.552	59%	0.586	S	S	*	*	H	α-helix	trans	-69.3	-38.2	177.4	49.4	0	0	0	0	112.6	A410 A411 A418	A410-T414 PolarHBondContact O-N 3Å; A410-T414 PolarHBondContact O-OG1 3.4Å; A411-T414 PolarHBondContact O-OG1 3.24Å; T414-A418 WeakPolarHBondContact O-CB 3.37Å; T414-A418 PolarHBondContact O-N 3.32Å; T414-A418 VanDerWaalsContact O-N 3.14Å
415	N	36.9	Very low	34	Very low	102 Å²	102	105.4 Å²	105.4	55%	0.545	61%	0.605	S	S	.	*	H	α-helix	trans	-74.9	-26.1	177.4	-77.9	-57.6	0	0	0	114	A411 S412 N419	A411-N415 PolarHBondContact O-ND2 2.87Å; S412-N415 PolarHBondContact O-N 3.01Å; N415-N419 PolarHBondContact O-ND2 2.84Å
416	L	32.8	Very low	34	Very low	117 Å²	117	105.7 Å²	105.7	61%	0.613	61%	0.614	S	S	*	*	H	α-helix	trans	-76.3	-43.6	173.9	-81.6	162.4	0	0	0	111.9	S412 A418 N419 T420	S412-L416 WeakPolarHBondContact O-CB 3.45Å; S412-L416 PolarHBondContact O-N 3.34Å; L416-A418 VanDerWaalsContact C-N 3.32Å; L416-A418 PolarHBondContact O-N 3.03Å; L416-N419 PolarHBondContact O-N 3.12Å; L416-T420 PolarHBondContact O-N 3.33Å; L416-T420 PolarHBondContact O-OG1 3Å
417	L	34.4	Very low	33.6	Very low	110 Å²	110	110.1 Å²	110.1	58%	0.576	63%	0.632	S	S	*	*	H	α-helix	trans	-63.5	-37	175.3	-74.8	167.2	0	0	0	112.3	A413 N419 T420 Y421	A413-L417 PolarHBondContact O-N 3.06Å; L417-N419 VanDerWaalsContact C-N 3.28Å; L417-N419 PolarHBondContact O-N 3.29Å; L417-T420 PolarHBondContact O-OG1 3.24Å; L417-Y421 WeakPolarHBondContact O-CD2 3.36Å
418	A	33.3	Very low	33.3	Very low	69 Å²	69	111.1 Å²	111.1	57%	0.57	64%	0.642	S	S	*	*	H	α-helix	trans	-64.3	-28.7	176.8	0	0	0	0	0	113.7	T414 L416	T414-A418 WeakPolarHBondContact O-CB 3.37Å; T414-A418 PolarHBondContact O-N 3.32Å; T414-A418 VanDerWaalsContact O-N 3.14Å; L416-A418 VanDerWaalsContact C-N 3.32Å; L416-A418 PolarHBondContact O-N 3.03Å
419	N	34	Very low	33.2	Very low	121 Å²	121	111.3 Å²	111.3	65%	0.647	64%	0.644	S	S	*	*	H	α-helix	trans	-91.3	-18.3	-177.1	-76.7	-41.1	0	0	0	114.1	N415 L416 L417	N415-N419 PolarHBondContact O-ND2 2.84Å; L416-N419 PolarHBondContact O-N 3.12Å; L417-N419 VanDerWaalsContact C-N 3.28Å; L417-N419 PolarHBondContact O-N 3.29Å
420	T	34.6	Very low	33.2	Very low	100 Å²	100	111.2 Å²	111.2	61%	0.613	65%	0.647	S	S	*	*	H	α-helix	trans	-84.8	-16	175.4	46.1	0	0	0	0	114	L416 L417 S422	L416-T420 PolarHBondContact O-N 3.33Å; L416-T420 PolarHBondContact O-OG1 3Å; L417-T420 PolarHBondContact O-OG1 3.24Å; T420-S422 VanDerWaalsContact C-N 3.3Å; T420-S422 PolarHBondContact O-N 3.32Å
421	Y	32.9	Very low	33.2	Very low	209 Å²	209	116.4 Å²	116.4	82%	0.82	67%	0.666	S	S	*	*	S	Bend	trans	-91.6	58.2	172.7	-76.2	-77.1	0	0	0	112.2	L417	L417-Y421 WeakPolarHBondContact O-CD2 3.36Å
422	S	30.5	Very low	33.4	Very low	72 Å²	72	117.9 Å²	117.9	50%	0.503	67%	0.674	S	S	.	*	S	Bend	trans	-137.8	140.2	160.3	69	0	0	0	0	109.8	T420	T420-S422 VanDerWaalsContact C-N 3.3Å; T420-S422 PolarHBondContact O-N 3.32Å
423	F	31.5	Very low	33.6	Very low	210 Å²	210	120.2 Å²	120.2	92%	0.921	68%	0.681	S	S	*	*	S	Bend	trans	70.8	114.1	-174.5	-51.7	-83.1	0	0	0	116.8
424	G	29.8	Very low	33.8	Very low	75 Å²	75	124.9 Å²	124.9	77%	0.773	70%	0.699	S	S	*	*			trans	126.2	104.2	159.3	0	0	0	0	0	115.9
425	D	29.9	Very low	33.9	Very low	154 Å²	154	127 Å²	127	82%	0.824	71%	0.705	S	S	*	*			trans	-4.9	124.5	161.7	-52.6	-31.2	0	0	0	119	E427	D425-E427 PolarHBondContact O-N 2.74Å
426	P	32.3	Very low	34	Very low	134 Å²	134	126.6 Å²	126.6	87%	0.87	70%	0.703	S	S	*	*			trans	-91.6	72.6	-178.7	37.7	-35.4	0	0	0	113
427	E	29.4	Very low	34.3	Very low	176 Å²	176	127 Å²	127	82%	0.822	71%	0.705	S	S	*	*			trans	-133.8	136.2	159.8	-71.7	-165.1	166.8	0	0	110	D425	D425-E427 PolarHBondContact O-N 2.74Å
428	V	34.8	Very low	34.4	Very low	137 Å²	137	129.8 Å²	129.8	83%	0.83	71%	0.713	S	S	*	*			trans	66.9	127.6	-169.6	-146.8	0	0	0	0	110.4
429	V	35	Very low	34.5	Very low	104 Å²	104	133.5 Å²	133.5	63%	0.63	72%	0.716	S	S	*	*				-154.4	151.3	53.6	177	0	0	0	0	110.7	L433	V429-L433 HydrophobicContact CG1-CD1 3.8Å
430	D	30.4	Very low	34.8	Very low	132 Å²	132	134.2 Å²	134.2	71%	0.706	72%	0.719	S	S	*	*			trans	-62	157.5	-180	-64.2	-72.4	0	0	0	116.5	S432	D430-S432 PolarHBondContact O-N 3.34Å
431	N	33.4	Very low	34.9	Very low	172 Å²	172	136.3 Å²	136.3	92%	0.92	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.6	52.8	179	-77.7	-34.9	0	0	0	114.6
432	S	39	Very low	35.2	Very low	83 Å²	83	131 Å²	131	58%	0.58	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-122.8	-11.2	178.8	58	0	0	0	0	115	D430	D430-S432 PolarHBondContact O-N 3.34Å
433	L	36.3	Very low	35.3	Very low	105 Å²	105	135.2 Å²	135.2	55%	0.55	73%	0.727	S	S	.	*			trans	-100.1	-6.2	-169.6	-63.1	178.2	0	0	0	116.2	V429 I435	V429-L433 HydrophobicContact CG1-CD1 3.8Å; L433-I435 PolarHBondContact O-N 3.37Å; L433-I435 VanDerWaalsContact O-N 3.09Å
434	N	37.6	Very low	35.3	Very low	150 Å²	150	130.8 Å²	130.8	80%	0.802	72%	0.718	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74	4.4	-178.1	-80.2	-16.1	0	0	0	115.2
435	I	42.9	Very low	35.3	Very low	136 Å²	136	133.4 Å²	133.4	70%	0.697	72%	0.721	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.2	-25.2	-179.5	-66.8	175	0	0	0	112.4	L433	L433-I435 PolarHBondContact O-N 3.37Å; L433-I435 VanDerWaalsContact O-N 3.09Å
436	D	39.6	Very low	35.4	Very low	92 Å²	92	133.4 Å²	133.4	49%	0.492	72%	0.719	S	S	.	*	T	Hydrogen-bonded Turn	trans	-91.2	-24.4	-174.3	-74.2	-33.6	0	0	0	114.3	F438 K439 L440	D436-F438 VanDerWaalsContact C-N 3.3Å; D436-F438 PolarHBondContact O-N 3.07Å; D436-K439 PolarHBondContact O-N 3.07Å; D436-L440 PolarHBondContact O-N 3.37Å
437	L	39.6	Very low	35.3	Very low	126 Å²	126	131.8 Å²	131.8	66%	0.66	71%	0.711	S	S	*	*	H	α-helix	trans	-67.9	-31.2	178.5	-156.6	74.7	0	0	0	112.5	K439 L440	L437-K439 VanDerWaalsContact C-N 3.29Å; L437-K439 PolarHBondContact O-N 3.47Å; L437-L440 PolarHBondContact O-N 3.15Å
438	F	35.5	Very low	35.1	Very low	169 Å²	169	128 Å²	128	74%	0.741	70%	0.704	S	S	*	*	H	α-helix	trans	-72.2	-22.6	178.2	-134.6	-87.1	0	0	0	112.9	D436	D436-F438 VanDerWaalsContact C-N 3.3Å; D436-F438 PolarHBondContact O-N 3.07Å
439	K	36.3	Very low	34.7	Very low	146 Å²	146	128.6 Å²	128.6	64%	0.635	70%	0.702	S	S	*	*	H	α-helix	trans	-80	-31.9	176	-106.1	179.8	176.2	177	0	113.5	D436 L437 L441 T442	D436-K439 PolarHBondContact O-N 3.07Å; L437-K439 VanDerWaalsContact C-N 3.29Å; L437-K439 PolarHBondContact O-N 3.47Å; K439-L441 VanDerWaalsContact C-N 3.34Å; K439-T442 PolarHBondContact O-OG1 3.38Å
440	L	38.7	Very low	34.3	Very low	137 Å²	137	134.7 Å²	134.7	72%	0.717	71%	0.714	S	S	*	*	H	α-helix	trans	-75.3	-23.8	179.7	-88	158.1	0	0	0	113.1	D436 L437	D436-L440 PolarHBondContact O-N 3.37Å; L437-L440 PolarHBondContact O-N 3.15Å
441	L	38.4	Very low	34.4	Very low	144 Å²	144	136.4 Å²	136.4	75%	0.754	72%	0.722	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83	-12.3	177.8	-71	169	0	0	0	113.8	K439	K439-L441 VanDerWaalsContact C-N 3.34Å
442	T	38.9	Very low	34.2	Very low	98 Å²	98	135.3 Å²	135.3	60%	0.601	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.5	-4	-177.3	45	0	0	0	0	115.1	K439	K439-T442 PolarHBondContact O-OG1 3.38Å
443	E	32.1	Very low	33.8	Very low	160 Å²	160	137.4 Å²	137.4	75%	0.748	73%	0.725	S	S	*	*	S	Bend	trans	-128.7	42.1	-166.9	-63	-169	174.8	0	0	116
444	T	32.5	Very low	33.7	Very low	117 Å²	117	141 Å²	141	72%	0.718	74%	0.744	S	S	*	*			trans	-144.1	122.5	159.3	44.8	0	0	0	0	113.7
445	P	28.6	Very low	33.3	Very low	129 Å²	129	141.5 Å²	141.5	84%	0.838	75%	0.747	S	S	*	*			trans	-106.2	104.6	172.2	34.6	-25.5	0	0	0	111.2
446	I	32.5	Very low	33	Very low	154 Å²	154	142.6 Å²	142.6	79%	0.79	75%	0.754	S	S	*	*			trans	-132	134.6	176.5	-54.5	-175.1	0	0	0	112.6
447	S	30.4	Very low	32.7	Very low	101 Å²	101	146.6 Å²	146.6	71%	0.706	78%	0.775	S	S	*	*			trans	-63.9	154.2	-170.7	51.5	0	0	0	0	117.9
448	S	23.7	Very low	32.2	Very low	95 Å²	95	144.2 Å²	144.2	66%	0.664	77%	0.773	S	S	*	*			trans	-35.1	136.9	158.3	54	0	0	0	0	116.6
449	N	26.6	Very low	31.9	Very low	150 Å²	150	145.9 Å²	145.9	80%	0.802	78%	0.78	S	S	*	*				169.6	150.2	118.9	-84.6	-26.1	0	0	0	112.3
450	R	27.5	Very low	31.7	Very low	232 Å²	232	143.9 Å²	143.9	88%	0.875	79%	0.785	S	S	*	*			trans	74.3	110.9	177.6	-59.9	175.6	165	161.3	-4.7	116.7
451	I	32.9	Very low	31.2	Very low	168 Å²	168	143.6 Å²	143.6	86%	0.862	79%	0.789	S	S	*	*				-149.9	106.6	98.5	-85.3	145	0	0	0	106.3
452	D	27.7	Very low	30.8	Very low	149 Å²	149	143.1 Å²	143.1	80%	0.797	79%	0.787	S	S	*	*			trans	-100.8	126.9	164.9	-59.7	-53.1	0	0	0	107.4
453	T	32.2	Very low	30.4	Very low	128 Å²	128	144.1 Å²	144.1	79%	0.785	80%	0.795	S	S	*	*			trans	164.8	100.1	140.8	49.3	0	0	0	0	109.4
454	L	34.1	Very low	30.7	Very low	179 Å²	179	143.6 Å²	143.6	94%	0.937	80%	0.798	S	S	*	*			trans	167.3	60.3	145.3	-91.2	162.6	0	0	0	109.7
455	D	29.3	Very low	30.6	Very low	162 Å²	162	144.6 Å²	144.6	87%	0.866	80%	0.799	S	S	*	*			trans	-92.9	125.3	156.9	-91.5	-34.8	0	0	0	108
456	D	35	Very low	30.9	Very low	159 Å²	159	146.6 Å²	146.6	85%	0.85	80%	0.802	S	S	*	*			trans	172.4	95.1	143	-99	-23.1	0	0	0	109
457	L	34.4	Very low	31	Very low	176 Å²	176	144.2 Å²	144.2	92%	0.921	80%	0.799	S	S	*	*			trans	-177.4	116.8	141.4	-98.6	159.3	0	0	0	110.7
458	A	29.4	Very low	31	Very low	76 Å²	76	145.2 Å²	145.2	63%	0.628	80%	0.8	S	S	*	*			trans	-23.1	147.8	169.9	0	0	0	0	0	117.1
459	F	28.7	Very low	31.6	Very low	203 Å²	203	146.7 Å²	146.7	89%	0.89	81%	0.806	S	S	*	*				-152	144.6	58.1	-100.5	-93.6	0	0	0	115.5
460	S	31.9	Very low	31.9	Very low	104 Å²	104	147.8 Å²	147.8	73%	0.727	81%	0.806	S	S	*	*			trans	-73.8	143.3	169.3	55.7	0	0	0	0	112.6
461	T	28.1	Very low	32.3	Very low	132 Å²	132	143.4 Å²	143.4	81%	0.81	80%	0.799	S	S	*	*			trans	-61.5	133.2	174.4	51.1	0	0	0	0	113.9
462	N	30.1	Very low	32.2	Very low	134 Å²	134	141.8 Å²	141.8	72%	0.717	80%	0.799	S	S	*	*			trans	-121.7	116.7	156.6	-94.9	-21.5	0	0	0	108.5	N464	N462-N464 VanDerWaalsContact C-N 3.25Å; N462-N464 PolarHBondContact O-N 2.9Å; N462-N464 VanDerWaalsContact O-N 3.11Å
463	P	31.6	Very low	32.6	Very low	119 Å²	119	138.4 Å²	138.4	77%	0.773	80%	0.799	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.1	29.2	-168.6	35.8	-38	0	0	0	114.6
464	N	36.4	Very low	32.7	Very low	148 Å²	148	138.6 Å²	138.6	79%	0.791	80%	0.795	S	S	*	*	T	Hydrogen-bonded Turn	trans	-126	-8.1	-173.7	-77.4	-23.8	0	0	0	115.6	N462	N462-N464 VanDerWaalsContact C-N 3.25Å; N462-N464 PolarHBondContact O-N 2.9Å; N462-N464 VanDerWaalsContact O-N 3.11Å
465	D	32.3	Very low	32.7	Very low	138 Å²	138	138.1 Å²	138.1	74%	0.738	79%	0.793	S	S	*	*			trans	-104	78.1	-179.6	-73.9	-44.3	0	0	0	112
466	L	34.5	Very low	33.1	Very low	172 Å²	172	137.3 Å²	137.3	90%	0.901	78%	0.784	S	S	*	*			trans	-115.8	76.9	157	-98	89.2	0	0	0	109.7
467	S	33.5	Very low	33.1	Very low	104 Å²	104	132.4 Å²	132.4	73%	0.727	77%	0.771	S	S	*	*			trans	-77.3	118.1	163.5	59.2	0	0	0	0	109.9	T469	S467-T469 PolarHBondContact O-N 2.87Å
468	T	31.5	Very low	33.2	Very low	121 Å²	121	129.5 Å²	129.5	74%	0.742	76%	0.762	S	S	*	*			trans	-56.3	111.3	175.8	42.9	0	0	0	0	112.8	E470	T468-E470 PolarHBondContact O-N 3.44Å
469	T	36.5	Very low	33.3	Very low	127 Å²	127	132.1 Å²	132.1	78%	0.779	77%	0.77	S	S	*	*			trans	-86.5	95.4	158.5	49.3	0	0	0	0	109.1	S467 I471	S467-T469 PolarHBondContact O-N 2.87Å; T469-I471 PolarHBondContact O-N 2.94Å
470	E	31.5	Very low	33.6	Very low	173 Å²	173	127.8 Å²	127.8	81%	0.808	76%	0.761	S	S	*	*			trans	-69.4	114.7	176.6	-62.3	-177.9	162.2	0	0	110.5	T468	T468-E470 PolarHBondContact O-N 3.44Å
471	I	36.1	Very low	33.5	Very low	140 Å²	140	130.2 Å²	130.2	72%	0.718	77%	0.765	S	S	*	*			trans	-95.4	118.6	167.3	-60.3	175.3	0	0	0	107.3	T469 G473	T469-I471 PolarHBondContact O-N 2.94Å; I471-G473 PolarHBondContact O-N 2.98Å; I471-G473 VanDerWaalsContact O-N 3.1Å
472	P	30.9	Very low	33.7	Very low	134 Å²	134	131.7 Å²	131.7	87%	0.87	77%	0.768	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.5	113.9	-179.9	-21.7	33.1	0	0	0	111.6
473	G	36.3	Very low	33.8	Very low	77 Å²	77	132.4 Å²	132.4	79%	0.794	77%	0.771	S	S	*	*	T	Hydrogen-bonded Turn	trans	135.6	-2.7	168.1	0	0	0	0	0	118.1	I471	I471-G473 PolarHBondContact O-N 2.98Å; I471-G473 VanDerWaalsContact O-N 3.1Å
474	L	34.9	Very low	34	Very low	133 Å²	133	134.5 Å²	134.5	70%	0.696	77%	0.774	S	S	*	*			trans	-127.7	78	-174.9	-98.9	147.7	0	0	0	112.9	E476	L474-E476 PolarHBondContact O-N 3.28Å
475	N	34.6	Very low	33.9	Very low	168 Å²	168	133.5 Å²	133.5	90%	0.898	77%	0.774	S	S	*	*			trans	-89.2	78.3	174.5	-79	-3.3	0	0	0	112.2
476	E	37.8	Very low	34	Very low	145 Å²	145	134.6 Å²	134.6	68%	0.678	78%	0.78	S	S	*	*			trans	-92.4	98.6	154.5	-78	-83.5	161.3	0	0	107.4	L474	L474-E476 PolarHBondContact O-N 3.28Å
477	G	34.5	Very low	34	Very low	56 Å²	56	131.6 Å²	131.6	58%	0.577	77%	0.769	S	S	*	*			trans	-65.5	150	179.2	0	0	0	0	0	112.1	V479	G477-V479 PolarHBondContact O-N 2.96Å
478	P	36.2	Very low	34.3	Very low	115 Å²	115	133.6 Å²	133.6	75%	0.747	77%	0.771	S	S	*	*			trans	-60	136.7	-173.9	24.9	-34.2	0	0	0	111.6	T480	P478-T480 PolarHBondContact O-N 3.11Å
479	V	31.7	Very low	34.8	Very low	131 Å²	131	133.6 Å²	133.6	79%	0.794	77%	0.767	S	S	*	*			trans	-68.6	97.6	174.4	-179.5	0	0	0	0	108.6	G477	G477-V479 PolarHBondContact O-N 2.96Å
480	T	34.4	Very low	35.4	Very low	113 Å²	113	132.5 Å²	132.5	69%	0.693	76%	0.762	S	S	*	*			trans	-119.3	155.9	168.8	48.3	0	0	0	0	111.2	P478	P478-T480 PolarHBondContact O-N 3.11Å
481	D	30.5	Very low	36.1	Very low	154 Å²	154	131.1 Å²	131.1	82%	0.824	76%	0.756	S	S	*	*			trans	-59.6	157.4	-154.4	-58	-63	0	0	0	117.3	N483	D481-N483 PolarHBondContact O-N 3.43Å
482	L	32.3	Very low	36.7	Very low	164 Å²	164	129 Å²	129	86%	0.859	74%	0.743	S	S	*	*	S	Bend	trans	-59.4	99.1	164.2	-69.2	166.3	0	0	0	110.3
483	N	31.7	Very low	37.1	Very low	148 Å²	148	131.7 Å²	131.7	79%	0.791	74%	0.735	S	S	*	*				168.5	151.9	128.7	-86.7	-43.1	0	0	0	112.7	D481	D481-N483 PolarHBondContact O-N 3.43Å
484	I	34.9	Very low	37.4	Very low	163 Å²	163	134.9 Å²	134.9	84%	0.836	73%	0.73	S	S	*	*			trans	77.4	119.4	172	-54	156.6	0	0	0	114.6
485	T	35.5	Very low	37.9	Very low	127 Å²	127	134.4 Å²	134.4	78%	0.779	72%	0.722	S	S	*	*			trans	-83.8	135.6	169.2	45.3	0	0	0	0	110.9	T487	T485-T487 PolarHBondContact O-N 2.89Å; T485-T487 VanDerWaalsContact O-N 3.16Å
486	D	34	Very low	38.3	Very low	162 Å²	162	130 Å²	130	87%	0.866	70%	0.698	S	S	*	*	S	Bend	trans	-65.9	108.1	176.1	-69.1	-57.2	0	0	0	113.5
487	T	35.5	Very low	38.4	Very low	109 Å²	109	130.3 Å²	130.3	67%	0.669	70%	0.697	S	S	*	*			trans	-165.5	131.3	130.2	36.4	0	0	0	0	106.1	T485	T485-T487 PolarHBondContact O-N 2.89Å; T485-T487 VanDerWaalsContact O-N 3.16Å
488	D	39.4	Very low	38.7	Very low	145 Å²	145	134.4 Å²	134.4	78%	0.775	71%	0.705	S	S	*	*			trans	155.5	152.6	144.6	-73.6	-14.1	0	0	0	112
489	D	42.5	Very low	38.7	Very low	121 Å²	121	137.9 Å²	137.9	65%	0.647	70%	0.704	S	S	*	*			trans	-64.1	153.4	-158.9	-82	-61.9	0	0	0	117	E491 E492	D489-E491 PolarHBondContact O-N 3.41Å; D489-E491 VanDerWaalsContact O-N 3.08Å; D489-E492 PolarHBondContact O-N 2.99Å; D489-E492 VanDerWaalsContact O-N 3.12Å
490	P	48	Very low	38.9	Very low	105 Å²	105	136.9 Å²	136.9	68%	0.682	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.8	-21.5	-178.9	23.7	-33.8	0	0	0	114.7	R493	P490-R493 WeakPolarHBondContact O-CB 3.37Å
491	E	47.1	Very low	39	Very low	144 Å²	144	135.9 Å²	135.9	67%	0.673	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.1	-26.8	176.7	-65.9	-163.7	171.1	0	0	114.4	D489 R493	D489-E491 PolarHBondContact O-N 3.41Å; D489-E491 VanDerWaalsContact O-N 3.08Å; E491-R493 PolarHBondContact O-N 3.14Å
492	E	47.3	Very low	39.5	Very low	96 Å²	96	139.6 Å²	139.6	45%	0.449	70%	0.702	S	S	.	*	H	α-helix	trans	-67.3	-30.6	171.9	-89.6	-95.1	136.9	0	0	110.6	D489 E494 K495 N496	D489-E492 PolarHBondContact O-N 2.99Å; D489-E492 VanDerWaalsContact O-N 3.12Å; E492-E494 VanDerWaalsContact C-N 3.29Å; E492-E494 PolarHBondContact O-N 2.83Å; E492-K495 PolarHBondContact O-N 2.73Å; E492-N496 WeakPolarHBondContact O-CB 3.43Å; E492-N496 PolarHBondContact O-N 2.75Å; E492-N496 PolarHBondContact O-ND2 3.03Å; E492-N496 PolarHBondContact OE2-ND2 2.74Å
493	R	41	Very low	40.3	Very low	190 Å²	190	137.8 Å²	137.8	72%	0.717	70%	0.698	S	S	*	*	H	α-helix	trans	-66.5	-25.9	-175.9	-151.3	173.5	-170.2	-179.9	5	113.7	P490 E491 K497	P490-R493 WeakPolarHBondContact O-CB 3.37Å; E491-R493 PolarHBondContact O-N 3.14Å; R493-K497 WeakPolarHBondContact O-CG 3.43Å
494	E	42.7	Very low	40.9	Very low	144 Å²	144	136.7 Å²	136.7	67%	0.673	69%	0.691	S	S	*	*	H	α-helix	trans	-82.6	-40.8	170.4	-66.8	-140	131.9	0	0	112.5	E492 N496 K497 L498	E492-E494 VanDerWaalsContact C-N 3.29Å; E492-E494 PolarHBondContact O-N 2.83Å; E494-N496 VanDerWaalsContact C-N 3.29Å; E494-N496 PolarHBondContact O-N 2.81Å; E494-K497 PolarHBondContact O-N 2.92Å; E494-L498 PolarHBondContact O-N 2.98Å
495	K	44.7	Very low	41.8	Very low	122 Å²	122	133.1 Å²	133.1	53%	0.53	68%	0.679	S	S	.	*	H	α-helix	trans	-64.2	-33.8	177.6	-70.7	167.5	-175.1	155.1	0	112.2	E492 L498	E492-K495 PolarHBondContact O-N 2.73Å; K495-L498 PolarHBondContact O-N 2.78Å
496	N	42	Very low	42.8	Very low	76 Å²	76	136.1 Å²	136.1	41%	0.406	68%	0.681	S	S	.	*	H	α-helix	trans	-81	-26.4	177.8	-72.4	-36	0	0	0	113.5	E492 E494 L498 R499	E492-N496 WeakPolarHBondContact O-CB 3.43Å; E492-N496 PolarHBondContact O-N 2.75Å; E492-N496 PolarHBondContact O-ND2 3.03Å; E492-N496 PolarHBondContact OE2-ND2 2.74Å; E494-N496 VanDerWaalsContact C-N 3.29Å; E494-N496 PolarHBondContact O-N 2.81Å; N496-L498 PolarHBondContact O-N 2.71Å; N496-R499 PolarHBondContact O-N 2.85Å
497	K	40.4	Very low	44.2	Very low	151 Å²	151	135.8 Å²	135.8	66%	0.657	67%	0.674	S	S	*	*	H	α-helix	trans	-62.5	-25.5	167.6	-82.2	174.8	178.6	179	0	113.2	R493 E494	R493-K497 WeakPolarHBondContact O-CG 3.43Å; E494-K497 PolarHBondContact O-N 2.92Å
498	L	41	Very low	44.8	Very low	142 Å²	142	136.1 Å²	136.1	74%	0.743	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87	-2.1	174.6	-73.9	160.8	0	0	0	113.9	E494 K495 N496	E494-L498 PolarHBondContact O-N 2.98Å; K495-L498 PolarHBondContact O-N 2.78Å; N496-L498 PolarHBondContact O-N 2.71Å
499	R	36.5	Very low	45.5	Very low	189 Å²	189	132 Å²	132	71%	0.713	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.6	-13.8	-176.8	-76.2	-175.6	172	-151	0.6	115.5	N496 S501	N496-R499 PolarHBondContact O-N 2.85Å; R499-S501 VanDerWaalsContact C-N 3.3Å; R499-S501 PolarHBondContact O-N 3.19Å
500	S	34.9	Very low	46.2	Very low	110 Å²	110	129 Å²	129	77%	0.769	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.1	-0.2	178.4	64	0	0	0	0	115
501	S	37.3	Very low	46.8	Very low	91 Å²	91	129.1 Å²	129.1	64%	0.636	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.4	29.8	179	59.1	0	0	0	0	114.2	R499 T503	R499-S501 VanDerWaalsContact C-N 3.3Å; R499-S501 PolarHBondContact O-N 3.19Å; S501-T503 PolarHBondContact O-N 2.88Å
502	R	40.6	Very low	46.7	Very low	232 Å²	232	131.4 Å²	131.4	88%	0.875	64%	0.642	S	S	*	*			trans	-76.2	94.8	170.9	-81.7	-170.2	170.3	-172.6	-3.1	111.1
503	T	48.5	Very low	46.8	Very low	127 Å²	127	130.7 Å²	130.7	78%	0.779	65%	0.653	S	S	*	*	P	Polyproline II helix	trans	-48.2	136.2	165.9	43.7	0	0	0	0	111.6	S501	S501-T503 PolarHBondContact O-N 2.88Å
504	I	44.8	Very low	47.5	Very low	125 Å²	125	125.2 Å²	125.2	64%	0.641	64%	0.643	S	S	*	*	P	Polyproline II helix	trans	-57.5	127.3	176.2	-59.5	168	0	0	0	108.7	K506 F508	I504-K506 PolarHBondContact O-N 3.47Å; I504-F508 HydrophobicContact CG2-CB 4.35Å; I504-F508 HydrophobicContact CG2-CD1 4.18Å
505	P	53.4	Low	47.6	Very low	88 Å²	88	124 Å²	124	57%	0.571	65%	0.646	S	S	*	*	P	Polyproline II helix	trans	-58.1	129.1	174.1	-23.9	34	0	0	0	110.4	E507 F508 A509	P505-E507 PolarHBondContact O-N 2.87Å; P505-F508 WeakPolarHBondContact O-CB 3.36Å; P505-F508 PolarHBondContact O-N 3.07Å; P505-A509 PolarHBondContact O-N 3.44Å
506	K	56.7	Low	47.2	Very low	190 Å²	190	129.8 Å²	129.8	83%	0.826	66%	0.664	S	S	*	*	H	α-helix	trans	-56.7	-29.1	-176.2	-70.1	-178	176.6	179.4	0	113.1	I504 F508 A509 A510	I504-K506 PolarHBondContact O-N 3.47Å; K506-F508 VanDerWaalsContact C-N 3.35Å; K506-A509 PolarHBondContact O-N 3.3Å; K506-A510 PolarHBondContact O-N 3.3Å
507	E	63.7	Low	47	Very low	155 Å²	155	132.9 Å²	132.9	72%	0.724	68%	0.679	S	S	*	*	H	α-helix	trans	-65.9	-33.2	175.6	-62.7	178.2	158.3	0	0	113	P505 A510 N511	P505-E507 PolarHBondContact O-N 2.87Å; E507-A510 PolarHBondContact O-N 3.25Å; E507-N511 WeakPolarHBondContact O-CB 3.47Å; E507-N511 PolarHBondContact O-N 2.87Å
508	F	48.9	Very low	46.7	Very low	116 Å²	116	132 Å²	132	51%	0.509	69%	0.687	S	S	.	*	H	α-helix	trans	-71.6	-40	176.9	-168.7	-105.2	0	0	0	111.5	I504 P505 K506 A510 N511 W512	I504-F508 HydrophobicContact CG2-CB 4.35Å; I504-F508 HydrophobicContact CG2-CD1 4.18Å; P505-F508 WeakPolarHBondContact O-CB 3.36Å; P505-F508 PolarHBondContact O-N 3.07Å; K506-F508 VanDerWaalsContact C-N 3.35Å; F508-A510 VanDerWaalsContact C-N 3.35Å; F508-N511 PolarHBondContact O-N 3.2Å; F508-W512 HydrophobicContact CD1-CE3 4.27Å; F508-W512 AromaticContact CE1-CE3 3.44Å; F508-W512 HydrophobicContact CE1-CE3 3.44Å; F508-W512 VanDerWaalsContact CE1-CE3 3.44Å; F508-W512 AromaticContact CE1-CZ3 3.58Å; F508-W512 HydrophobicContact CE1-CZ3 3.58Å; F508-W512 AromaticContact CZ-CE3 3.64Å; F508-W512 HydrophobicContact CZ-CE3 3.64Å; F508-W512 AromaticContact CZ-CZ3 3.61Å; F508-W512 HydrophobicContact CZ-CZ3 3.61Å; F508-W512 WeakPolarHBondContact O-CB 3.42Å; F508-W512 PolarHBondContact O-N 3.31Å
509	A	52.5	Low	46.3	Very low	58 Å²	58	129.2 Å²	129.2	48%	0.479	68%	0.684	S	S	.	*	H	α-helix	trans	-65.4	-37.3	173.6	0	0	0	0	0	112.3	P505 K506 A513	P505-A509 PolarHBondContact O-N 3.44Å; K506-A509 PolarHBondContact O-N 3.3Å; A509-A513 PolarHBondContact O-N 3.3Å
510	A	59.1	Low	46.1	Very low	59 Å²	59	128.8 Å²	128.8	49%	0.488	69%	0.692	S	S	.	*	H	α-helix	trans	-65.5	-44.5	174.1	0	0	0	0	0	112.2	K506 E507 F508 A513 S514	K506-A510 PolarHBondContact O-N 3.3Å; E507-A510 PolarHBondContact O-N 3.25Å; F508-A510 VanDerWaalsContact C-N 3.35Å; A510-A513 PolarHBondContact O-N 3.5Å; A510-S514 PolarHBondContact O-N 3Å
511	N	59	Low	45.9	Very low	106 Å²	106	129.3 Å²	129.3	57%	0.567	69%	0.694	S	S	*	*	H	α-helix	trans	-67.5	-40.3	178.9	-75.3	-11.8	0	0	0	112.3	E507 F508 A513 S514 T515	E507-N511 WeakPolarHBondContact O-CB 3.47Å; E507-N511 PolarHBondContact O-N 2.87Å; F508-N511 PolarHBondContact O-N 3.2Å; N511-A513 VanDerWaalsContact C-N 3.26Å; N511-A513 PolarHBondContact O-N 2.82Å; N511-S514 WeakPolarHBondContact O-CB 3.29Å; N511-S514 PolarHBondContact O-N 3.02Å; N511-S514 PolarHBondContact O-OG 2.93Å; N511-T515 PolarHBondContact O-OG1 3.18Å
512	W	44.8	Very low	45.7	Very low	192 Å²	192	131.5 Å²	131.5	73%	0.727	70%	0.703	S	S	*	*	H	α-helix	trans	-62.8	-32.4	176.3	-156.3	-60.2	0	0	0	112.4	F508 S514	F508-W512 HydrophobicContact CD1-CE3 4.27Å; F508-W512 AromaticContact CE1-CE3 3.44Å; F508-W512 HydrophobicContact CE1-CE3 3.44Å; F508-W512 VanDerWaalsContact CE1-CE3 3.44Å; F508-W512 AromaticContact CE1-CZ3 3.58Å; F508-W512 HydrophobicContact CE1-CZ3 3.58Å; F508-W512 AromaticContact CZ-CE3 3.64Å; F508-W512 HydrophobicContact CZ-CE3 3.64Å; F508-W512 AromaticContact CZ-CZ3 3.61Å; F508-W512 HydrophobicContact CZ-CZ3 3.61Å; F508-W512 WeakPolarHBondContact O-CB 3.42Å; F508-W512 PolarHBondContact O-N 3.31Å; W512-S514 VanDerWaalsContact C-N 3.28Å; W512-S514 PolarHBondContact O-N 3.42Å
513	A	50.9	Low	45.5	Very low	82 Å²	82	126.4 Å²	126.4	68%	0.678	70%	0.698	S	S	*	*	H	α-helix	trans	-70.9	-21.6	174.2	0	0	0	0	0	113.5	A509 A510 N511	A509-A513 PolarHBondContact O-N 3.3Å; A510-A513 PolarHBondContact O-N 3.5Å; N511-A513 VanDerWaalsContact C-N 3.26Å; N511-A513 PolarHBondContact O-N 2.82Å
514	S	54.3	Low	44.6	Very low	74 Å²	74	129.6 Å²	129.6	52%	0.517	71%	0.706	S	S	.	*	H	α-helix	trans	-84.1	-20.9	-175.1	76	0	0	0	0	114.7	A510 N511 W512 R516	A510-S514 PolarHBondContact O-N 3Å; N511-S514 WeakPolarHBondContact O-CB 3.29Å; N511-S514 PolarHBondContact O-N 3.02Å; N511-S514 PolarHBondContact O-OG 2.93Å; W512-S514 VanDerWaalsContact C-N 3.28Å; W512-S514 PolarHBondContact O-N 3.42Å; S514-R516 PolarHBondContact O-N 3.37Å; S514-R516 VanDerWaalsContact O-N 3.12Å
515	T	46.7	Very low	44.2	Very low	118 Å²	118	132 Å²	132	72%	0.724	72%	0.717	S	S	*	*			trans	-82	16.2	-170.1	-17.8	0	0	0	0	115.2	N511	N511-T515 PolarHBondContact O-OG1 3.18Å
516	R	36	Very low	43.5	Very low	244 Å²	244	132.5 Å²	132.5	92%	0.921	73%	0.728	S	S	*	*			trans	-102.2	88.3	173.6	-112.8	-174.5	178.3	175.9	0.8	110.7	S514	S514-R516 PolarHBondContact O-N 3.37Å; S514-R516 VanDerWaalsContact O-N 3.12Å
517	I	37.7	Very low	43.1	Very low	141 Å²	141	129.8 Å²	129.8	72%	0.723	73%	0.728	S	S	*	*			trans	-121.1	115	176.6	-72.3	-178.4	0	0	0	108.7
518	T	33.6	Very low	42.6	Very low	134 Å²	134	126.5 Å²	126.5	82%	0.822	72%	0.72	S	S	*	*			trans	44.8	134.5	150	-7.5	0	0	0	0	118.6
519	A	31.9	Very low	42.9	Very low	82 Å²	82	124.2 Å²	124.2	68%	0.678	72%	0.718	S	S	*	*			cis	-159.8	175.6	21.9	0	0	0	0	0	108.6
520	M	32.2	Very low	43.4	Very low	180 Å²	180	126.8 Å²	126.8	89%	0.887	73%	0.73	S	S	*	*			cis	-140.6	163.1	11.5	-78.8	-170.3	166.1	0	0	110.6
521	P	31.4	Very low	43.8	Very low	122 Å²	122	128 Å²	128	79%	0.792	74%	0.735	S	S	*	*			trans	-96.8	148.1	-175.4	36.7	-33	0	0	0	114.4
522	T	34	Very low	44.1	Very low	137 Å²	137	125.2 Å²	125.2	84%	0.84	73%	0.726	S	S	*	*			trans	-142	112	157.4	-65.8	0	0	0	0	110.4
523	V	34.5	Very low	44.9	Very low	125 Å²	125	120.8 Å²	120.8	76%	0.758	72%	0.716	S	S	*	*			trans	35	105.1	155.3	-169.7	0	0	0	0	118.2
524	M	31.2	Very low	45.5	Very low	193 Å²	193	119.8 Å²	119.8	95%	0.951	71%	0.708	S	S	*	*	P	Polyproline II helix	trans	-75	130.1	157.5	-74	-171.9	171.5	0	0	110.8
525	M	35.2	Very low	46	Very low	176 Å²	176	119.2 Å²	119.2	87%	0.867	71%	0.707	S	S	*	*	P	Polyproline II helix	trans	-103.6	138.9	155	-85.4	-68.1	-147.3	0	0	108.7
526	A	39.1	Very low	46.6	Very low	99 Å²	99	116.4 Å²	116.4	82%	0.818	70%	0.697	S	S	*	*	P	Polyproline II helix	trans	-68.9	138.8	-174.4	0	0	0	0	0	112.3
527	T	49.4	Very low	47.7	Very low	133 Å²	133	107.7 Å²	107.7	82%	0.816	68%	0.677	S	S	*	*	P	Polyproline II helix	trans	-70.5	132.5	171.5	41.1	0	0	0	0	110.4
528	P	53.3	Low	48.8	Very low	85 Å²	85	104 Å²	104	55%	0.552	67%	0.667	S	S	*	*	P	Polyproline II helix	trans	-69.9	140.5	179.2	27.9	-33.7	0	0	0	111.1	A532 I533	P528-A532 HydrophobicContact CB-CB 4.15Å; P528-I533 HydrophobicContact CG-CD1 4.47Å; P528-I533 HydrophobicContact CG-CG1 4.14Å
529	S	54.8	Low	50.2	Low	69 Å²	69	100.6 Å²	100.6	48%	0.483	65%	0.653	S	S	.	*	P	Polyproline II helix	trans	-60.7	152.1	175	73.6	0	0	0	0	111.6	S531 A532 I533	S529-S531 PolarHBondContact O-N 3.35Å; S529-S531 PolarHBondContact OG-OG 2.9Å; S529-S531 VanDerWaalsContact OG-OG 3.1Å; S529-A532 WeakPolarHBondContact O-CB 3.49Å; S529-A532 PolarHBondContact O-N 2.95Å; S529-I533 PolarHBondContact O-N 3.3Å
530	P	62.4	Low	51.4	Low	111 Å²	111	99.5 Å²	99.5	72%	0.721	64%	0.644	S	S	*	*	H	α-helix	trans	-58	-24.7	-173.7	19.3	-32	0	0	0	114.8	I533 A534	P530-I533 PolarHBondContact O-N 2.86Å; P530-A534 PolarHBondContact O-N 3.4Å; P530-A534 VanDerWaalsContact O-N 3.15Å
531	S	68.4	Low	52.4	Low	86 Å²	86	94.1 Å²	94.1	60%	0.601	63%	0.628	S	S	*	*	H	α-helix	trans	-66.2	-34.5	173.9	59.1	0	0	0	0	113.3	S529 A535	S529-S531 PolarHBondContact O-N 3.35Å; S529-S531 PolarHBondContact OG-OG 2.9Å; S529-S531 VanDerWaalsContact OG-OG 3.1Å; S531-A535 PolarHBondContact O-N 3.07Å
532	A	65.4	Low	53.6	Low	46 Å²	46	91.1 Å²	91.1	38%	0.38	61%	0.613	S	S	.	*	H	α-helix	trans	-74	-31.9	177.5	0	0	0	0	0	112	P528 S529 A535 A536	P528-A532 HydrophobicContact CB-CB 4.15Å; S529-A532 WeakPolarHBondContact O-CB 3.49Å; S529-A532 PolarHBondContact O-N 2.95Å; A532-A535 PolarHBondContact O-N 3.39Å; A532-A536 WeakPolarHBondContact O-CB 3.3Å; A532-A536 PolarHBondContact O-N 2.67Å
533	I	61.3	Low	54.4	Low	99 Å²	99	87.6 Å²	87.6	51%	0.508	60%	0.598	S	S	.	*	H	α-helix	trans	-67.2	-42.8	174.2	-55.9	178.9	0	0	0	110.1	P528 S529 P530 A536 A537	P528-I533 HydrophobicContact CG-CD1 4.47Å; P528-I533 HydrophobicContact CG-CG1 4.14Å; S529-I533 PolarHBondContact O-N 3.3Å; P530-I533 PolarHBondContact O-N 2.86Å; I533-A536 PolarHBondContact O-N 3.34Å; I533-A537 WeakPolarHBondContact O-CB 3.45Å; I533-A537 PolarHBondContact O-N 3.46Å
534	A	62.2	Low	55.4	Low	62 Å²	62	86.8 Å²	86.8	51%	0.512	59%	0.593	S	S	.	*	H	α-helix	trans	-63	-42	174.5	0	0	0	0	0	112.6	P530 A537 A538	P530-A534 PolarHBondContact O-N 3.4Å; P530-A534 VanDerWaalsContact O-N 3.15Å; A534-A537 PolarHBondContact O-N 3.49Å; A534-A538 PolarHBondContact O-N 3.44Å
535	A	65	Low	56.3	Low	61 Å²	61	82 Å²	82	50%	0.504	58%	0.578	S	S	.	*	H	α-helix	trans	-64.8	-39.8	175.8	0	0	0	0	0	112.6	S531 A532 A538 A539	S531-A535 PolarHBondContact O-N 3.07Å; A532-A535 PolarHBondContact O-N 3.39Å; A535-A538 PolarHBondContact O-N 3.16Å; A535-A539 WeakPolarHBondContact O-CB 3.45Å; A535-A539 PolarHBondContact O-N 3.03Å
536	A	60.3	Low	56.9	Low	60 Å²	60	79.9 Å²	79.9	50%	0.496	57%	0.571	S	S	.	*	H	α-helix	trans	-66.2	-39.1	175.4	0	0	0	0	0	112.3	A532 I533 A539 A540	A532-A536 WeakPolarHBondContact O-CB 3.3Å; A532-A536 PolarHBondContact O-N 2.67Å; I533-A536 PolarHBondContact O-N 3.34Å; A536-A539 PolarHBondContact O-N 2.88Å; A536-A540 WeakPolarHBondContact O-CB 3.4Å; A536-A540 PolarHBondContact O-N 2.98Å
537	A	58	Low	57	Low	61 Å²	61	81.9 Å²	81.9	50%	0.504	57%	0.567	S	S	.	*	H	α-helix	trans	-64.7	-41.5	174.4	0	0	0	0	0	112.2	I533 A534 A540 A541	I533-A537 WeakPolarHBondContact O-CB 3.45Å; I533-A537 PolarHBondContact O-N 3.46Å; A534-A537 PolarHBondContact O-N 3.49Å; A537-A540 PolarHBondContact O-N 2.96Å; A537-A541 PolarHBondContact O-N 2.91Å
538	A	62.1	Low	56.6	Low	63 Å²	63	83.5 Å²	83.5	52%	0.521	57%	0.571	S	S	.	*	H	α-helix	trans	-64.7	-40.1	174.8	0	0	0	0	0	112.5	A534 A535 A541 A542	A534-A538 PolarHBondContact O-N 3.44Å; A535-A538 PolarHBondContact O-N 3.16Å; A538-A541 PolarHBondContact O-N 3.1Å; A538-A542 PolarHBondContact O-N 3.48Å
539	A	61.6	Low	55.9	Low	63 Å²	63	83.3 Å²	83.3	52%	0.521	58%	0.576	S	S	.	*	H	α-helix	trans	-66	-38.4	174.6	0	0	0	0	0	112.5	A535 A536 A542 A543	A535-A539 WeakPolarHBondContact O-CB 3.45Å; A535-A539 PolarHBondContact O-N 3.03Å; A536-A539 PolarHBondContact O-N 2.88Å; A539-A542 PolarHBondContact O-N 3.12Å; A539-A543 PolarHBondContact O-N 3.08Å; A539-A543 VanDerWaalsContact O-N 3.13Å
540	A	57.1	Low	55	Low	59 Å²	59	86.9 Å²	86.9	49%	0.488	60%	0.595	S	S	.	*	H	α-helix	trans	-65.1	-41.7	174.3	0	0	0	0	0	112	A536 A537 A542 A543 V544	A536-A540 WeakPolarHBondContact O-CB 3.4Å; A536-A540 PolarHBondContact O-N 2.98Å; A537-A540 PolarHBondContact O-N 2.96Å; A540-A542 PolarHBondContact O-N 2.8Å; A540-A543 PolarHBondContact O-N 3.45Å; A540-V544 PolarHBondContact O-N 3.49Å
541	A	54.7	Low	54.1	Low	66 Å²	66	87.3 Å²	87.3	55%	0.545	60%	0.598	S	S	.	*	H	α-helix	trans	-62.2	-41.2	175	0	0	0	0	0	112.3	A537 A538 A543 V544	A537-A541 PolarHBondContact O-N 2.91Å; A538-A541 PolarHBondContact O-N 3.1Å; A541-A543 VanDerWaalsContact C-N 3.28Å; A541-A543 PolarHBondContact O-N 2.99Å; A541-V544 PolarHBondContact O-N 3.34Å
542	A	55.7	Low	52.6	Low	59 Å²	59	92.3 Å²	92.3	49%	0.488	61%	0.612	S	S	.	*	H	α-helix	trans	-68.5	-22.9	176.4	0	0	0	0	0	113.9	A538 A539 A540 S545	A538-A542 PolarHBondContact O-N 3.48Å; A539-A542 PolarHBondContact O-N 3.12Å; A540-A542 PolarHBondContact O-N 2.8Å; A542-S545 PolarHBondContact O-OG 2.71Å
543	A	51.4	Low	51.2	Low	63 Å²	63	101.1 Å²	101.1	52%	0.521	64%	0.637	S	S	.	*	H	α-helix	trans	-74.8	-31.2	174.6	0	0	0	0	0	112.6	A539 A540 A541	A539-A543 PolarHBondContact O-N 3.08Å; A539-A543 VanDerWaalsContact O-N 3.13Å; A540-A543 PolarHBondContact O-N 3.45Å; A541-A543 VanDerWaalsContact C-N 3.28Å; A541-A543 PolarHBondContact O-N 2.99Å
544	V	54.8	Low	50.4	Low	109 Å²	109	104.1 Å²	104.1	66%	0.661	65%	0.653	S	S	*	*	H	α-helix	trans	-71	-29.9	-178	175	0	0	0	0	112.3	A540 A541 N546	A540-V544 PolarHBondContact O-N 3.49Å; A541-V544 PolarHBondContact O-N 3.34Å; V544-N546 VanDerWaalsContact C-N 3.27Å; V544-N546 PolarHBondContact O-N 2.92Å
545	S	51	Low	49.7	Very low	91 Å²	91	106.4 Å²	106.4	64%	0.636	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73	-9.4	-177.7	57.4	0	0	0	0	115.6	A542	A542-S545 PolarHBondContact O-OG 2.71Å
546	N	46.1	Very low	48.8	Very low	133 Å²	133	109.6 Å²	109.6	71%	0.711	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.8	2.5	-177.8	-80.8	-32.9	0	0	0	114.6	V544 N548	V544-N546 VanDerWaalsContact C-N 3.27Å; V544-N546 PolarHBondContact O-N 2.92Å; N546-N548 PolarHBondContact O-N 2.95Å
547	L	41.8	Very low	48.2	Very low	141 Å²	141	113.7 Å²	113.7	74%	0.738	70%	0.696	S	S	*	*			trans	-85.1	51.4	-180	-75.9	162.8	0	0	0	113.1
548	N	40.7	Very low	47.4	Very low	167 Å²	167	119.8 Å²	119.8	89%	0.893	71%	0.712	S	S	*	*			trans	-121.7	54.2	166.8	-95.2	-22.5	0	0	0	110.1	N546	N546-N548 PolarHBondContact O-N 2.95Å
549	A	39.3	Very low	46.7	Very low	80 Å²	80	122.2 Å²	122.2	66%	0.661	72%	0.722	S	S	*	*	S	Bend	trans	-148.4	133.8	171.1	0	0	0	0	0	110.2	P551	A549-P551 WeakPolarHBondContact O-CD 3.35Å
550	T	35.6	Very low	46	Very low	144 Å²	144	125.5 Å²	125.5	88%	0.883	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-70.8	120.2	-175.4	28.1	0	0	0	0	113
551	P	42.9	Very low	45.1	Very low	120 Å²	120	127.4 Å²	127.4	78%	0.779	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-82.9	136.1	170.1	-6.8	25.7	0	0	0	111.2	A549	A549-P551 WeakPolarHBondContact O-CD 3.35Å
552	Q	38.3	Very low	44.5	Very low	191 Å²	191	132.5 Å²	132.5	89%	0.893	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-78.7	148.4	176	-67.6	173.7	-17.4	0	0	111.9
553	Y	34.2	Very low	43.8	Very low	231 Å²	231	137 Å²	137	91%	0.906	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-64.5	138.6	178	-89.1	-103.8	0	0	0	112.9
554	L	46.3	Very low	43.2	Very low	163 Å²	163	144 Å²	144	85%	0.853	81%	0.806	S	S	*	*			trans	-123	132.9	160.9	-81.7	168.4	0	0	0	109.8
555	P	46	Very low	42.4	Very low	110 Å²	110	147.5 Å²	147.5	71%	0.714	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-81.1	161.5	-177.7	32.7	-35.3	0	0	0	113.4
556	P	46.4	Very low	41.9	Very low	127 Å²	127	154.7 Å²	154.7	83%	0.825	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-75.6	149.5	-170.3	29.8	-36.1	0	0	0	114.9
557	V	47.4	Very low	41.7	Very low	146 Å²	146	157.2 Å²	157.2	89%	0.885	84%	0.841	S	S	*	*	P	Polyproline II helix	trans	-77.1	135.6	-179.9	178.3	0	0	0	0	111.5
558	K	42.1	Very low	41.4	Very low	190 Å²	190	155.2 Å²	155.2	83%	0.826	84%	0.844	S	S	*	*	P	Polyproline II helix	trans	-80.8	147.4	174.6	-74.7	-179.7	176.3	176.9	0	112.2
559	P	48.3	Very low	41.5	Very low	114 Å²	114	156.3 Å²	156.3	74%	0.74	84%	0.844	S	S	*	*	P	Polyproline II helix	trans	-68.9	158.3	170.9	30.3	-35.2	0	0	0	112.4
560	P	45.8	Very low	41.5	Very low	131 Å²	131	164.8 Å²	164.8	85%	0.851	86%	0.859	S	S	*	*	P	Polyproline II helix	trans	-72.7	145.9	-174.3	29.7	-35.4	0	0	0	113.2
561	A	39.1	Very low	41.5	Very low	100 Å²	100	162.8 Å²	162.8	83%	0.826	86%	0.857	S	S	*	*	P	Polyproline II helix	trans	-81.6	138.3	-179.5	0	0	0	0	0	112.6
562	L	42.3	Very low	41.4	Very low	173 Å²	173	162 Å²	162	91%	0.906	86%	0.861	S	S	*	*	P	Polyproline II helix	trans	-83	140.3	172.6	-160.9	81.8	0	0	0	110.9
563	N	39.4	Very low	41.5	Very low	154 Å²	154	158.8 Å²	158.8	82%	0.824	86%	0.856	S	S	*	*	P	Polyproline II helix	trans	-53.3	132	-174.1	-66.8	-25.4	0	0	0	114.9
564	K	39.1	Very low	41.8	Very low	208 Å²	208	156 Å²	156	90%	0.904	86%	0.855	S	S	*	*			trans	-127.6	73	161.5	-88.7	-172	174	179.8	0	110.8
565	E	39	Very low	41.5	Very low	183 Å²	183	155.5 Å²	155.5	86%	0.855	85%	0.853	S	S	*	*			trans	-121.8	90.3	165	-73.6	-168.6	151.3	0	0	109.5
566	R	39.8	Very low	41.2	Very low	243 Å²	243	156 Å²	156	92%	0.917	86%	0.857	S	S	*	*	S	Bend	trans	167	69.7	161.4	-97.2	168.9	-174.3	-149.3	2.7	110.1
567	L	41.2	Very low	40.9	Very low	186 Å²	186	155.4 Å²	155.4	97%	0.974	86%	0.855	S	S	*	*			trans	-174.9	65.3	163.3	-105.8	156	0	0	0	110.4
568	A	36.7	Very low	40.4	Very low	98 Å²	98	157.4 Å²	157.4	81%	0.81	86%	0.855	S	S	*	*			trans	-151.6	46.2	179.8	0	0	0	0	0	113.1
569	Q	41.3	Very low	40.2	Very low	190 Å²	190	153.6 Å²	153.6	89%	0.888	85%	0.85	S	S	*	*			trans	-145.2	81.7	171.3	-73.3	-168.4	-3.4	0	0	112.2
570	R	39.6	Very low	39.7	Very low	258 Å²	258	157.2 Å²	157.2	97%	0.974	86%	0.857	S	S	*	*			trans	-174.2	118.4	143.5	-109.7	170.4	172	179.6	-3.9	109.7
571	A	36.1	Very low	39.1	Very low	103 Å²	103	154.6 Å²	154.6	85%	0.851	85%	0.846	S	S	*	*			trans	-110.3	145	179.1	0	0	0	0	0	110.8
572	A	41.4	Very low	39	Very low	103 Å²	103	157.3 Å²	157.3	85%	0.851	85%	0.845	S	S	*	*			trans	-164.7	119.4	157.2	0	0	0	0	0	109.1
573	P	39.1	Very low	38.7	Very low	123 Å²	123	154.7 Å²	154.7	80%	0.799	84%	0.836	S	S	*	*			trans	-110.6	145.9	178.2	37.4	-29.3	0	0	0	113.2
574	I	42.3	Very low	38.5	Very low	172 Å²	172	153.4 Å²	153.4	88%	0.882	83%	0.83	S	S	*	*			trans	-140	149.7	164.2	-60.7	-174.7	0	0	0	109.5
575	N	39.7	Very low	38.3	Very low	153 Å²	153	150.4 Å²	150.4	82%	0.818	82%	0.819	S	S	*	*			trans	-79.1	165.1	-158.4	-57.7	-40.2	0	0	0	117.4
576	P	38.3	Very low	38.3	Very low	122 Å²	122	147.2 Å²	147.2	79%	0.792	81%	0.806	S	S	*	*			trans	-115.9	140.5	169.5	38.9	-27.9	0	0	0	115.9
577	S	40.4	Very low	38	Very low	113 Å²	113	143 Å²	143	79%	0.79	80%	0.797	S	S	*	*			trans	175.3	134.8	165.9	50.1	0	0	0	0	106.3
578	E	37.1	Very low	37.8	Very low	188 Å²	188	139.3 Å²	139.3	88%	0.879	78%	0.778	S	S	*	*			cis	-152.2	175.1	24.4	-103.4	159.9	-176	0	0	110.7
579	P	38.8	Very low	37.7	Very low	111 Å²	111	145.3 Å²	145.3	72%	0.721	78%	0.78	S	S	*	*			trans	-112.7	-171.9	-170.6	41.8	-32.2	0	0	0	116.6
580	E	36.2	Very low	37.3	Very low	189 Å²	189	139.3 Å²	139.3	88%	0.883	77%	0.769	S	S	*	*			trans	81.6	149.6	175.1	-58.5	-163.9	-172.9	0	0	117.4
581	A	35.1	Very low	37	Very low	76 Å²	76	136.8 Å²	136.8	63%	0.628	77%	0.766	S	S	*	*			cis	-170.5	-179.4	-24.9	0	0	0	0	0	108.7
582	I	35.7	Very low	36.9	Very low	157 Å²	157	137.1 Å²	137.1	81%	0.805	76%	0.761	S	S	*	*			trans	76.3	112.9	169.4	-48.4	164	0	0	0	113.6
583	V	35.5	Very low	36.5	Very low	118 Å²	118	142 Å²	142	72%	0.715	76%	0.762	S	S	*	*			cis	95.1	133.6	42.1	172.8	0	0	0	0	113.3
584	D	36.3	Very low	36.3	Very low	128 Å²	128	141.8 Å²	141.8	68%	0.684	76%	0.761	S	S	*	*			trans	71	145.5	170	-69.9	-14.3	0	0	0	118.5
585	Q	35.6	Very low	35.8	Very low	144 Å²	144	141.1 Å²	141.1	67%	0.673	76%	0.759	S	S	*	*			cis	-164.8	162.1	-3.8	-118.8	168.6	33.3	0	0	112.8
586	I	37.7	Very low	35.7	Very low	117 Å²	117	142.7 Å²	142.7	60%	0.6	76%	0.762	S	S	*	*			trans	72.4	117.5	142.8	-71.4	165.8	0	0	0	121.2
587	Q	35	Very low	35.5	Very low	155 Å²	155	143.2 Å²	143.2	72%	0.724	76%	0.763	S	S	*	*				41.4	155.1	126.8	-44.7	169.6	-25.4	0	0	120
588	D	35.9	Very low	35.4	Very low	107 Å²	107	143.7 Å²	143.7	57%	0.572	76%	0.763	S	S	*	*			cis	-165.3	159.3	26.6	-163.3	11.2	0	0	0	111.3
589	R	35.7	Very low	35	Very low	224 Å²	224	144 Å²	144	85%	0.845	76%	0.762	S	S	*	*			trans	63.8	150	166.2	-57.9	156.8	-157.6	-149.6	0.7	118.4
590	G	32.9	Very low	34.9	Very low	65 Å²	65	144.6 Å²	144.6	67%	0.67	76%	0.764	S	S	*	*			cis	155.8	129.4	-6.6	0	0	0	0	0	113.8
591	F	33	Very low	34.8	Very low	205 Å²	205	144.2 Å²	144.2	90%	0.899	76%	0.762	S	S	*	*			trans	78	145.6	156.4	-85.1	-87.9	0	0	0	124.1
592	C	33.4	Very low	34.8	Very low	110 Å²	110	148.6 Å²	148.6	74%	0.743	77%	0.769	S	S	*	*			trans	86.4	89.2	150	-72.2	0	0	0	0	122.6
593	K	32.8	Very low	35	Very low	204 Å²	204	146.8 Å²	146.8	89%	0.887	77%	0.768	S	S	*	*				35.1	140	129.6	-67.8	-173.3	177.3	-178.5	0	121.9
594	P	35.4	Very low	35	Very low	120 Å²	120	147.9 Å²	147.9	78%	0.779	77%	0.768	S	S	*	*			trans	-89.6	157.8	-180	38.2	-36.4	0	0	0	113.9
595	N	32	Very low	35.2	Very low	157 Å²	157	145.5 Å²	145.5	84%	0.84	77%	0.774	S	S	*	*			trans	-171.5	164.1	146.7	-110.1	-19.4	0	0	0	112.5
596	Q	36.3	Very low	35.3	Very low	186 Å²	186	146.5 Å²	146.5	87%	0.869	78%	0.778	S	S	*	*			trans	84.5	101.6	167.3	-63.1	170.3	7.9	0	0	119.4
597	T	34.6	Very low	35.3	Very low	133 Å²	133	149 Å²	149	82%	0.816	79%	0.79	S	S	*	*			trans	-67.7	156.9	144.9	54.5	0	0	0	0	110.6
598	P	38	Very low	35.4	Very low	123 Å²	123	145.7 Å²	145.7	80%	0.799	78%	0.784	S	S	*	*				-150.7	175.7	89.2	37.6	-18	0	0	0	117.4
599	F	29.8	Very low	35.5	Very low	195 Å²	195	148.3 Å²	148.3	86%	0.855	80%	0.798	S	S	*	*			trans	-28.4	154.8	165.2	-91.1	-118.1	0	0	0	119
600	V	36.4	Very low	35.6	Very low	124 Å²	124	140.8 Å²	140.8	75%	0.752	79%	0.79	S	S	*	*				-179.9	122.2	111.7	150.5	0	0	0	0	113.2
601	E	34	Very low	35.8	Very low	181 Å²	181	144.6 Å²	144.6	85%	0.846	80%	0.8	S	S	*	*			trans	53.2	162.7	143	-56	-176.2	139.2	0	0	125.7
602	Q	34.9	Very low	36	Very low	167 Å²	167	139.3 Å²	139.3	78%	0.78	79%	0.789	S	S	*	*			trans	-99.1	-177.1	-164.1	-52.8	175.3	-13.9	0	0	113.4
603	P	40.7	Very low	36.2	Very low	119 Å²	119	139.5 Å²	139.5	77%	0.773	79%	0.786	S	S	*	*				-149.7	139.6	86.4	36.3	-16.9	0	0	0	118.5
604	I	33.7	Very low	36.5	Very low	142 Å²	142	137.3 Å²	137.3	73%	0.728	78%	0.779	S	S	*	*			trans	24.3	130.9	132	-50.6	171.5	0	0	0	120.7	E606	I604-E606 HydrophobicContact CG2-CG 4.41Å
605	G	42.1	Very low	36.4	Very low	78 Å²	78	139.2 Å²	139.2	80%	0.804	78%	0.775	S	S	*	*			trans	-160.4	134.9	156.5	0	0	0	0	0	111.3
606	E	36.2	Very low	36.7	Very low	164 Å²	164	141.6 Å²	141.6	77%	0.766	77%	0.774	S	S	*	*			trans	-105.1	176.1	-157.2	-60.2	-178.4	125.4	0	0	117.2	I604	I604-E606 HydrophobicContact CG2-CG 4.41Å
607	M	37.6	Very low	36.5	Very low	169 Å²	169	139.5 Å²	139.5	83%	0.833	77%	0.768	S	S	*	*			trans	88.3	140.8	158.2	-50.5	-172	-171.7	0	0	119.2
608	S	38	Very low	36.9	Very low	86 Å²	86	142.2 Å²	142.2	60%	0.601	77%	0.772	S	S	*	*			cis	-170.1	159.7	-24.6	56.1	0	0	0	0	112.1
609	N	38	Very low	36.9	Very low	163 Å²	163	140.5 Å²	140.5	87%	0.872	76%	0.761	S	S	*	*			trans	85	127.7	152.9	-58.4	-30	0	0	0	123.2
610	G	37.9	Very low	37.2	Very low	66 Å²	66	137.3 Å²	137.3	68%	0.68	76%	0.759	S	S	*	*			trans	125.8	71.6	164.9	0	0	0	0	0	115.1
611	V	37.7	Very low	37.2	Very low	144 Å²	144	140 Å²	140	87%	0.873	76%	0.761	S	S	*	*				60.8	120.2	79	-174.9	0	0	0	0	111.7
612	S	37	Very low	37	Very low	95 Å²	95	136.8 Å²	136.8	66%	0.664	76%	0.759	S	S	*	*			cis	-165.4	149.1	13.6	47.5	0	0	0	0	114.7
613	T	36.9	Very low	37	Very low	114 Å²	114	137.3 Å²	137.3	70%	0.699	76%	0.761	S	S	*	*			trans	38.3	152.3	140	71	0	0	0	0	122.5
614	H	39.7	Very low	36.7	Very low	158 Å²	158	137.8 Å²	137.8	73%	0.731	76%	0.762	S	S	*	*			cis	-138.3	140.3	8.3	-81.4	-96.4	0	0	0	109.2
615	K	33.9	Very low	36.6	Very low	159 Å²	159	139 Å²	139	69%	0.691	77%	0.77	S	S	*	*				64.6	109.8	68.7	-87.4	-167.6	173.4	-174.1	0	117.1
616	Y	37.3	Very low	36.8	Very low	207 Å²	207	140.9 Å²	140.9	81%	0.812	77%	0.767	S	S	*	*				-173.8	134.2	96.3	-105.9	-78	0	0	0	113.3
617	D	31.3	Very low	36.7	Very low	142 Å²	142	139 Å²	139	76%	0.759	77%	0.769	S	S	*	*			trans	-101.9	166.3	-174.5	-48.8	-85.4	0	0	0	113.9
618	Q	42.9	Very low	36.4	Very low	191 Å²	191	142.7 Å²	142.7	89%	0.893	77%	0.774	S	S	*	*			trans	-171	163.2	131.4	-103.3	-174.2	24.5	0	0	112.1
619	P	38.2	Very low	36.4	Very low	87 Å²	87	142.4 Å²	142.4	57%	0.565	79%	0.785	S	S	*	*				-120.9	172.2	-119.2	43.4	-34.6	0	0	0	116.1	F621	P619-F621 HydrophobicContact CG-CD2 4.41Å
620	P	36.9	Very low	36.1	Very low	127 Å²	127	142 Å²	142	83%	0.825	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-87	124.2	156.7	33.6	-27.7	0	0	0	110.8
621	F	36.7	Very low	35.9	Very low	181 Å²	181	146.7 Å²	146.7	79%	0.794	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-82.5	121.7	170.3	-110.1	-95.7	0	0	0	110.5	P619	P619-F621 HydrophobicContact CG-CD2 4.41Å
622	S	30.1	Very low	35.7	Very low	113 Å²	113	148.5 Å²	148.5	79%	0.79	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-100.4	120.8	160.7	57.3	0	0	0	0	108.3
623	E	34.2	Very low	35.4	Very low	178 Å²	178	152.5 Å²	152.5	83%	0.832	79%	0.792	S	S	*	*			trans	-117.1	139.1	173.4	-134.7	174.7	-159.9	0	0	112.4
624	T	33.5	Very low	35.4	Very low	129 Å²	129	153.9 Å²	153.9	79%	0.791	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-88.1	145.4	-165.8	41.5	0	0	0	0	113.2
625	L	31.9	Very low	35.1	Very low	169 Å²	169	150.7 Å²	150.7	89%	0.885	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-56.7	134.4	168.6	-66.7	163.6	0	0	0	112.4
626	P	46.4	Very low	35.1	Very low	117 Å²	117	150.7 Å²	150.7	76%	0.76	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-86.3	150.3	160	34	-31.5	0	0	0	111.5
627	P	35.4	Very low	35.1	Very low	123 Å²	123	146.5 Å²	146.5	80%	0.799	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-88.2	158.7	-175.3	34.6	-35.6	0	0	0	114.9
628	R	31.5	Very low	35	Very low	248 Å²	248	146.6 Å²	146.6	94%	0.936	79%	0.794	S	S	*	*			trans	-15.9	130	170.8	-69.3	175.8	169.8	177.7	-4.5	118.5
629	G	37.5	Very low	34.8	Very low	80 Å²	80	147 Å²	147	83%	0.825	80%	0.795	S	S	*	*			trans	-110.9	149.2	148.4	0	0	0	0	0	110.8
630	L	31.5	Very low	34.5	Very low	153 Å²	153	148.5 Å²	148.5	80%	0.801	80%	0.798	S	S	*	*			trans	-109.7	156.5	-172	-103	159	0	0	0	112.3
631	E	32.7	Very low	34.6	Very low	165 Å²	165	149.2 Å²	149.2	77%	0.771	80%	0.8	S	S	*	*			trans	68	140.3	165.9	-61.8	174.5	-171.7	0	0	116.7
632	Q	35	Very low	34.4	Very low	183 Å²	183	147.1 Å²	147.1	86%	0.855	80%	0.797	S	S	*	*			cis	-148.2	160.6	44.7	-75.1	177.1	-11.9	0	0	114.4
633	H	30.8	Very low	34.7	Very low	178 Å²	178	147.3 Å²	147.3	82%	0.824	79%	0.788	S	S	*	*			trans	-79	151.8	-179.3	-83.7	-101.1	0	0	0	115.1
634	V	35.2	Very low	34.6	Very low	144 Å²	144	148.5 Å²	148.5	87%	0.873	79%	0.785	S	S	*	*			trans	-139.3	139.7	143.3	-174.2	0	0	0	0	108.9
635	P	34.3	Very low	34.5	Very low	91 Å²	91	148.8 Å²	148.8	59%	0.591	78%	0.782	S	S	*	*			trans	-125.4	164.8	-158.1	19.2	5.7	0	0	0	117.8
636	I	34.2	Very low	34.7	Very low	158 Å²	158	148.5 Å²	148.5	81%	0.81	78%	0.781	S	S	*	*			trans	75.1	152.2	146.2	-74.2	164.8	0	0	0	116.9
637	P	36.5	Very low	34.1	Very low	119 Å²	119	148.6 Å²	148.6	77%	0.773	78%	0.78	S	S	*	*			cis	-124.9	164.3	14.1	18.5	6.5	0	0	0	118.9
638	E	30.7	Very low	34	Very low	145 Å²	145	150 Å²	150	68%	0.678	78%	0.781	S	S	*	*			trans	-87.1	165.1	171.3	-56.3	175.8	168.1	0	0	113.6	N640	E638-N640 PolarHBondContact OE2-ND2 3.02Å
639	H	38.6	Very low	34.3	Very low	198 Å²	198	143.7 Å²	143.7	92%	0.917	77%	0.771	S	S	*	*			trans	-137.4	106.4	149	-113.4	47.5	0	0	0	110.9
640	N	31.3	Very low	33.9	Very low	119 Å²	119	145.1 Å²	145.1	64%	0.636	77%	0.769	S	S	*	*			trans	-88.2	137.1	173.6	-69	-55.3	0	0	0	111	E638	E638-N640 PolarHBondContact OE2-ND2 3.02Å
641	V	38.2	Very low	34.1	Very low	143 Å²	143	145.3 Å²	145.3	87%	0.867	77%	0.77	S	S	*	*			trans	-148.2	76.6	140.5	-168.9	0	0	0	0	110.4
642	D	32.8	Very low	34	Very low	137 Å²	137	145.1 Å²	145.1	73%	0.733	77%	0.774	S	S	*	*				46.3	148.7	113.9	-124.5	-12.7	0	0	0	124.2
643	I	35.8	Very low	33.8	Very low	116 Å²	116	147.4 Å²	147.4	60%	0.595	78%	0.775	S	S	*	*			trans	100.8	97.7	148.2	-68.5	164	0	0	0	121.8
644	R	33.2	Very low	34	Very low	204 Å²	204	146.2 Å²	146.2	77%	0.77	78%	0.775	S	S	*	*			trans	88.5	104.6	133.8	-71.7	175.6	-163.6	163.5	4.2	123.6
645	N	31.2	Very low	33.9	Very low	134 Å²	134	146.7 Å²	146.7	72%	0.717	77%	0.768	S	S	*	*				53.3	112.1	118.4	-58	4.8	0	0	0	120.7
646	N	35.6	Very low	33.9	Very low	163 Å²	163	152.7 Å²	152.7	87%	0.872	78%	0.778	S	S	*	*				-156.4	157.3	99	-105.4	-15	0	0	0	112.6
647	T	34.5	Very low	33.9	Very low	119 Å²	119	150.6 Å²	150.6	73%	0.73	77%	0.769	S	S	*	*			trans	-104.7	137.9	-157.9	48.5	0	0	0	0	114.6
648	N	33.8	Very low	33.7	Very low	154 Å²	154	152.5 Å²	152.5	82%	0.824	77%	0.768	S	S	*	*				35.6	164.9	126.2	-79	2.4	0	0	0	122.3
649	P	37.9	Very low	33.8	Very low	114 Å²	114	154 Å²	154	74%	0.74	77%	0.774	S	S	*	*			cis	-135.8	179.5	-2.4	23.4	2.2	0	0	0	116.4
650	S	29.2	Very low	33.5	Very low	110 Å²	110	152.1 Å²	152.1	77%	0.769	77%	0.77	S	S	*	*			trans	-60.6	161.6	163.8	51.9	0	0	0	0	116.2
651	L	34.5	Very low	33.7	Very low	158 Å²	158	150.9 Å²	150.9	83%	0.827	77%	0.769	S	S	*	*			trans	-146.8	118.8	161.8	-112.6	157.4	0	0	0	112.6
652	D	31.6	Very low	33.3	Very low	160 Å²	160	151 Å²	151	86%	0.856	76%	0.764	S	S	*	*			trans	-69.3	156.7	166.2	-85.9	-49	0	0	0	111.6
653	W	30.8	Very low	33.3	Very low	231 Å²	231	151.8 Å²	151.8	88%	0.875	76%	0.763	S	S	*	*			trans	-131	112.2	168.8	-94.6	84.6	0	0	0	112.2
654	N	33.9	Very low	33.1	Very low	153 Å²	153	151.4 Å²	151.4	82%	0.818	77%	0.766	S	S	*	*			trans	-161.6	137.4	153.8	-116.5	-38.1	0	0	0	113.2
655	Q	33.7	Very low	32.9	Very low	155 Å²	155	149.1 Å²	149.1	72%	0.724	76%	0.764	S	S	*	*			trans	78.6	130.7	162.1	-59.8	-171.6	6.5	0	0	122.2
656	R	33.2	Very low	33.1	Very low	216 Å²	216	150.4 Å²	150.4	82%	0.815	77%	0.766	S	S	*	*			trans	89.1	137.9	158.3	-67.4	172.6	-169.8	-154	-3.1	117
657	N	34.6	Very low	33	Very low	114 Å²	114	149.3 Å²	149.3	61%	0.61	76%	0.76	S	S	*	*			cis	176.6	148.1	-13.4	-120.9	36.7	0	0	0	104
658	E	32.9	Very low	33	Very low	160 Å²	160	150.2 Å²	150.2	75%	0.748	77%	0.765	S	S	*	*			trans	61	139.2	152.8	-70.9	141.3	178.2	0	0	117.9
659	E	33.4	Very low	32.8	Very low	175 Å²	175	148.4 Å²	148.4	82%	0.818	76%	0.762	S	S	*	*			cis	-145.4	177.2	17.2	-117.7	158.3	-161.3	0	0	111.6
660	L	31.7	Very low	32.6	Very low	159 Å²	159	150.6 Å²	150.6	83%	0.832	77%	0.766	S	S	*	*			trans	-117.9	-169.2	-169.2	-104.7	176.1	0	0	0	109.6
661	P	35.3	Very low	32.6	Very low	93 Å²	93	153.8 Å²	153.8	60%	0.604	77%	0.769	S	S	*	*			cis	-141.4	-165.3	-18.9	31.9	-7.6	0	0	0	115
662	L	30.2	Very low	32.5	Very low	146 Å²	146	152 Å²	152	76%	0.764	77%	0.765	S	S	*	*			trans	72.8	145.4	157.9	-57.4	171.4	0	0	0	117
663	Q	32.9	Very low	32.3	Very low	154 Å²	154	150.4 Å²	150.4	72%	0.72	75%	0.752	S	S	*	*			cis	-156.9	141.4	12.5	-133.7	162.4	33	0	0	113.4
664	T	30.3	Very low	32.1	Very low	108 Å²	108	147.1 Å²	147.1	66%	0.663	75%	0.747	S	S	*	*			trans	45	123.2	145.9	43.2	0	0	0	0	125.2
665	E	30.1	Very low	32.2	Very low	155 Å²	155	145.9 Å²	145.9	72%	0.724	75%	0.747	S	S	*	*			trans	68.5	116.2	134.8	-59.5	-179.8	-167.6	0	0	122.8
666	H	36.1	Very low	32.2	Very low	161 Å²	161	144.5 Å²	144.5	75%	0.745	75%	0.745	S	S	*	*				-170.8	144.1	98.7	-104.4	64.6	0	0	0	114.6
667	N	32.7	Very low	32	Very low	140 Å²	140	141.4 Å²	141.4	75%	0.749	74%	0.744	S	S	*	*			trans	-36.5	142.7	177.5	-60.4	-59.7	0	0	0	119.4
668	V	33.8	Very low	31.9	Very low	138 Å²	138	142.4 Å²	142.4	84%	0.836	75%	0.748	S	S	*	*				-166.4	133.9	111.2	171.9	0	0	0	0	109.6
669	P	30.4	Very low	31.6	Very low	117 Å²	117	145.4 Å²	145.4	76%	0.76	75%	0.754	S	S	*	*			trans	-110.4	146	-179.7	38.4	-31.3	0	0	0	116.2
670	L	33.8	Very low	31.5	Very low	159 Å²	159	148 Å²	148	83%	0.832	76%	0.756	S	S	*	*			trans	-157.8	107.7	162.1	-92.9	150.6	0	0	0	106.2
671	Q	29.6	Very low	31.5	Very low	177 Å²	177	147.5 Å²	147.5	83%	0.827	75%	0.75	S	S	*	*				52.1	123.9	77.2	-75	-167.8	1.1	0	0	114.1
672	T	31	Very low	32	Very low	120 Å²	120	149.3 Å²	149.3	74%	0.736	76%	0.762	S	S	*	*			cis	-156.9	158.6	-0.2	-62.4	0	0	0	0	110.4
673	E	27.1	Very low	32.2	Very low	128 Å²	128	150.9 Å²	150.9	60%	0.598	76%	0.763	S	S	*	*			trans	-61.8	143.4	174.3	-42.5	168	125.8	0	0	114.5	R881	E673-R881 IonicContact OE2-CZ 3.47Å; E673-R881 IonicContact OE2-NH1 3.09Å; E673-R881 PolarHBondContact OE2-NH1 3.32Å; E673-R881 VanDerWaalsContact OE2-NH1 3.09Å; E673-R881 IonicContact OE2-NH2 2.83Å; E673-R881 PolarHBondContact OE2-NH2 3.15Å
674	Q	28.3	Very low	32.1	Very low	162 Å²	162	149.1 Å²	149.1	76%	0.757	77%	0.768	S	S	*	*				-163.1	124.2	129.2	-81.3	-157.1	3.1	0	0	109.7	N676	Q674-N676 PolarHBondContact O-N 3.07Å
675	P	35.6	Very low	32.4	Very low	127 Å²	127	147.3 Å²	147.3	83%	0.825	77%	0.77	S	S	*	*			trans	-82.2	107.5	164.9	31.4	-28.8	0	0	0	109.5
676	N	32.4	Very low	32.5	Very low	126 Å²	126	145.6 Å²	145.6	67%	0.674	77%	0.772	S	S	*	*			trans	-62.9	137.7	178.4	-80.4	-37	0	0	0	112.3	Q674 I678	Q674-N676 PolarHBondContact O-N 3.07Å; N676-I678 PolarHBondContact O-N 3.37Å; N676-I678 VanDerWaalsContact O-N 3.17Å
677	N	29.8	Very low	32.6	Very low	151 Å²	151	143.9 Å²	143.9	81%	0.807	78%	0.776	S	S	*	*			trans	-58.5	114.2	161.8	-78.1	-34.7	0	0	0	109.4
678	I	31.7	Very low	32.7	Very low	135 Å²	135	146.1 Å²	146.1	69%	0.692	78%	0.782	S	S	*	*			trans	-100.7	87.8	170.5	-61	177.4	0	0	0	108.1	N676 R680	N676-I678 PolarHBondContact O-N 3.37Å; N676-I678 VanDerWaalsContact O-N 3.17Å; I678-R680 HydrophobicContact CG2-CB 4.34Å; I678-R680 HydrophobicContact CG2-CG 3.88Å; I678-R680 PolarHBondContact O-N 3.23Å
679	Y	28.4	Very low	32.3	Very low	222 Å²	222	146.6 Å²	146.6	87%	0.871	78%	0.778	S	S	*	*			trans	-59.5	128.7	148.5	-81.8	-98.5	0	0	0	107.5
680	R	31.1	Very low	32.4	Very low	229 Å²	229	152 Å²	152	86%	0.864	79%	0.786	S	S	*	*			trans	-124.8	94.1	173.5	-115.7	-173.5	-174.5	-160.3	3	109.9	I678	I678-R680 HydrophobicContact CG2-CB 4.34Å; I678-R680 HydrophobicContact CG2-CG 3.88Å; I678-R680 PolarHBondContact O-N 3.23Å
681	E	30.3	Very low	32.1	Very low	150 Å²	150	151 Å²	151	70%	0.701	78%	0.781	S	S	*	*			trans	-66.5	145.5	151.7	-64.2	-167.1	156.3	0	0	109.6	F683	E681-F683 PolarHBondContact O-N 2.79Å
682	P	46.4	Very low	32.3	Very low	131 Å²	131	151.5 Å²	151.5	85%	0.851	78%	0.783	S	S	*	*			trans	-87.7	97.2	161.4	29.1	-20.6	0	0	0	109.6
683	F	34	Very low	32.3	Very low	178 Å²	178	153.7 Å²	153.7	78%	0.781	79%	0.785	S	S	*	*			trans	-60.3	144.4	171.4	-108	-100.6	0	0	0	112.2	E681	E681-F683 PolarHBondContact O-N 2.79Å
684	S	30.3	Very low	32.4	Very low	118 Å²	118	155 Å²	155	83%	0.825	79%	0.791	S	S	*	*			trans	-68.1	133.3	171.3	54.8	0	0	0	0	112.7
685	G	36.4	Very low	32.6	Very low	69 Å²	69	155.6 Å²	155.6	71%	0.711	80%	0.799	S	S	*	*			trans	-152.9	140.3	169	0	0	0	0	0	111.3
686	P	32.8	Very low	32.2	Very low	119 Å²	119	158.6 Å²	158.6	77%	0.773	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-82.8	150.6	-170.8	33.4	-35.6	0	0	0	112.9
687	P	37.7	Very low	32.4	Very low	126 Å²	126	160.7 Å²	160.7	82%	0.818	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-76.1	126.8	178.7	30.7	-33.3	0	0	0	111.5
688	Q	35.1	Very low	32.6	Very low	187 Å²	187	162.5 Å²	162.5	87%	0.874	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-89.9	138.5	164.2	-71.5	-172.7	-7.1	0	0	110
689	L	27	Very low	32.8	Very low	147 Å²	147	162 Å²	162	77%	0.77	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-69.3	140.6	173.4	-68.8	94.1	0	0	0	110.8
690	Y	31.6	Very low	33.2	Very low	232 Å²	232	160.5 Å²	160.5	91%	0.91	82%	0.817	S	S	*	*			trans	-141.5	132.6	139.8	-106.5	-84.2	0	0	0	109.7
691	N	27.1	Very low	33.3	Very low	136 Å²	136	155.6 Å²	155.6	73%	0.727	82%	0.815	S	S	*	*			trans	-84.7	145.9	174.7	-70	-32.7	0	0	0	109.7
692	E	33.8	Very low	33.5	Very low	188 Å²	188	157.9 Å²	157.9	88%	0.879	82%	0.823	S	S	*	*			trans	-160.3	106.6	132.4	-113.6	162.8	-150.4	0	0	113
693	Q	32.3	Very low	32.9	Very low	167 Å²	167	156.8 Å²	156.8	78%	0.78	82%	0.816	S	S	*	*			trans	36.7	110.1	143.5	-70.4	169.6	-17.3	0	0	122.2
694	E	29	Very low	32.7	Very low	156 Å²	156	159.7 Å²	159.7	73%	0.729	82%	0.822	S	S	*	*				57.2	104.9	126.2	-62.2	-176.8	169.4	0	0	120.4
695	N	32.2	Very low	32.9	Very low	173 Å²	173	161.7 Å²	161.7	93%	0.925	82%	0.817	S	S	*	*				-148.8	125.7	117	-103.7	-56.8	0	0	0	110.9
696	F	27.9	Very low	32.4	Very low	190 Å²	190	169.2 Å²	169.2	83%	0.833	82%	0.824	S	S	*	*			trans	-81	116.4	-177.2	-93.9	-105.5	0	0	0	111.7
697	L	36	Very low	32.5	Very low	170 Å²	170	170.9 Å²	170.9	89%	0.89	82%	0.822	S	S	*	*			trans	-141.1	127.4	156.7	-86	170.3	0	0	0	108.9
698	E	33.1	Very low	32.2	Very low	189 Å²	189	171.9 Å²	171.9	88%	0.883	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-69.7	139	-169.8	-60.1	177.1	132	0	0	113.5
699	P	37.3	Very low	32	Very low	124 Å²	124	174.5 Å²	174.5	81%	0.805	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-80.3	125.2	165.3	31.3	-29.9	0	0	0	110.7
700	K	35.9	Very low	32.1	Very low	191 Å²	191	174.9 Å²	174.9	83%	0.83	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-57.9	142	179.9	-64.1	175.6	179.7	175.9	0	112.2
701	P	32.3	Very low	32.3	Very low	126 Å²	126	174.4 Å²	174.4	82%	0.818	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-73.2	130.1	171.6	30.5	-33	0	0	0	110.6
702	F	35.5	Very low	32.5	Very low	199 Å²	199	179 Å²	179	87%	0.873	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-66.7	137.2	168.2	-86.7	-90.2	0	0	0	110.3	R704	F702-R704 PolarHBondContact O-N 3.41Å
703	P	33.3	Very low	32.4	Very low	107 Å²	107	177.1 Å²	177.1	70%	0.695	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-73.4	127.5	-177.4	8.8	1.4	0	0	0	110.6	H705	P703-H705 PolarHBondContact O-N 3.19Å
704	R	29.6	Very low	32.6	Very low	240 Å²	240	178.1 Å²	178.1	91%	0.906	83%	0.83	S	S	*	*			trans	-68.7	109.7	161.3	-73.1	-179.1	173.8	179.8	-2.3	107.9	F702 R706	F702-R704 PolarHBondContact O-N 3.41Å; R704-R706 PolarHBondContact O-N 3.5Å
705	H	34.7	Very low	32.6	Very low	159 Å²	159	179.4 Å²	179.4	74%	0.736	84%	0.837	S	S	*	*			trans	-58.2	112.3	164.4	-99.1	-106.9	0	0	0	108.3	P703 E707	P703-H705 PolarHBondContact O-N 3.19Å; H705-E707 IonicContact CE1-OE1 2.82Å; H705-E707 IonicContact CG-OE1 2.67Å; H705-E707 IonicContact ND1-OE1 3.96Å; H705-E707 PolarHBondContact ND1-OE1 3.38Å
706	R	26.6	Very low	32.7	Very low	227 Å²	227	180 Å²	180	86%	0.857	83%	0.834	S	S	*	*			trans	-113	84.2	175.3	-169.5	-174.4	-161.7	175.8	4.5	105	R704	R704-R706 PolarHBondContact O-N 3.5Å
707	E	35.6	Very low	32.7	Very low	155 Å²	155	175.6 Å²	175.6	72%	0.724	83%	0.826	S	S	*	*			trans	-91.1	131.9	178.1	-81	173.6	-153	0	0	110.5	H705	H705-E707 IonicContact CE1-OE1 2.82Å; H705-E707 IonicContact CG-OE1 2.67Å; H705-E707 IonicContact ND1-OE1 3.96Å; H705-E707 PolarHBondContact ND1-OE1 3.38Å
708	D	30.4	Very low	32.5	Very low	146 Å²	146	176 Å²	176	78%	0.781	82%	0.824	S	S	*	*			trans	-73.5	142.3	-166.8	-59.1	-65.4	0	0	0	112.6
709	R	32	Very low	32.3	Very low	242 Å²	242	175.2 Å²	175.2	91%	0.913	82%	0.82	S	S	*	*			trans	-128.1	71.5	158.5	-76.7	-165.5	-176.3	-177.8	2.6	110.3	Y711	R709-Y711 PolarHBondContact O-N 2.97Å
710	D	29.1	Very low	32	Very low	155 Å²	155	179.5 Å²	179.5	83%	0.829	83%	0.826	S	S	*	*			trans	-74.2	97.5	148.5	-85.2	-21.2	0	0	0	108.2
711	Y	35.1	Very low	31.7	Very low	223 Å²	223	175.5 Å²	175.5	88%	0.875	82%	0.822	S	S	*	*			trans	-127	103.2	154.2	-105.5	-83.5	0	0	0	108.3	R709	R709-Y711 PolarHBondContact O-N 2.97Å
712	R	31.4	Very low	31.7	Very low	232 Å²	232	181.2 Å²	181.2	88%	0.875	83%	0.827	S	S	*	*			trans	-59.5	137.3	177.1	-81.5	175.5	163.8	148.2	-4.7	111	H714	R712-H714 PolarHBondContact O-N 3.08Å
713	D	31.3	Very low	31.7	Very low	149 Å²	149	177.4 Å²	177.4	80%	0.797	82%	0.823	S	S	*	*			trans	-59.2	129.4	160.1	-58.9	-67.7	0	0	0	110.3	E715	D713-E715 PolarHBondContact O-N 3.29Å
714	H	35.9	Very low	31.4	Very low	187 Å²	187	182.2 Å²	182.2	87%	0.866	83%	0.833	S	S	*	*			trans	-91.7	88.3	159.7	-88.3	-61.1	0	0	0	108.3	R712 H716	R712-H714 PolarHBondContact O-N 3.08Å; H714-H716 PolarHBondContact O-N 3.44Å
715	E	29.3	Very low	32	Very low	184 Å²	184	176.6 Å²	176.6	86%	0.86	83%	0.828	S	S	*	*			trans	-62.4	118.5	163.4	-69	-170.9	136.6	0	0	109.4	D713	D713-E715 PolarHBondContact O-N 3.29Å
716	H	34.2	Very low	31.7	Very low	186 Å²	186	177.9 Å²	177.9	86%	0.861	83%	0.834	S	S	*	*			trans	-94.2	112.5	153.4	-109	-70.1	0	0	0	108.1	H714	H714-H716 PolarHBondContact O-N 3.44Å
717	S	28.5	Very low	32.2	Very low	97 Å²	97	175.1 Å²	175.1	68%	0.678	84%	0.836	S	S	*	*			trans	-62.7	134.2	176.2	54.4	0	0	0	0	112.4
718	E	32.4	Very low	32	Very low	179 Å²	179	174.3 Å²	174.3	84%	0.836	84%	0.837	S	S	*	*			trans	-166.6	96.5	133.4	-108.2	166.3	-143.1	0	0	111.4
719	Q	28	Very low	32.2	Very low	172 Å²	172	175.1 Å²	175.1	80%	0.804	84%	0.836	S	S	*	*				33.8	109.7	125.5	-60.1	176	2.8	0	0	118.5
720	F	31.8	Very low	32.3	Very low	214 Å²	214	172.8 Å²	172.8	94%	0.939	83%	0.828	S	S	*	*				-163.6	123.9	117.7	-110.4	-72.1	0	0	0	110.9
721	S	28.3	Very low	32.6	Very low	106 Å²	106	175.7 Å²	175.7	74%	0.741	83%	0.829	S	S	*	*			trans	-122.9	135.9	-175	47	0	0	0	0	111.3
722	R	33.6	Very low	32.5	Very low	246 Å²	246	172.4 Å²	172.4	93%	0.928	83%	0.827	S	S	*	*			trans	-148.8	148.2	151.7	-71.6	-156.1	177	-162.6	-1.7	111.4
723	P	35.3	Very low	32.6	Very low	119 Å²	119	165.1 Å²	165.1	77%	0.773	82%	0.824	S	S	*	*			trans	-112.4	162.2	-165.8	39.4	-28.6	0	0	0	114.7
724	F	27.3	Very low	32.8	Very low	208 Å²	208	166.5 Å²	166.5	91%	0.912	83%	0.83	S	S	*	*			trans	-98.1	144.3	163	-78.1	-89.7	0	0	0	110.6
725	P	41.7	Very low	32.8	Very low	123 Å²	123	163.3 Å²	163.3	80%	0.799	83%	0.826	S	S	*	*			trans	-104.4	137.3	162.8	35.1	-26.6	0	0	0	112
726	E	28.3	Very low	33.1	Very low	186 Å²	186	158.5 Å²	158.5	87%	0.869	83%	0.826	S	S	*	*			trans	-77.5	158.3	166	-65.7	168.3	134.3	0	0	111.2
727	N	36.8	Very low	33.1	Very low	168 Å²	168	152.9 Å²	152.9	90%	0.898	82%	0.818	S	S	*	*			trans	-165.2	126.3	140.5	-101.6	-26.3	0	0	0	110.6
728	D	30.3	Very low	33.4	Very low	139 Å²	139	157.4 Å²	157.4	74%	0.743	83%	0.826	S	S	*	*			trans	-70.8	156.2	170.7	-74.7	-51.6	0	0	0	112.2
729	H	36.4	Very low	33.4	Very low	162 Å²	162	155.5 Å²	155.5	75%	0.75	82%	0.821	S	S	*	*				171.7	129.4	110	-84.4	-24.2	0	0	0	114.2
730	Y	33.3	Very low	33.5	Very low	193 Å²	193	153 Å²	153	76%	0.757	82%	0.823	S	S	*	*			trans	34.2	121.5	144	-66.6	-93.1	0	0	0	121.3
731	Y	35.1	Very low	33.7	Very low	217 Å²	217	146.2 Å²	146.2	85%	0.851	81%	0.814	S	S	*	*				-170.8	158.3	87.7	-126	-90.1	0	0	0	113.7
732	N	32.5	Very low	33.8	Very low	154 Å²	154	146.5 Å²	146.5	82%	0.824	82%	0.816	S	S	*	*			trans	-75.3	153.5	-179.3	-67.9	-56.9	0	0	0	114.5
733	G	33.4	Very low	33.7	Very low	79 Å²	79	138.9 Å²	138.9	81%	0.814	80%	0.8	S	S	*	*			trans	173.6	114.1	161.2	0	0	0	0	0	114.7
734	L	35.4	Very low	33.7	Very low	177 Å²	177	141.5 Å²	141.5	93%	0.927	80%	0.802	S	S	*	*			trans	-78.3	159.5	-179.9	-83.1	161.4	0	0	0	113.5
735	P	37.3	Very low	34	Very low	121 Å²	121	134.5 Å²	134.5	79%	0.786	79%	0.788	S	S	*	*			trans	-98.8	164	-168.1	38.9	-36.8	0	0	0	115.2
736	G	35.4	Very low	33.8	Very low	82 Å²	82	136.2 Å²	136.2	85%	0.845	79%	0.785	S	S	*	*			trans	170.7	137.9	159.7	0	0	0	0	0	114.3
737	G	33.9	Very low	34.2	Very low	69 Å²	69	133.9 Å²	133.9	71%	0.711	77%	0.774	S	S	*	*			trans	136.5	83	155.3	0	0	0	0	0	120
738	F	33.9	Very low	34.2	Very low	192 Å²	192	131.8 Å²	131.8	84%	0.842	76%	0.763	S	S	*	*			trans	53.3	121.8	131.9	-66.2	-73.2	0	0	0	124.5
739	N	32.4	Very low	34.3	Very low	138 Å²	138	134.8 Å²	134.8	74%	0.738	76%	0.763	S	S	*	*				76.8	116.5	125.6	-79.5	-4.3	0	0	0	124.7
740	S	32	Very low	34.2	Very low	119 Å²	119	133.5 Å²	133.5	83%	0.832	76%	0.762	S	S	*	*				90.5	147	116.9	76.2	0	0	0	0	121.9
741	G	34.2	Very low	34.3	Very low	73 Å²	73	129.5 Å²	129.5	75%	0.753	76%	0.758	S	S	*	*			trans	102.1	90.9	170.1	0	0	0	0	0	114
742	S	30.4	Very low	34.2	Very low	111 Å²	111	126.6 Å²	126.6	78%	0.776	76%	0.755	S	S	*	*				83.7	113.5	53.6	-167.6	0	0	0	0	115.6
743	S	31.7	Very low	34.6	Very low	87 Å²	87	124.5 Å²	124.5	61%	0.608	75%	0.75	S	S	*	*			trans	91.6	150.2	138.8	77.4	0	0	0	0	122.7
744	H	36	Very low	34.6	Very low	174 Å²	174	125.6 Å²	125.6	81%	0.806	75%	0.745	S	S	*	*			trans	73.3	134.9	171.2	-53.9	83.7	0	0	0	117.1
745	G	33.5	Very low	34.6	Very low	60 Å²	60	124.9 Å²	124.9	62%	0.619	74%	0.742	S	S	*	*			cis	149	152.5	-6.4	0	0	0	0	0	112.3
746	H	38	Very low	34.4	Very low	160 Å²	160	127.7 Å²	127.7	74%	0.741	75%	0.745	S	S	*	*			trans	69.4	151.8	167.6	-59.6	-87.3	0	0	0	116.4
747	H	37	Very low	34.3	Very low	137 Å²	137	132.9 Å²	132.9	63%	0.634	75%	0.75	S	S	*	*			cis	-161.2	150.9	1.3	-122	-38.7	0	0	0	110.8
748	N	35.7	Very low	34.3	Very low	123 Å²	123	138.4 Å²	138.4	66%	0.658	76%	0.756	S	S	*	*			trans	60.5	158.5	140.3	-67.2	-12.4	0	0	0	120.8
749	R	33.1	Very low	34.6	Very low	202 Å²	202	135 Å²	135	76%	0.762	75%	0.754	S	S	*	*			cis	175.8	140.6	-32.4	-123.3	-177.8	174.5	177.3	-0.8	105.7
750	N	34.1	Very low	34.8	Very low	136 Å²	136	132 Å²	132	73%	0.727	76%	0.755	S	S	*	*			trans	67.1	159.1	145.2	-64.6	5.8	0	0	0	116.8
751	V	35.1	Very low	34.8	Very low	108 Å²	108	133.3 Å²	133.3	66%	0.655	75%	0.748	S	S	*	*			cis	-167.5	134.7	-2.8	116.7	0	0	0	0	111.2
752	I	34.1	Very low	34.7	Very low	157 Å²	157	140.5 Å²	140.5	81%	0.805	75%	0.753	S	S	*	*			trans	73.5	153.7	136.9	-69.3	177.5	0	0	0	121.4
753	P	40.9	Very low	34.9	Very low	109 Å²	109	138.8 Å²	138.8	71%	0.708	75%	0.752	S	S	*	*			trans	-124.3	-139.6	-148.9	46.4	-31.2	0	0	0	114.8
754	S	32.4	Very low	35.2	Very low	102 Å²	102	146.1 Å²	146.1	71%	0.713	77%	0.766	S	S	*	*			trans	99.2	141.6	-172.6	-34.9	0	0	0	0	111.6
755	D	35.8	Very low	35.5	Very low	162 Å²	162	142 Å²	142	87%	0.866	76%	0.755	S	S	*	*			cis	-141	169.3	30.9	-90.4	-49.5	0	0	0	115.9
756	Q	32.4	Very low	35.7	Very low	180 Å²	180	148.2 Å²	148.2	84%	0.841	77%	0.765	S	S	*	*			trans	-93.4	157.2	173.4	-57.4	169.8	-9.1	0	0	111.8
757	M	34.7	Very low	35.6	Very low	192 Å²	192	145.5 Å²	145.5	95%	0.946	76%	0.764	S	S	*	*				-179.4	153.1	123.2	-98.4	179.6	-178.6	0	0	115.1
758	H	32.8	Very low	35.8	Very low	184 Å²	184	144.2 Å²	144.2	85%	0.852	77%	0.768	S	S	*	*			trans	-93.8	-163.9	-175.3	-84.3	-68.8	0	0	0	112.5
759	P	40.1	Very low	35.8	Very low	122 Å²	122	145.2 Å²	145.2	79%	0.792	77%	0.774	S	S	*	*			cis	-136.1	-177.4	-46.5	34.8	-17	0	0	0	114.7
760	G	36.4	Very low	35.9	Very low	74 Å²	74	141.4 Å²	141.4	76%	0.763	77%	0.773	S	S	*	*			trans	95.9	168.8	150.8	0	0	0	0	0	117.4
761	E	32.3	Very low	35.9	Very low	146 Å²	146	141 Å²	141	68%	0.682	77%	0.766	S	S	*	*			cis	-171.8	148.4	-19.1	-150.3	-166.2	-172	0	0	109.2
762	R	32.3	Very low	35.5	Very low	225 Å²	225	142.6 Å²	142.6	85%	0.849	76%	0.764	S	S	*	*			trans	66.9	156.5	169.5	-44.4	166.7	-157.3	-145.2	-3.4	114.6
763	G	35	Very low	35.4	Very low	74 Å²	74	145.1 Å²	145.1	76%	0.763	77%	0.765	S	S	*	*			cis	176.9	175.1	-1.5	0	0	0	0	0	106.6
764	R	37.2	Very low	35.2	Very low	241 Å²	241	144.8 Å²	144.8	91%	0.909	76%	0.763	S	S	*	*			cis	-165.9	-167.2	6.9	-130.2	-168.4	-155.9	-107.4	3.1	108.2
765	P	43.3	Very low	35.2	Very low	89 Å²	89	150.2 Å²	150.2	58%	0.578	77%	0.769	S	S	*	*			trans	-127.2	-141.5	-130.3	45.5	-26.1	0	0	0	115.3
766	F	36.6	Very low	35.1	Very low	189 Å²	189	147.8 Å²	147.8	83%	0.829	76%	0.756	S	S	*	*			trans	108.1	129.9	172.6	-66.8	-67.2	0	0	0	114.6
767	S	36.8	Very low	35	Very low	103 Å²	103	147.9 Å²	147.9	72%	0.72	75%	0.749	S	S	*	*			cis	-154.3	161.1	0.2	-70.7	0	0	0	0	112.4
768	P	39.9	Very low	34.8	Very low	110 Å²	110	149.4 Å²	149.4	71%	0.714	74%	0.744	S	S	*	*			trans	-111.9	173.8	179.9	41.7	-33.7	0	0	0	115.1
769	N	37.1	Very low	34.7	Very low	145 Å²	145	144 Å²	144	78%	0.775	74%	0.738	S	S	*	*			trans	166.9	130	137.9	-87.6	-13.6	0	0	0	114
770	V	35.6	Very low	34.4	Very low	122 Å²	122	145.9 Å²	145.9	74%	0.739	74%	0.742	S	S	*	*				84.2	131.1	106.1	171.8	0	0	0	0	115.4
771	E	32.6	Very low	34.2	Very low	126 Å²	126	153.4 Å²	153.4	59%	0.589	75%	0.747	S	S	*	*			cis	-160.2	177.3	-14.4	-111.9	-154.7	167	0	0	114
772	K	27.9	Very low	34.6	Very low	142 Å²	142	152.1 Å²	152.1	62%	0.617	75%	0.751	S	S	*	*			trans	0.8	149.7	148.6	-59.3	172.7	-170	147.2	0	119.6
773	Y	32.2	Very low	34.9	Very low	211 Å²	211	147.1 Å²	147.1	83%	0.827	75%	0.748	S	S	*	*				-159.4	160.6	60	-82.6	-90.8	0	0	0	115
774	P	35.1	Very low	34.9	Very low	101 Å²	101	149.1 Å²	149.1	66%	0.656	75%	0.747	S	S	*	*			trans	-118.2	175.3	167.9	37.6	-24.7	0	0	0	115.7
775	Y	33.7	Very low	34.6	Very low	216 Å²	216	146.3 Å²	146.3	85%	0.847	75%	0.747	S	S	*	*			trans	73	153.8	178.3	-67.8	-87.4	0	0	0	116
776	D	32.7	Very low	34.1	Very low	111 Å²	111	154.4 Å²	154.4	59%	0.594	77%	0.766	S	S	*	*			cis	-154.1	158	2.7	-146.9	-9.9	0	0	0	112.9
777	R	30.7	Very low	33.7	Very low	183 Å²	183	153.5 Å²	153.5	69%	0.691	76%	0.764	S	S	*	*			trans	35.2	143	144.6	-88	174	-134.1	-135.5	3	126.7
778	R	30.7	Very low	33.4	Very low	224 Å²	224	154.2 Å²	154.2	85%	0.845	76%	0.76	S	S	*	*			trans	75.4	123.5	157.5	-62.8	174.2	-124.6	-138.2	5.6	114.8
779	G	30.2	Very low	33	Very low	70 Å²	70	159.3 Å²	159.3	72%	0.722	77%	0.767	S	S	*	*				97.2	130.3	77.6	0	0	0	0	0	107.8
780	D	34.6	Very low	32.7	Very low	162 Å²	162	158.6 Å²	158.6	87%	0.866	76%	0.763	S	S	*	*			cis	-152	-166.9	23.7	-106.7	-62.9	0	0	0	112.9
781	R	31.6	Very low	32.4	Very low	231 Å²	231	160.9 Å²	160.9	87%	0.872	77%	0.765	S	S	*	*			trans	-61	162.8	-166.1	-68.4	176.1	-179.7	-141.1	-0.8	119.2
782	P	40.4	Very low	32.2	Very low	119 Å²	119	161.8 Å²	161.8	77%	0.773	77%	0.774	S	S	*	*			trans	-95.2	171.8	179	40	-37.8	0	0	0	114.5
783	P	39.5	Very low	32.2	Very low	120 Å²	120	159.3 Å²	159.3	78%	0.779	78%	0.775	S	S	*	*			trans	-115.6	147.2	162.1	37.2	-26.7	0	0	0	114
784	P	35	Very low	32.3	Very low	116 Å²	116	159.7 Å²	159.7	75%	0.753	78%	0.775	S	S	*	*			trans	-109.5	172.4	179.5	40.8	-34.8	0	0	0	115.1
785	M	30.6	Very low	31.9	Very low	183 Å²	183	158.4 Å²	158.4	90%	0.901	78%	0.78	S	S	*	*			trans	58	124.1	157	-78.9	-178.8	164	0	0	120.3
786	R	32.3	Very low	32.1	Very low	258 Å²	258	158.6 Å²	158.6	97%	0.974	78%	0.779	S	S	*	*				-156.9	160.2	119	-111.3	170.8	-169.4	-132	-0.1	112.7
787	Q	29.1	Very low	31.8	Very low	171 Å²	171	164.6 Å²	164.6	80%	0.799	79%	0.793	S	S	*	*			trans	-119.2	164.2	-161.8	-139.7	170.4	-1.4	0	0	110.2
788	N	29.6	Very low	31.8	Very low	117 Å²	117	167.2 Å²	167.2	63%	0.626	80%	0.803	S	S	*	*			trans	73.7	127.6	168.7	-49.9	-1.9	0	0	0	116.2
789	Y	32.7	Very low	32	Very low	218 Å²	218	161.5 Å²	161.5	86%	0.855	80%	0.795	S	S	*	*				-160.2	160	90.5	-102.4	-72.9	0	0	0	111.8
790	D	29.6	Very low	31.9	Very low	129 Å²	129	165 Å²	165	69%	0.69	80%	0.798	S	S	*	*			trans	-91.5	174.6	-163.3	-57.3	-79.5	0	0	0	115.6
791	E	29.8	Very low	32.1	Very low	171 Å²	171	165 Å²	165	80%	0.799	80%	0.797	S	S	*	*			trans	75.9	118.8	141.8	-88.4	174.5	-169.8	0	0	121.9
792	D	28.8	Very low	31.9	Very low	144 Å²	144	164 Å²	164	77%	0.77	79%	0.793	S	S	*	*				89.3	150.5	125.4	-88.7	2.6	0	0	0	123.9
793	S	28	Very low	31.6	Very low	91 Å²	91	165.1 Å²	165.1	64%	0.636	79%	0.793	S	S	*	*			trans	70.3	117	178.1	73.3	0	0	0	0	116.3
794	W	33.4	Very low	31.3	Very low	219 Å²	219	165.3 Å²	165.3	83%	0.83	79%	0.792	S	S	*	*				173.8	86.1	104.3	-88.7	104.5	0	0	0	110
795	G	28	Very low	31.4	Very low	73 Å²	73	164.7 Å²	164.7	75%	0.753	79%	0.788	S	S	*	*			trans	-79.3	137.3	170.2	0	0	0	0	0	112.2
796	R	36	Very low	31.6	Very low	220 Å²	220	162.5 Å²	162.5	83%	0.83	78%	0.78	S	S	*	*			trans	-141.7	113.4	153.4	-72.8	-160.8	-172.6	-149.6	3.8	111.6
797	R	26.7	Very low	31.3	Very low	237 Å²	237	159.6 Å²	159.6	89%	0.894	77%	0.769	S	S	*	*			trans	-66.5	152	161.2	-67.1	171.6	162.8	-170.3	-5.8	110.9
798	W	30.7	Very low	31.6	Very low	239 Å²	239	161.8 Å²	161.8	91%	0.905	78%	0.776	S	S	*	*			trans	-155.2	156.5	142	-89.7	99.3	0	0	0	107
799	P	35.3	Very low	31.8	Very low	103 Å²	103	160.3 Å²	160.3	67%	0.669	77%	0.768	S	S	*	*				-129.7	175	-109.5	42.2	-29.5	0	0	0	116.9
800	D	29.1	Very low	31.9	Very low	145 Å²	145	158.3 Å²	158.3	78%	0.775	76%	0.761	S	S	*	*			trans	-49.2	148.7	164.7	-88.6	-52.1	0	0	0	113.7
801	N	37.8	Very low	32.3	Very low	160 Å²	160	158.1 Å²	158.1	86%	0.856	77%	0.766	S	S	*	*			trans	-143.8	107.8	155.6	-151.6	6.3	0	0	0	111.4
802	R	28	Very low	32.4	Very low	211 Å²	211	158 Å²	158	80%	0.796	77%	0.766	S	S	*	*			trans	-99.6	137.1	167.2	-61.7	178.4	-175.3	-179.8	0.4	108.3
803	N	34.2	Very low	32.8	Very low	143 Å²	143	154.3 Å²	154.3	77%	0.765	76%	0.762	S	S	*	*			trans	158.9	105.8	155.1	-84.5	-20.8	0	0	0	108.2
804	T	33	Very low	33.2	Very low	123 Å²	123	155.6 Å²	155.6	76%	0.755	77%	0.768	S	S	*	*				71.1	155.3	88.3	55.7	0	0	0	0	114.7
805	P	37.5	Very low	33.3	Very low	104 Å²	104	151.2 Å²	151.2	68%	0.675	77%	0.768	S	S	*	*			cis	-134.7	-167.7	-15.4	32.1	-9.2	0	0	0	114.6
806	D	33.4	Very low	33.7	Very low	137 Å²	137	159.6 Å²	159.6	73%	0.733	78%	0.777	S	S	*	*			trans	74.6	100.1	148.9	-65.5	-35.3	0	0	0	123.4
807	R	27.2	Very low	33.6	Very low	197 Å²	197	159.8 Å²	159.8	74%	0.743	78%	0.777	S	S	*	*				49.1	107.7	110.9	-167.1	-178.5	-170.1	168.9	4.6	118.9	D809	R807-D809 IonicContact CZ-OD2 3.67Å; R807-D809 IonicContact NE-OD2 3.08Å; R807-D809 PolarHBondContact NE-OD2 3.01Å; R807-D809 VanDerWaalsContact NE-OD2 3.08Å; R807-D809 IonicContact NH2-OD2 3.32Å; R807-D809 PolarHBondContact NH2-OD2 3.4Å
808	F	35.6	Very low	34.4	Very low	217 Å²	217	153.9 Å²	153.9	95%	0.952	77%	0.77	S	S	*	*			trans	-131	137.5	145.6	-101.2	-87.2	0	0	0	111.2
809	D	32.2	Very low	34.8	Very low	85 Å²	85	148.4 Å²	148.4	46%	0.455	77%	0.765	S	S	.	*			trans	-113	135.6	-166.9	-102.7	-49.6	0	0	0	110.4	R807	R807-D809 IonicContact CZ-OD2 3.67Å; R807-D809 IonicContact NE-OD2 3.08Å; R807-D809 PolarHBondContact NE-OD2 3.01Å; R807-D809 VanDerWaalsContact NE-OD2 3.08Å; R807-D809 IonicContact NH2-OD2 3.32Å; R807-D809 PolarHBondContact NH2-OD2 3.4Å
810	Y	36.2	Very low	34.6	Very low	177 Å²	177	154.1 Å²	154.1	69%	0.694	77%	0.773	S	S	*	*			trans	69.7	159.1	157.6	-70.2	-58	0	0	0	119.8	Q812	Y810-Q812 HydrophobicContact CD1-CG 4.03Å; Y810-Q812 HydrophobicContact CE1-CG 4.05Å
811	P	37.2	Very low	34.8	Very low	124 Å²	124	156.2 Å²	156.2	81%	0.805	78%	0.779	S	S	*	*			cis	-123.5	163.7	21.8	39.7	-23.8	0	0	0	118.7
812	Q	31.5	Very low	34.7	Very low	169 Å²	169	157.3 Å²	157.3	79%	0.79	78%	0.778	S	S	*	*			trans	-71.3	136.6	-178.6	-56.9	-176.8	9.6	0	0	112.5	Y810	Y810-Q812 HydrophobicContact CD1-CG 4.03Å; Y810-Q812 HydrophobicContact CE1-CG 4.05Å
813	G	38	Very low	34.9	Very low	67 Å²	67	158.1 Å²	158.1	69%	0.691	78%	0.781	S	S	*	*			trans	-104.2	149.8	165.8	0	0	0	0	0	111.5
814	P	37.1	Very low	35.4	Very low	117 Å²	117	156.4 Å²	156.4	76%	0.76	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-71.9	156.7	-173.2	30.5	-36.3	0	0	0	112.8	R816	P814-R816 PolarHBondContact O-N 3.27Å; P814-R816 VanDerWaalsContact O-N 3.15Å
815	P	35.4	Very low	35.5	Very low	128 Å²	128	156.1 Å²	156.1	83%	0.831	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-65.3	116.5	-178.3	27	-34.4	0	0	0	110.8	R817	P815-R817 PolarHBondContact O-N 3.5Å
816	R	35.3	Very low	35.2	Very low	249 Å²	249	159.3 Å²	159.3	94%	0.94	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-69.8	116.1	173.2	-74.6	-171.9	174.1	-129.4	0.3	109.3	P814	P814-R816 PolarHBondContact O-N 3.27Å; P814-R816 VanDerWaalsContact O-N 3.15Å
817	R	34.7	Very low	36	Very low	223 Å²	223	158.2 Å²	158.2	84%	0.842	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-59.5	149	173.7	-63.9	179.8	179.1	-162.7	-1.8	110.6	P815	P815-R817 PolarHBondContact O-N 3.5Å
818	P	42.6	Very low	36.4	Very low	113 Å²	113	155.7 Å²	155.7	73%	0.734	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-61.5	152.7	169.4	28.3	-34.8	0	0	0	110.5	R820	P818-R820 PolarHBondContact O-N 3.08Å
819	P	38.6	Very low	36.2	Very low	125 Å²	125	154.5 Å²	154.5	81%	0.812	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-59.6	138.1	178.2	-20.7	32.6	0	0	0	111.1	E821	P819-E821 PolarHBondContact O-N 3.48Å
820	R	31.3	Very low	36.6	Very low	223 Å²	223	161.6 Å²	161.6	84%	0.842	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-64.7	128.1	169.5	-83.5	176.1	161.8	167.1	-7.8	109.2	P818 H822	P818-R820 PolarHBondContact O-N 3.08Å; R820-H822 PolarHBondContact O-N 3.24Å; R820-H822 VanDerWaalsContact O-N 3.08Å
821	E	34	Very low	36.5	Very low	189 Å²	189	158.6 Å²	158.6	88%	0.883	80%	0.804	S	S	*	*			trans	-59.4	111.2	164.7	-68.7	177.9	145.6	0	0	109.4	P819 R823	P819-E821 PolarHBondContact O-N 3.48Å; E821-R823 VanDerWaalsContact C-N 3.31Å; E821-R823 PolarHBondContact O-N 3.08Å
822	H	36	Very low	36.6	Very low	183 Å²	183	159.1 Å²	159.1	85%	0.847	80%	0.801	S	S	*	*			trans	-73.1	92.2	165.5	-91	-85	0	0	0	108.6	R820 P824	R820-H822 PolarHBondContact O-N 3.24Å; R820-H822 VanDerWaalsContact O-N 3.08Å; H822-P824 WeakPolarHBondContact O-CD 3.44Å
823	R	31	Very low	36.8	Very low	227 Å²	227	155.7 Å²	155.7	86%	0.857	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-60	119.6	169.3	-164.8	-176.9	-62.1	-161.3	-0.4	108.5	E821	E821-R823 VanDerWaalsContact C-N 3.31Å; E821-R823 PolarHBondContact O-N 3.08Å
824	P	45.1	Very low	36.8	Very low	108 Å²	108	162.5 Å²	162.5	70%	0.701	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-67.8	150.5	173	29.2	-33.4	0	0	0	109.9	H822	H822-P824 WeakPolarHBondContact O-CD 3.44Å
825	P	35.1	Very low	37.1	Very low	117 Å²	117	165.8 Å²	165.8	76%	0.76	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-73.4	147.4	-176.5	30.5	-34.6	0	0	0	111.7	P827	P825-P827 WeakPolarHBondContact O-CD 3.43Å
826	H	32.5	Very low	37.3	Very low	170 Å²	170	165.3 Å²	165.3	79%	0.787	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-67.4	127.7	167.3	-140.5	-76.1	0	0	0	108.8
827	P	49.2	Very low	37.8	Very low	115 Å²	115	161.2 Å²	161.2	75%	0.747	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-85.8	130.1	165.5	-6.1	24.9	0	0	0	109.4	P825	P825-P827 WeakPolarHBondContact O-CD 3.43Å
828	D	35.7	Very low	38.6	Very low	143 Å²	143	156.1 Å²	156.1	77%	0.765	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-77.5	158.1	170.9	-75.5	-56.2	0	0	0	112.3
829	F	31	Very low	38.5	Very low	192 Å²	192	155.9 Å²	155.9	84%	0.842	79%	0.789	S	S	*	*			trans	-18.4	126.7	161	-76.6	-106.2	0	0	0	116.9
830	Y	40.3	Very low	38.7	Very low	235 Å²	235	156.6 Å²	156.6	92%	0.922	79%	0.787	S	S	*	*				-157.3	153.2	125.4	-100.6	-78.4	0	0	0	109.1
831	P	35	Very low	39	Very low	113 Å²	113	156 Å²	156	73%	0.734	79%	0.79	S	S	*	*			trans	-102	147.3	-168.1	36.9	-28.1	0	0	0	113.5
832	D	38.2	Very low	39.5	Very low	136 Å²	136	152.8 Å²	152.8	73%	0.727	78%	0.783	S	S	*	*			trans	-108.5	120.3	167.4	-168.5	4.4	0	0	0	111	R834	D832-R834 IonicContact OD1-NH2 3.14Å
833	P	37.5	Very low	39.5	Very low	96 Å²	96	149 Å²	149	62%	0.623	78%	0.775	S	S	*	*			trans	-92.3	116.3	175.4	33.4	-30.4	0	0	0	111.7
834	R	36.9	Very low	40.5	Very low	210 Å²	210	144.5 Å²	144.5	79%	0.792	78%	0.775	S	S	*	*			trans	177.9	106.5	147.7	-101.8	154.2	-70.2	-173.5	5.5	111.7	D832	D832-R834 IonicContact OD1-NH2 3.14Å
835	H	43.3	Very low	40.3	Very low	186 Å²	186	147 Å²	147	86%	0.861	78%	0.777	S	S	*	*			trans	175.4	127.6	132.1	-99.2	-72.5	0	0	0	109.3
836	P	40.5	Very low	40.5	Very low	119 Å²	119	150.3 Å²	150.3	77%	0.773	78%	0.779	S	S	*	*			trans	-86.2	135.9	-174.9	33	-33.3	0	0	0	112.4
837	L	45.2	Very low	40.6	Very low	163 Å²	163	153.8 Å²	153.8	85%	0.853	79%	0.786	S	S	*	*			trans	-115.2	147.3	165.8	-70.8	175.4	0	0	0	109.8
838	P	50.7	Low	40.6	Very low	116 Å²	116	153.8 Å²	153.8	75%	0.753	79%	0.786	S	S	*	*			trans	-73.8	153.9	-176.4	31	-35.6	0	0	0	112.5
839	P	40.9	Very low	40.9	Very low	107 Å²	107	152.8 Å²	152.8	70%	0.695	79%	0.787	S	S	*	*			trans	-88.4	161.6	-171.4	35.6	-36.6	0	0	0	114.2
840	N	43.4	Very low	41.6	Very low	141 Å²	141	149.1 Å²	149.1	75%	0.754	78%	0.783	S	S	*	*			trans	80.7	100.1	162.6	-51.2	-31.3	0	0	0	118.3
841	F	37	Very low	41.7	Very low	210 Å²	210	147.1 Å²	147.1	92%	0.921	78%	0.784	S	S	*	*				-153.1	145.8	105	-131.1	-100.3	0	0	0	112
842	V	45.1	Very low	42.1	Very low	121 Å²	121	145.3 Å²	145.3	73%	0.733	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-102.5	136.5	-166.9	175.1	0	0	0	0	111.5
843	P	34.8	Very low	42.2	Very low	104 Å²	104	145.5 Å²	145.5	68%	0.675	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-87.8	139.1	174	34.2	-32.9	0	0	0	112.2
844	P	53.1	Low	42.2	Very low	132 Å²	132	145 Å²	145	86%	0.857	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-83.3	126.3	175.6	31.5	-32	0	0	0	112.2
845	H	40.2	Very low	42.1	Very low	161 Å²	161	138.9 Å²	138.9	75%	0.745	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-90.6	142	176.5	-97.9	-42.1	0	0	0	113.5
846	K	40.1	Very low	41.9	Very low	186 Å²	186	139.1 Å²	139.1	81%	0.809	81%	0.81	S	S	*	*			trans	56.2	130.4	140.9	-66	178.2	176.9	176.9	0	120.2
847	R	35	Very low	41.6	Very low	243 Å²	243	139.1 Å²	139.1	92%	0.917	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-66.4	146.7	175.7	-47.6	174.1	-167.7	-154.1	1.4	112.8
848	P	48.3	Very low	41.7	Very low	115 Å²	115	137.4 Å²	137.4	75%	0.747	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-92.6	163.9	151	35.4	-29.5	0	0	0	112
849	P	43.3	Very low	41.1	Very low	123 Å²	123	137.8 Å²	137.8	80%	0.799	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-85.8	169.7	-178.8	35.5	-36	0	0	0	113.9
850	P	44	Very low	41.1	Very low	115 Å²	115	141.7 Å²	141.7	75%	0.747	81%	0.813	S	S	*	*			trans	-104.2	163.1	-166.4	39.2	-35	0	0	0	116.3
851	M	43.4	Very low	40.8	Very low	193 Å²	193	140.6 Å²	140.6	95%	0.951	81%	0.805	S	S	*	*			trans	127.5	139.2	149.9	-70.6	-154.1	-70.4	0	0	115.3
852	G	43.2	Very low	40.9	Very low	75 Å²	75	141.9 Å²	141.9	77%	0.773	80%	0.804	S	S	*	*			trans	130.7	100	172	0	0	0	0	0	113.5
853	P	41.1	Very low	40.4	Very low	140 Å²	140	143.6 Å²	143.6	91%	0.909	80%	0.801	S	S	*	*			trans	-97.4	152.3	-170.4	36.7	-34.3	0	0	0	114.4
854	G	36.9	Very low	40.6	Very low	84 Å²	84	149.2 Å²	149.2	87%	0.866	81%	0.811	S	S	*	*			trans	160.7	137.6	163.2	0	0	0	0	0	114.2
855	G	35	Very low	39.8	Very low	82 Å²	82	148 Å²	148	85%	0.845	80%	0.803	S	S	*	*			trans	115	85.1	167.6	0	0	0	0	0	115.9
856	Q	39.6	Very low	39.3	Very low	192 Å²	192	152.3 Å²	152.3	90%	0.897	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-47.1	147.9	175.8	-65.9	155.7	-40.1	0	0	116.4
857	P	33.2	Very low	39.2	Very low	118 Å²	118	152.1 Å²	152.1	77%	0.766	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-92.8	154.1	156	37.1	-31.2	0	0	0	111.9
858	P	47.4	Very low	39.2	Very low	127 Å²	127	148.2 Å²	148.2	83%	0.825	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-95.9	143.3	168.7	33.9	-29.2	0	0	0	113.7
859	D	38.1	Very low	38.8	Very low	124 Å²	124	148.2 Å²	148.2	66%	0.663	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-51.4	157	179.5	-65.8	-73.4	0	0	0	118.6
860	H	41.4	Very low	38.4	Very low	189 Å²	189	147.2 Å²	147.2	88%	0.875	81%	0.808	S	S	*	*				178.3	102.8	117	-89.3	-58.5	0	0	0	108.6
861	M	36.2	Very low	37.8	Very low	119 Å²	119	153 Å²	153	59%	0.586	82%	0.815	S	S	*	*			cis	94.4	101.5	34.2	-164	-164.1	-153.6	0	0	114.8	K863	M861-K863 HydrophobicContact CE-CD 4.04Å
862	R	38.8	Very low	37.5	Very low	237 Å²	237	150.9 Å²	150.9	89%	0.894	81%	0.813	S	S	*	*			trans	-179.9	91.3	147.2	-100.3	170.2	-170.8	-152.2	2	107.5
863	K	35.4	Very low	37.1	Very low	157 Å²	157	156.9 Å²	156.9	68%	0.683	82%	0.817	S	S	*	*				52.2	119.3	73.8	-73.4	-167.8	174.1	-177.7	0	114.7	M861	M861-K863 HydrophobicContact CE-CD 4.04Å
864	Y	38.4	Very low	36.9	Very low	222 Å²	222	155.6 Å²	155.6	87%	0.871	81%	0.809	S	S	*	*				-163.5	160.9	114.2	-86.8	-60	0	0	0	109.3
865	P	37	Very low	37.1	Very low	107 Å²	107	156.3 Å²	156.3	70%	0.695	80%	0.798	S	S	*	*			trans	-125.4	168	-140.9	29.9	-8.2	0	0	0	115.9
866	R	29.3	Very low	37.1	Very low	250 Å²	250	163.5 Å²	163.5	94%	0.943	80%	0.8	S	S	*	*			trans	-78.6	141.7	163.2	-77.1	-178.3	171.9	173.5	-3.3	111
867	Q	37.4	Very low	37.1	Very low	182 Å²	182	160.5 Å²	160.5	85%	0.85	80%	0.796	S	S	*	*			trans	-136.2	134.1	161.9	-77.8	-176	-18.2	0	0	108.4
868	D	35	Very low	37.2	Very low	161 Å²	161	158 Å²	158	86%	0.861	79%	0.791	S	S	*	*			trans	-67.9	155.5	163.5	-63.1	-54.9	0	0	0	110.1
869	P	41.1	Very low	36.7	Very low	116 Å²	116	162 Å²	162	75%	0.753	79%	0.791	S	S	*	*				-145.6	132.8	117.6	32	-14.9	0	0	0	116.1
870	S	34.1	Very low	36.9	Very low	102 Å²	102	162.9 Å²	162.9	71%	0.713	80%	0.796	S	S	*	*			trans	7.9	128.5	141	65.4	0	0	0	0	121.7
871	R	31.5	Very low	36.4	Very low	237 Å²	237	162.9 Å²	162.9	89%	0.894	79%	0.788	S	S	*	*				72.4	94.3	117.7	-168	-168	-164.2	178.9	5.3	119.8
872	T	37.1	Very low	36.2	Very low	147 Å²	147	172.6 Å²	172.6	90%	0.902	82%	0.819	S	S	*	*			trans	-156	129.2	143	25.8	0	0	0	0	112.3
873	K	34.2	Very low	36.1	Very low	201 Å²	201	169.4 Å²	169.4	87%	0.874	82%	0.815	S	S	*	*			trans	-96.3	-173.5	156.6	-60	-176.8	171.9	-176.5	0	107.9
874	P	38.8	Very low	36.1	Very low	113 Å²	113	170.1 Å²	170.1	73%	0.734	82%	0.822	S	S	*	*			cis	-128.4	-139.9	-8	40.6	-18.1	0	0	0	109.3
875	P	40.7	Very low	36	Very low	99 Å²	99	167.2 Å²	167.2	64%	0.643	82%	0.819	S	S	*	*			cis	-137.9	146.7	-17.1	32.6	-10.7	0	0	0	118.6
876	W	34.8	Very low	36	Very low	233 Å²	233	170.7 Å²	170.7	88%	0.883	83%	0.827	S	S	*	*			trans	72.2	146.6	130.9	-76.3	65.5	0	0	0	125.6
877	T	39	Very low	36.4	Very low	130 Å²	130	165.8 Å²	165.8	80%	0.798	82%	0.819	S	S	*	*			trans	65.3	137.1	161.6	56.2	0	0	0	0	119.3
878	G	35.2	Very low	36.3	Very low	66 Å²	66	164.7 Å²	164.7	68%	0.68	82%	0.817	S	S	*	*			cis	163.3	171.1	-5.6	0	0	0	0	0	113.2
879	Y	37.7	Very low	36.4	Very low	210 Å²	210	164.9 Å²	164.9	82%	0.824	81%	0.814	S	S	*	*			trans	86	93.5	168.9	-75.9	-92.1	0	0	0	121.5
880	N	41.6	Very low	36	Very low	142 Å²	142	168.7 Å²	168.7	76%	0.759	82%	0.819	S	S	*	*				77.7	119.6	122.1	-68.4	9.7	0	0	0	123.8
881	R	30.6	Very low	36.2	Very low	189 Å²	189	174.3 Å²	174.3	71%	0.713	83%	0.828	S	S	*	*			trans	-52.6	147	151.3	-72.8	176.4	170.3	171.2	-4.4	112.1	E673	E673-R881 IonicContact OE2-CZ 3.47Å; E673-R881 IonicContact OE2-NH1 3.09Å; E673-R881 PolarHBondContact OE2-NH1 3.32Å; E673-R881 VanDerWaalsContact OE2-NH1 3.09Å; E673-R881 IonicContact OE2-NH2 2.83Å; E673-R881 PolarHBondContact OE2-NH2 3.15Å
882	W	32.9	Very low	36.6	Very low	324 Å²	324	168.5 Å²	168.5	100%	1.227	82%	0.821	S	S	*	*				-125.3	0	116.6	-101.3	75.3	0	0	0	108

Retrieved 882 of 882 residues in 471.1 ms (Link to these results)

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