A0A087X8J0_POEFO Loading...

Leucine rich repeat transmembrane neuronal 2

AlphaFold DB , UniProt , Accession A0A087X8J0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 546 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	36.9	Very low	36.7	Very low	245 Å²	245	154.9 Å²	154.9	100%	1.207	82%	0.823	S	S	*	*				0	115.1	0	-55.4	167.3	-173.7	0	0	104.8
2	G	35.9	Very low	37.4	Very low	68 Å²	68	150.8 Å²	150.8	70%	0.701	81%	0.812	S	S	*	*			cis	89.1	123.9	33.3	0	0	0	0	0	108.1
3	F	32.3	Very low	38.4	Very low	201 Å²	201	145.1 Å²	145.1	88%	0.882	80%	0.798	S	S	*	*			cis	-131.4	169.6	12.6	-85.3	-117.5	0	0	0	110.1
4	H	34.9	Very low	39.2	Very low	160 Å²	160	141.5 Å²	141.5	74%	0.741	79%	0.785	S	S	*	*			cis	127.6	96.4	-0.5	-159.3	12.8	0	0	0	111.3
5	S	30.7	Very low	40	Very low	111 Å²	111	137.9 Å²	137.9	78%	0.776	77%	0.768	S	S	*	*			trans	-158.7	87.6	168.8	41.2	0	0	0	0	110.4
6	R	32.6	Very low	40.6	Very low	228 Å²	228	133.3 Å²	133.3	86%	0.86	75%	0.752	S	S	*	*				55.3	104.3	102.6	-71.2	-168.1	176.5	-160.6	-0.5	115.3
7	W	37	Very low	41.2	Very low	218 Å²	218	132.9 Å²	132.9	83%	0.826	75%	0.747	S	S	*	*			trans	-68.9	164.5	152.9	-73.4	14.2	0	0	0	110.4	L9	W7-L9 HydrophobicContact CE3-CD1 3.99Å; W7-L9 HydrophobicContact CE3-CG 3.95Å; W7-L9 HydrophobicContact CZ3-CD1 3.6Å; W7-L9 HydrophobicContact CZ3-CG 3.95Å
8	P	36.9	Very low	41.9	Very low	120 Å²	120	129.1 Å²	129.1	78%	0.779	73%	0.731	S	S	*	*				-136.1	144.9	100.3	37.2	-27.5	0	0	0	115	V10	P8-V10 PolarHBondContact O-N 3.11Å
9	L	46	Very low	42.6	Very low	148 Å²	148	126.2 Å²	126.2	78%	0.775	72%	0.716	S	S	*	*			trans	-77.7	103.1	162.5	-85.9	167.3	0	0	0	110	W7	W7-L9 HydrophobicContact CE3-CD1 3.99Å; W7-L9 HydrophobicContact CE3-CG 3.95Å; W7-L9 HydrophobicContact CZ3-CD1 3.6Å; W7-L9 HydrophobicContact CZ3-CG 3.95Å
10	V	39.8	Very low	43.2	Very low	143 Å²	143	124.7 Å²	124.7	87%	0.867	71%	0.705	S	S	*	*			trans	-147.1	117	158.1	-171.6	0	0	0	0	109.3	P8	P8-V10 PolarHBondContact O-N 3.11Å
11	G	40.4	Very low	43.7	Very low	62 Å²	62	122.5 Å²	122.5	64%	0.639	70%	0.698	S	S	*	*	S	Bend	trans	172.6	139.9	177	0	0	0	0	0	112	A13	G11-A13 PolarHBondContact O-N 3.15Å; G11-A13 VanDerWaalsContact O-N 3.15Å
12	P	45.8	Very low	44.4	Very low	106 Å²	106	117.2 Å²	117.2	69%	0.688	67%	0.672	S	S	*	*			trans	-81.7	99.4	-164.6	31.2	-35.6	0	0	0	113.8
13	A	50.3	Low	45	Very low	76 Å²	76	119 Å²	119	63%	0.628	66%	0.664	S	S	*	*	H	α-helix	trans	-68.4	-18.3	174	0	0	0	0	0	118.4	G11	G11-A13 PolarHBondContact O-N 3.15Å; G11-A13 VanDerWaalsContact O-N 3.15Å
14	P	49.6	Very low	45.7	Very low	95 Å²	95	113.9 Å²	113.9	62%	0.617	65%	0.646	S	S	*	*	H	α-helix	trans	-77.6	-22.7	-176.2	30.5	-34.4	0	0	0	113.7	S18	P14-S18 WeakPolarHBondContact O-CB 3.44Å; P14-S18 PolarHBondContact O-N 3.39Å; P14-S18 VanDerWaalsContact O-N 3.13Å
15	V	51.1	Low	46.2	Very low	88 Å²	88	109.2 Å²	109.2	53%	0.533	64%	0.635	S	S	.	*	H	α-helix	trans	-74	-43.7	-172.4	-171.2	0	0	0	0	111.7	L17 S18 V19	V15-L17 PolarHBondContact O-N 3.04Å; V15-S18 WeakPolarHBondContact O-CB 3.28Å; V15-S18 PolarHBondContact O-N 2.9Å; V15-V19 HydrophobicContact CG1-CG2 4.47Å; V15-V19 WeakPolarHBondContact O-CG2 3.45Å; V15-V19 PolarHBondContact O-N 2.86Å
16	A	49.3	Very low	46.8	Very low	63 Å²	63	109.3 Å²	109.3	52%	0.521	63%	0.634	S	S	.	*	H	α-helix	trans	-63.3	-42.4	-179.3	0	0	0	0	0	112.5	V19 I20	A16-V19 PolarHBondContact O-N 3.15Å; A16-I20 WeakPolarHBondContact O-CG1 3.48Å; A16-I20 PolarHBondContact O-N 2.74Å
17	L	51.1	Low	47.3	Very low	127 Å²	127	105.1 Å²	105.1	67%	0.665	63%	0.628	S	S	*	*	H	α-helix	trans	-68.6	-36.3	176.1	-74.3	165.4	0	0	0	112	V15 S21	V15-L17 PolarHBondContact O-N 3.04Å; L17-S21 VanDerWaalsContact O-CB 3.29Å; L17-S21 WeakPolarHBondContact O-CB 3.28Å; L17-S21 PolarHBondContact O-N 3.07Å
18	S	53.2	Low	47.5	Very low	65 Å²	65	101.1 Å²	101.1	46%	0.455	62%	0.622	S	S	.	*	H	α-helix	trans	-61.6	-46.2	172.8	176.5	0	0	0	0	112.1	P14 V15 S21 M22	P14-S18 WeakPolarHBondContact O-CB 3.44Å; P14-S18 PolarHBondContact O-N 3.39Å; P14-S18 VanDerWaalsContact O-N 3.13Å; V15-S18 WeakPolarHBondContact O-CB 3.28Å; V15-S18 PolarHBondContact O-N 2.9Å; S18-S21 PolarHBondContact O-N 3.32Å; S18-M22 PolarHBondContact O-N 3.41Å
19	V	55	Low	47.8	Very low	74 Å²	74	99.4 Å²	99.4	45%	0.448	61%	0.613	S	S	.	*	H	α-helix	trans	-65.7	-41.6	178.6	172.3	0	0	0	0	111.7	V15 A16 S21 M22 L23	V15-V19 HydrophobicContact CG1-CG2 4.47Å; V15-V19 WeakPolarHBondContact O-CG2 3.45Å; V15-V19 PolarHBondContact O-N 2.86Å; A16-V19 PolarHBondContact O-N 3.15Å; V19-S21 VanDerWaalsContact C-N 3.34Å; V19-M22 PolarHBondContact O-N 3.13Å; V19-L23 HydrophobicContact CG1-CD1 3.99Å; V19-L23 WeakPolarHBondContact O-CB 3.36Å; V19-L23 WeakPolarHBondContact O-CG 3.45Å; V19-L23 PolarHBondContact O-N 3.04Å
20	I	56.2	Low	47.5	Very low	96 Å²	96	98.7 Å²	98.7	49%	0.492	62%	0.617	S	S	.	*	H	α-helix	trans	-65.8	-38	175.1	-67.2	167.1	0	0	0	111	A16 L23 L24	A16-I20 WeakPolarHBondContact O-CG1 3.48Å; A16-I20 PolarHBondContact O-N 2.74Å; I20-L23 PolarHBondContact O-N 2.81Å; I20-L24 HydrophobicContact CG2-CD1 4.18Å; I20-L24 PolarHBondContact O-N 3.28Å
21	S	53.7	Low	47.6	Very low	79 Å²	79	95.4 Å²	95.4	55%	0.552	61%	0.605	S	S	*	*	H	α-helix	trans	-67.7	-35.3	175.4	-168.6	0	0	0	0	112.8	L17 S18 V19 A25	L17-S21 VanDerWaalsContact O-CB 3.29Å; L17-S21 WeakPolarHBondContact O-CB 3.28Å; L17-S21 PolarHBondContact O-N 3.07Å; S18-S21 PolarHBondContact O-N 3.32Å; V19-S21 VanDerWaalsContact C-N 3.34Å; S21-A25 VanDerWaalsContact O-CB 3.3Å; S21-A25 WeakPolarHBondContact O-CB 3.4Å; S21-A25 PolarHBondContact O-N 3.07Å
22	M	51.1	Low	47.9	Very low	134 Å²	134	96.9 Å²	96.9	66%	0.66	61%	0.606	S	S	*	*	H	α-helix	trans	-67.9	-42.6	171.6	-81.8	-170.8	159.7	0	0	111.7	S18 V19 L24 A25 C26	S18-M22 PolarHBondContact O-N 3.41Å; V19-M22 PolarHBondContact O-N 3.13Å; M22-L24 PolarHBondContact O-N 3.08Å; M22-A25 PolarHBondContact O-N 3.26Å; M22-C26 PolarHBondContact O-N 2.84Å
23	L	47.6	Very low	47.9	Very low	105 Å²	105	97.5 Å²	97.5	55%	0.55	61%	0.611	S	S	.	*	H	α-helix	trans	-62.8	-41.4	176.5	-75.5	164.9	0	0	0	112	V19 I20 C26 L27	V19-L23 HydrophobicContact CG1-CD1 3.99Å; V19-L23 WeakPolarHBondContact O-CB 3.36Å; V19-L23 WeakPolarHBondContact O-CG 3.45Å; V19-L23 PolarHBondContact O-N 3.04Å; I20-L23 PolarHBondContact O-N 2.81Å; L23-C26 PolarHBondContact O-N 3.19Å; L23-L27 WeakPolarHBondContact O-CD1 3.5Å; L23-L27 VanDerWaalsContact O-CG 3.3Å; L23-L27 WeakPolarHBondContact O-CG 3.04Å; L23-L27 PolarHBondContact O-N 3.03Å
24	L	47	Very low	48.3	Very low	94 Å²	94	95.3 Å²	95.3	49%	0.492	59%	0.59	S	S	.	*	H	α-helix	trans	-68.9	-36	173.1	-99.3	75.1	0	0	0	112.8	I20 M22 C26 L27 L28	I20-L24 HydrophobicContact CG2-CD1 4.18Å; I20-L24 PolarHBondContact O-N 3.28Å; M22-L24 PolarHBondContact O-N 3.08Å; L24-C26 VanDerWaalsContact C-N 3.33Å; L24-C26 PolarHBondContact O-N 2.95Å; L24-L27 CarbonylContact O-C 3.42Å; L24-L27 PolarHBondContact O-N 2.87Å; L24-L27 VanDerWaalsContact O-N 3.07Å; L24-L28 WeakPolarHBondContact O-CB 3.26Å; L24-L28 PolarHBondContact O-N 3.42Å
25	A	45.8	Very low	49.4	Very low	61 Å²	61	96.2 Å²	96.2	50%	0.504	59%	0.594	S	S	.	*	H	α-helix	trans	-62.7	-39.6	174.9	0	0	0	0	0	111.9	S21 M22 L27 L28	S21-A25 VanDerWaalsContact O-CB 3.3Å; S21-A25 WeakPolarHBondContact O-CB 3.4Å; S21-A25 PolarHBondContact O-N 3.07Å; M22-A25 PolarHBondContact O-N 3.26Å; A25-L27 VanDerWaalsContact C-N 3.26Å; A25-L27 PolarHBondContact O-N 2.92Å; A25-L28 PolarHBondContact O-N 3.37Å
26	C	43.3	Very low	51	Low	113 Å²	113	94.7 Å²	94.7	76%	0.764	59%	0.586	S	S	*	*	H	α-helix	trans	-69.7	-17.8	172.4	-70	0	0	0	0	114.1	M22 L23 L24	M22-C26 PolarHBondContact O-N 2.84Å; L23-C26 PolarHBondContact O-N 3.19Å; L24-C26 VanDerWaalsContact C-N 3.33Å; L24-C26 PolarHBondContact O-N 2.95Å
27	L	43.6	Very low	52.7	Low	140 Å²	140	93 Å²	93	73%	0.733	57%	0.57	S	S	*	*	H	α-helix	trans	-94.1	-11.2	175.7	-70.8	166.5	0	0	0	113.4	L23 L24 A25	L23-L27 WeakPolarHBondContact O-CD1 3.5Å; L23-L27 VanDerWaalsContact O-CG 3.3Å; L23-L27 WeakPolarHBondContact O-CG 3.04Å; L23-L27 PolarHBondContact O-N 3.03Å; L24-L27 CarbonylContact O-C 3.42Å; L24-L27 PolarHBondContact O-N 2.87Å; L24-L27 VanDerWaalsContact O-N 3.07Å; A25-L27 VanDerWaalsContact C-N 3.26Å; A25-L27 PolarHBondContact O-N 2.92Å
28	L	41.2	Very low	53.9	Low	135 Å²	135	96.9 Å²	96.9	71%	0.707	59%	0.585	S	S	*	*	S	Bend	trans	-109.2	52.8	-178.8	-78.3	164.8	0	0	0	112.1	L24 A25	L24-L28 WeakPolarHBondContact O-CB 3.26Å; L24-L28 PolarHBondContact O-N 3.42Å; A25-L28 PolarHBondContact O-N 3.37Å
29	S	42.2	Very low	55.3	Low	84 Å²	84	99.7 Å²	99.7	59%	0.587	59%	0.589	S	S	*	*			trans	-154.6	97.7	167	-79.7	0	0	0	0	111.5	A31	S29-A31 PolarHBondContact O-N 3.44Å
30	P	41.2	Very low	56.9	Low	133 Å²	133	97 Å²	97	86%	0.864	57%	0.574	S	S	*	*			trans	-76.9	39.8	164.4	35.9	-35.8	0	0	0	111.1	S32	P30-S32 VanDerWaalsContact C-N 3.34Å; P30-S32 PolarHBondContact O-N 3.46Å; P30-S32 VanDerWaalsContact O-N 3.15Å
31	A	42	Very low	58.6	Low	73 Å²	73	100.4 Å²	100.4	60%	0.603	58%	0.58	S	S	*	*			trans	-77.6	91.5	163.8	0	0	0	0	0	106.4	S29 C33	S29-A31 PolarHBondContact O-N 3.44Å; A31-C33 PolarHBondContact O-N 3.33Å
32	S	44.7	Very low	60.3	Low	94 Å²	94	98.6 Å²	98.6	66%	0.657	57%	0.567	S	S	*	*			trans	-55.2	103.7	177.2	-60.4	0	0	0	0	109.8	P30 T34	P30-S32 VanDerWaalsContact C-N 3.34Å; P30-S32 PolarHBondContact O-N 3.46Å; P30-S32 VanDerWaalsContact O-N 3.15Å; S32-T34 PolarHBondContact O-N 3.18Å
33	C	46.1	Very low	62.2	Low	118 Å²	118	95.6 Å²	95.6	80%	0.797	55%	0.551	S	S	*	*			trans	-70.2	81.7	174.3	-73.6	0	0	0	0	110.2	A31 T35	A31-C33 PolarHBondContact O-N 3.33Å; C33-T35 PolarHBondContact O-N 3.28Å
34	T	59.5	Low	64.1	Low	30 Å²	30	98.1 Å²	98.1	18%	0.184	57%	0.565	C	S	.	*			trans	-62	88.4	158.3	45.1	0	0	0	0	108	S32 C36 K63	S32-T34 PolarHBondContact O-N 3.18Å; T34-C36 PolarHBondContact O-N 3.01Å; T34-C36 VanDerWaalsContact O-N 3.13Å; T34-K63 VanDerWaalsContact CG2-O 3.27Å; T34-K63 WeakPolarHBondContact CG2-O 3.33Å
35	T	73.3	Confident	66.2	Low	115 Å²	115	96.9 Å²	96.9	71%	0.706	56%	0.559	S	S	*	*	P	Polyproline II helix	trans	-56.5	117.6	175.5	28.1	0	0	0	0	109.5	C33	C33-T35 PolarHBondContact O-N 3.28Å
36	C	83.8	Confident	68.4	Low	55 Å²	55	97.1 Å²	97.1	37%	0.372	55%	0.549	S	S	.	.	P	Polyproline II helix	trans	-55.8	125.8	177.2	-169.9	0	0	0	0	110.1	T34 C40 C42	T34-C36 PolarHBondContact O-N 3.01Å; T34-C36 VanDerWaalsContact O-N 3.13Å; C36-C40 PolarHBondContact SG-O 3.42Å; C36-C40 VanDerWaalsContact SG-O 3.34Å; C36-C42 WeakPolarHBondContact CA-SG 3.14Å; C36-C42 HydrophobicContact CB-CB 3.75Å; C36-C42 WeakPolarHBondContact CB-SG 3.49Å; C36-C42 WeakPolarHBondContact SG-CB 3.48Å; C36-C42 CovalentContact SG-SG 2.03Å; C36-C42 PolarHBondContact SG-SG 2.7Å
37	P	84.8	Confident	70.8	Confident	28 Å²	28	91.8 Å²	91.8	18%	0.182	51%	0.513	C	S	.	.	P	Polyproline II helix	trans	-60.8	140	177.7	-20.4	30.5	0	0	0	110.4	K39 C40 P58 V61	P37-K39 PolarHBondContact O-N 2.94Å; P37-C40 HydrophobicContact CB-CB 4.35Å; P37-C40 HydrophobicContact CG-CB 4.45Å; P37-C40 PolarHBondContact O-N 3.22Å; P37-P58 HydrophobicContact CB-CB 4.41Å; P37-P58 HydrophobicContact CG-CB 4.17Å; P37-P58 HydrophobicContact CG-CG 4.25Å; P37-V61 HydrophobicContact CG-CG2 3.34Å
38	Q	76.9	Confident	73.2	Confident	208 Å²	208	88.1 Å²	88.1	97%	0.972	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-14.6	-170.7	-68.6	-167.4	-19.1	0	0	115.6
39	K	81.6	Confident	75.7	Confident	124 Å²	124	81.7 Å²	81.7	54%	0.539	46%	0.456	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.8	-5.8	175.3	-81.2	-167.9	168.3	-166.7	0	114.2	P37 Q52	P37-K39 PolarHBondContact O-N 2.94Å; K39-Q52 HydrophobicContact CB-CB 4.43Å; K39-Q52 HydrophobicContact CB-CG 4.04Å; K39-Q52 HydrophobicContact CD-CB 4.25Å; K39-Q52 PolarHBondContact NZ-O 3.25Å; K39-Q52 VanDerWaalsContact NZ-O 3.1Å; K39-Q52 VanDerWaalsContact O-CG 3.27Å; K39-Q52 WeakPolarHBondContact O-CG 3.31Å; K39-Q52 PolarHBondContact O-OE1 3.4Å
40	C	89.1	Confident	78.2	Confident	19 Å²	19	79.6 Å²	79.6	13%	0.128	44%	0.439	C	S	.	.	S	Bend	trans	-108.1	155.5	-175.8	-52.9	0	0	0	0	111.8	C36 P37 Y48 C49	C36-C40 PolarHBondContact SG-O 3.42Å; C36-C40 VanDerWaalsContact SG-O 3.34Å; P37-C40 HydrophobicContact CB-CB 4.35Å; P37-C40 HydrophobicContact CG-CB 4.45Å; P37-C40 PolarHBondContact O-N 3.22Å; C40-Y48 WeakPolarHBondContact CA-O 3.39Å; C40-Y48 WeakPolarHBondContact CB-O 3.43Å; C40-C49 HydrophobicContact CB-CB 4.07Å; C40-C49 WeakPolarHBondContact CB-SG 3.33Å; C40-C49 VanDerWaalsContact SG-CA 3.54Å; C40-C49 WeakPolarHBondContact SG-CB 3.5Å; C40-C49 CovalentContact SG-SG 2.04Å; C40-C49 PolarHBondContact SG-SG 3.38Å
41	R	91.2	Very high	80.6	Confident	167 Å²	167	77.8 Å²	77.8	63%	0.63	43%	0.426	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.9	133.7	162.8	169.2	-178.6	177.7	170.5	-2	108	E43 Y48	R41-E43 IonicContact CZ-OE1 3.13Å; R41-E43 IonicContact NE-OE1 2.73Å; R41-E43 PolarHBondContact NE-OE1 3.27Å; R41-E43 IonicContact NH2-OE1 3.9Å; R41-E43 PolarHBondContact NH2-OE1 3.23Å; R41-Y48 PolarHBondContact N-O 3.23Å; R41-Y48 WeakPolarHBondContact O-CA 3.46Å; R41-Y48 WeakPolarHBondContact O-CB 3.3Å; R41-Y48 PolarHBondContact O-N 3.01Å
42	C	90.6	Very high	83	Confident	40 Å²	40	76.9 Å²	76.9	27%	0.27	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	136.2	179.2	-50.6	0	0	0	0	110.7	C36 Q46 F47	C36-C42 WeakPolarHBondContact CA-SG 3.14Å; C36-C42 HydrophobicContact CB-CB 3.75Å; C36-C42 WeakPolarHBondContact CB-SG 3.49Å; C36-C42 WeakPolarHBondContact SG-CB 3.48Å; C36-C42 CovalentContact SG-SG 2.03Å; C36-C42 PolarHBondContact SG-SG 2.7Å; C42-Q46 CarbonylContact C-O 3.57Å; C42-Q46 WeakPolarHBondContact CA-O 3.37Å; C42-F47 HydrophobicContact CB-CD1 4.12Å; C42-F47 HydrophobicContact CB-CE1 4.2Å; C42-F47 WeakPolarHBondContact SG-CD1 3.27Å
43	E	90.4	Very high	85.2	Confident	71 Å²	71	80 Å²	80	33%	0.332	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	101.2	180	-60.3	-169.8	166.7	0	0	108.2	R41 L45 Q46 Y48	R41-E43 IonicContact CZ-OE1 3.13Å; R41-E43 IonicContact NE-OE1 2.73Å; R41-E43 PolarHBondContact NE-OE1 3.27Å; R41-E43 IonicContact NH2-OE1 3.9Å; R41-E43 PolarHBondContact NH2-OE1 3.23Å; E43-L45 PolarHBondContact O-N 2.68Å; E43-Q46 PolarHBondContact N-O 2.78Å; E43-Q46 WeakPolarHBondContact O-CB 3.37Å; E43-Q46 PolarHBondContact O-N 2.96Å; E43-Y48 HydrophobicContact CB-CE2 4.33Å; E43-Y48 HydrophobicContact CG-CE2 4.23Å
44	D	87.4	Confident	87.3	Confident	158 Å²	158	76 Å²	76	85%	0.845	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.6	-97.8	-167.6	-55.8	-43	0	0	0	112.7
45	L	90.6	Very high	88.9	Confident	69 Å²	69	79.4 Å²	79.4	36%	0.361	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.3	18	179.1	-60.7	174.7	0	0	0	112.5	E43 A65 L66 G67	E43-L45 PolarHBondContact O-N 2.68Å; L45-A65 CarbonylContact O-C 3.08Å; L45-A65 WeakPolarHBondContact O-CA 3.24Å; L45-L66 HydrophobicContact CB-CB 4.21Å; L45-L66 HydrophobicContact CB-CD1 4.08Å; L45-L66 HydrophobicContact CB-CG 3.85Å; L45-L66 HydrophobicContact CD1-CD1 3.92Å; L45-L66 HydrophobicContact CD1-CG 3.99Å; L45-L66 PolarHBondContact O-N 2.87Å; L45-G67 PolarHBondContact O-N 3.04Å
46	Q	93.2	Very high	89.6	Confident	65 Å²	65	76.1 Å²	76.1	30%	0.304	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	128.7	176.1	-59.4	-179.6	106	0	0	109.9	C42 E43 Y48 G67 W91	C42-Q46 CarbonylContact C-O 3.57Å; C42-Q46 WeakPolarHBondContact CA-O 3.37Å; E43-Q46 PolarHBondContact N-O 2.78Å; E43-Q46 WeakPolarHBondContact O-CB 3.37Å; E43-Q46 PolarHBondContact O-N 2.96Å; Q46-Y48 HydrophobicContact CB-CE2 3.87Å; Q46-G67 WeakPolarHBondContact CA-O 3.34Å; Q46-W91 HydrophobicContact CB-CZ2 4.11Å; Q46-W91 HydrophobicContact CG-CZ2 4.15Å
47	F	93.6	Very high	89.8	Confident	1 Å²	1	74.5 Å²	74.5	0%	0.004	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	117.4	-171.1	-65.9	-100.9	0	0	0	110.4	C42 V61 A65 G67 L68 S69	C42-F47 HydrophobicContact CB-CD1 4.12Å; C42-F47 HydrophobicContact CB-CE1 4.2Å; C42-F47 WeakPolarHBondContact SG-CD1 3.27Å; F47-V61 HydrophobicContact CB-CG1 3.78Å; F47-V61 HydrophobicContact CD1-CB 4.29Å; F47-V61 HydrophobicContact CD1-CG1 3.45Å; F47-V61 VanDerWaalsContact CD1-CG1 3.45Å; F47-V61 HydrophobicContact CD1-CG2 3.9Å; F47-V61 HydrophobicContact CD2-CG1 3.61Å; F47-V61 HydrophobicContact CE1-CB 4.5Å; F47-V61 HydrophobicContact CE1-CG1 3.88Å; F47-V61 HydrophobicContact CE1-CG2 4.19Å; F47-V61 HydrophobicContact CE2-CG1 4.03Å; F47-V61 HydrophobicContact CG-CG1 3.31Å; F47-V61 HydrophobicContact CZ-CG1 4.16Å; F47-A65 HydrophobicContact CD2-CB 3.62Å; F47-A65 HydrophobicContact CE2-CB 3.69Å; F47-G67 PolarHBondContact N-O 3.46Å; F47-L68 HydrophobicContact CB-CD1 4Å; F47-L68 WeakPolarHBondContact O-CA 3.39Å; F47-S69 PolarHBondContact O-N 2.96Å
48	Y	94.8	Very high	89.7	Confident	63 Å²	63	74.1 Å²	74.1	25%	0.247	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	94.7	-178.9	-57.4	-84.4	0	0	0	109.3	C40 R41 E43 Q46 W91	C40-Y48 WeakPolarHBondContact CA-O 3.39Å; C40-Y48 WeakPolarHBondContact CB-O 3.43Å; R41-Y48 PolarHBondContact N-O 3.23Å; R41-Y48 WeakPolarHBondContact O-CA 3.46Å; R41-Y48 WeakPolarHBondContact O-CB 3.3Å; R41-Y48 PolarHBondContact O-N 3.01Å; E43-Y48 HydrophobicContact CB-CE2 4.33Å; E43-Y48 HydrophobicContact CG-CE2 4.23Å; Q46-Y48 HydrophobicContact CB-CE2 3.87Å; Y48-W91 HydrophobicContact CD1-CH2 4.25Å; Y48-W91 AromaticContact CE1-CH2 3.61Å; Y48-W91 HydrophobicContact CE1-CH2 3.61Å; Y48-W91 HydrophobicContact CE1-CZ2 4.12Å; Y48-W91 AromaticContact CZ-CH2 3.97Å
49	C	93.6	Very high	89.9	Confident	0 Å²	0	71.9 Å²	71.9	0%	0	37%	0.37	C	S	.	.			trans	-106	37.4	-178.1	-64	0	0	0	0	111	C40 L54 S69 L70 N73	C40-C49 HydrophobicContact CB-CB 4.07Å; C40-C49 WeakPolarHBondContact CB-SG 3.33Å; C40-C49 VanDerWaalsContact SG-CA 3.54Å; C40-C49 WeakPolarHBondContact SG-CB 3.5Å; C40-C49 CovalentContact SG-SG 2.04Å; C40-C49 PolarHBondContact SG-SG 3.38Å; C49-L54 HydrophobicContact CB-CD1 3.94Å; C49-S69 WeakPolarHBondContact CA-O 3.25Å; C49-S69 WeakPolarHBondContact CB-O 3.22Å; C49-S69 PolarHBondContact N-O 3.37Å; C49-L70 HydrophobicContact CB-CD2 3.74Å; C49-N73 PolarHBondContact O-ND2 3.25Å
50	D	93.9	Very high	89.5	Confident	40 Å²	40	67.9 Å²	67.9	21%	0.214	36%	0.364	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.1	144.7	-171.6	-51.1	-57.7	0	0	0	112.3	Q52 S69 L70 R71	D50-Q52 WeakPolarHBondContact O-CG 3.46Å; D50-Q52 PolarHBondContact O-N 3Å; D50-Q52 PolarHBondContact O-NE2 2.88Å; D50-S69 VanDerWaalsContact CG-OG 3.32Å; D50-S69 VanDerWaalsContact OD1-C 3.27Å; D50-S69 WeakPolarHBondContact OD1-CB 3.49Å; D50-S69 PolarHBondContact OD1-OG 3.49Å; D50-S69 PolarHBondContact OD2-OG 3.01Å; D50-L70 PolarHBondContact OD1-N 3.4Å; D50-R71 CarbonylContact C-O 3.25Å; D50-R71 VanDerWaalsContact CA-O 3.29Å; D50-R71 WeakPolarHBondContact CA-O 3.46Å; D50-R71 HydrophobicContact CB-CB 4.24Å; D50-R71 VanDerWaalsContact OD1-CB 3.23Å; D50-R71 WeakPolarHBondContact OD1-CB 2.99Å; D50-R71 WeakPolarHBondContact OD1-CG 3.33Å; D50-R71 PolarHBondContact OD1-N 3.41Å
51	T	92.4	Very high	88.9	Confident	96 Å²	96	67 Å²	67	59%	0.589	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.3	40.1	176.3	-32.8	0	0	0	0	114.1	R71 H72	T51-R71 PolarHBondContact N-O 3.26Å; T51-H72 WeakPolarHBondContact CA-O 3.43Å; T51-H72 HydrophobicContact CG2-CB 4.48Å
52	Q	90.6	Very high	88.1	Confident	53 Å²	53	60.7 Å²	60.7	25%	0.248	34%	0.337	C	S	.	.	S	Bend	trans	-108.9	5.6	-174.8	-65.1	-47.2	-51	0	0	114.6	K39 D50 L54 N73	K39-Q52 HydrophobicContact CB-CB 4.43Å; K39-Q52 HydrophobicContact CB-CG 4.04Å; K39-Q52 HydrophobicContact CD-CB 4.25Å; K39-Q52 PolarHBondContact NZ-O 3.25Å; K39-Q52 VanDerWaalsContact NZ-O 3.1Å; K39-Q52 VanDerWaalsContact O-CG 3.27Å; K39-Q52 WeakPolarHBondContact O-CG 3.31Å; K39-Q52 PolarHBondContact O-OE1 3.4Å; D50-Q52 WeakPolarHBondContact O-CG 3.46Å; D50-Q52 PolarHBondContact O-N 3Å; D50-Q52 PolarHBondContact O-NE2 2.88Å; Q52-L54 HydrophobicContact CB-CD1 4.02Å; Q52-L54 HydrophobicContact CB-CG 3.81Å; Q52-L54 PolarHBondContact O-N 3Å; Q52-N73 WeakPolarHBondContact CA-OD1 3.18Å; Q52-N73 PolarHBondContact N-OD1 2.7Å
53	E	91.3	Very high	87.4	Confident	159 Å²	159	65.8 Å²	65.8	74%	0.743	35%	0.354	S	S	*	.			trans	58.4	25.4	-173.2	-57.9	-177.2	162.1	0	0	113.6	N73	E53-N73 PolarHBondContact N-OD1 2.68Å; E53-N73 VanDerWaalsContact N-OD1 3.1Å
54	L	90.8	Very high	86.9	Confident	34 Å²	34	63.3 Å²	63.3	18%	0.178	35%	0.348	C	S	.	.			trans	-65.3	137.5	-178.3	-66.5	169.6	0	0	0	111.3	C49 Q52 L70 N73 S74 I75	C49-L54 HydrophobicContact CB-CD1 3.94Å; Q52-L54 HydrophobicContact CB-CD1 4.02Å; Q52-L54 HydrophobicContact CB-CG 3.81Å; Q52-L54 PolarHBondContact O-N 3Å; L54-L70 HydrophobicContact CD1-CD2 3.75Å; L54-N73 HydrophobicContact CB-CB 4.25Å; L54-N73 PolarHBondContact N-OD1 2.84Å; L54-S74 CarbonylContact O-C 3.08Å; L54-S74 VanDerWaalsContact O-C 3.25Å; L54-S74 WeakPolarHBondContact O-CA 3.48Å; L54-S74 PolarHBondContact O-N 3.04Å; L54-I75 PolarHBondContact O-N 3.43Å
55	T	92.1	Very high	87.1	Confident	103 Å²	103	55.8 Å²	55.8	63%	0.632	31%	0.307	S	S	*	.	S	Bend	trans	-97.1	-17.6	172.6	49.9	0	0	0	0	112.8
56	A	88.8	Confident	87.3	Confident	46 Å²	46	56 Å²	56	38%	0.38	31%	0.308	S	S	.	.	S	Bend	trans	-147.2	163.1	178.6	0	0	0	0	0	110.5
57	P	87.3	Confident	87.4	Confident	20 Å²	20	52.9 Å²	52.9	13%	0.13	29%	0.294	C	S	.	.	P	Polyproline II helix	trans	-59.4	146.2	171.4	-22.1	34.2	0	0	0	112.2	L70 Q82 F83 F86	P57-L70 HydrophobicContact CB-CD1 4.05Å; P57-L70 HydrophobicContact CG-CD1 4.04Å; P57-Q82 HydrophobicContact CG-CG 4.08Å; P57-F83 HydrophobicContact CB-CE1 4.23Å; P57-F83 HydrophobicContact CG-CD1 4.29Å; P57-F83 HydrophobicContact CG-CE1 3.49Å; P57-F83 VanDerWaalsContact CG-CE1 3.49Å; P57-F83 HydrophobicContact CG-CZ 3.83Å; P57-F86 HydrophobicContact CB-CZ 4.39Å
58	P	84.5	Confident	87.5	Confident	21 Å²	21	52.8 Å²	52.8	14%	0.136	29%	0.294	C	S	.	.	P	Polyproline II helix	trans	-78.4	138.3	179.6	30.6	-34.4	0	0	0	112.9	P37 V61	P37-P58 HydrophobicContact CB-CB 4.41Å; P37-P58 HydrophobicContact CG-CB 4.17Å; P37-P58 HydrophobicContact CG-CG 4.25Å; P58-V61 HydrophobicContact CG-CG2 3.95Å
59	D	79.4	Confident	87.6	Confident	161 Å²	161	49.8 Å²	49.8	86%	0.861	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	150.3	174.9	-64.4	-57.2	0	0	0	113	V61	D59-V61 VanDerWaalsContact C-N 3.27Å; D59-V61 PolarHBondContact O-N 2.96Å
60	G	73.1	Confident	87.7	Confident	40 Å²	40	49.8 Å²	49.8	41%	0.412	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.1	-3.5	174.3	0	0	0	0	0	115.9	D62	G60-D62 WeakPolarHBondContact CA-OD1 3.46Å
61	V	76.9	Confident	87.8	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	28%	0.284	C	S	.	.			trans	-85.4	-13	170	-176.3	0	0	0	0	112	P37 F47 P58 D59 K63 A65 L68 F86	P37-V61 HydrophobicContact CG-CG2 3.34Å; F47-V61 HydrophobicContact CB-CG1 3.78Å; F47-V61 HydrophobicContact CD1-CB 4.29Å; F47-V61 HydrophobicContact CD1-CG1 3.45Å; F47-V61 VanDerWaalsContact CD1-CG1 3.45Å; F47-V61 HydrophobicContact CD1-CG2 3.9Å; F47-V61 HydrophobicContact CD2-CG1 3.61Å; F47-V61 HydrophobicContact CE1-CB 4.5Å; F47-V61 HydrophobicContact CE1-CG1 3.88Å; F47-V61 HydrophobicContact CE1-CG2 4.19Å; F47-V61 HydrophobicContact CE2-CG1 4.03Å; F47-V61 HydrophobicContact CG-CG1 3.31Å; F47-V61 HydrophobicContact CZ-CG1 4.16Å; P58-V61 HydrophobicContact CG-CG2 3.95Å; D59-V61 VanDerWaalsContact C-N 3.27Å; D59-V61 PolarHBondContact O-N 2.96Å; V61-K63 PolarHBondContact O-N 3.17Å; V61-A65 HydrophobicContact CG1-CB 4.13Å; V61-A65 WeakPolarHBondContact O-CB 3.42Å; V61-L68 HydrophobicContact CG1-CD1 4.33Å; V61-F86 HydrophobicContact CB-CE1 3.89Å; V61-F86 HydrophobicContact CB-CZ 4.41Å; V61-F86 HydrophobicContact CG1-CE1 3.89Å
62	D	74.3	Confident	88	Confident	35 Å²	35	51.3 Å²	51.3	19%	0.187	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.9	-45.6	-176.8	64.8	-39.8	0	0	0	113.6	G60 G64 G85 F86	G60-D62 WeakPolarHBondContact CA-OD1 3.46Å; D62-G64 PolarHBondContact O-N 3.09Å; D62-G85 VanDerWaalsContact O-O 3.09Å; D62-F86 HydrophobicContact CB-CD2 4.19Å; D62-F86 HydrophobicContact CB-CE2 4.11Å; D62-F86 HydrophobicContact CB-CG 4.47Å; D62-F86 HydrophobicContact CB-CZ 4.31Å; D62-F86 WeakPolarHBondContact O-CA 3.4Å
63	K	75.9	Confident	88.3	Confident	146 Å²	146	49 Å²	49	64%	0.635	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.9	71.6	-166.5	-77.5	153.1	-169.7	154.2	0	114.4	T34 V61	T34-K63 VanDerWaalsContact CG2-O 3.27Å; T34-K63 WeakPolarHBondContact CG2-O 3.33Å; V61-K63 PolarHBondContact O-N 3.17Å
64	G	80.9	Confident	88.6	Confident	19 Å²	19	43.4 Å²	43.4	20%	0.196	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	117.8	4.3	163.9	0	0	0	0	0	115.6	D62 L66	D62-G64 PolarHBondContact O-N 3.09Å; G64-L66 PolarHBondContact O-N 2.78Å
65	A	90.7	Very high	88.8	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	24%	0.237	C	C	.	.			trans	-54	129.4	172.6	0	0	0	0	0	111.5	L45 F47 V61 Q88 L89	L45-A65 CarbonylContact O-C 3.08Å; L45-A65 WeakPolarHBondContact O-CA 3.24Å; F47-A65 HydrophobicContact CD2-CB 3.62Å; F47-A65 HydrophobicContact CE2-CB 3.69Å; V61-A65 HydrophobicContact CG1-CB 4.13Å; V61-A65 WeakPolarHBondContact O-CB 3.42Å; A65-Q88 CarbonylContact O-C 3.18Å; A65-L89 HydrophobicContact CB-CD2 3.95Å; A65-L89 WeakPolarHBondContact O-CA 3.4Å; A65-L89 PolarHBondContact O-N 3.42Å; A65-L89 VanDerWaalsContact O-N 3.15Å
66	L	94.7	Very high	89	Confident	73 Å²	73	40.4 Å²	40.4	38%	0.382	23%	0.229	S	C	.	.	S	Bend	trans	-92.1	-20.7	172.6	-64.1	179.3	0	0	0	111.9	L45 G64 Q88 T90	L45-L66 HydrophobicContact CB-CB 4.21Å; L45-L66 HydrophobicContact CB-CD1 4.08Å; L45-L66 HydrophobicContact CB-CG 3.85Å; L45-L66 HydrophobicContact CD1-CD1 3.92Å; L45-L66 HydrophobicContact CD1-CG 3.99Å; L45-L66 PolarHBondContact O-N 2.87Å; G64-L66 PolarHBondContact O-N 2.78Å; L66-Q88 HydrophobicContact CD2-CB 4.25Å; L66-T90 PolarHBondContact O-N 3.23Å; L66-T90 PolarHBondContact O-OG1 2.73Å
67	G	95.8	Very high	89.4	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	139.8	178.1	0	0	0	0	0	112.5	L45 Q46 F47 L89	L45-G67 PolarHBondContact O-N 3.04Å; Q46-G67 WeakPolarHBondContact CA-O 3.34Å; F47-G67 PolarHBondContact N-O 3.46Å; G67-L89 VanDerWaalsContact C-CD2 3.47Å
68	L	95.4	Very high	89.8	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	121.2	178.4	177.3	61.4	0	0	0	111	F47 V61 L70 F83 F86 L89 W91 L92 H93	F47-L68 HydrophobicContact CB-CD1 4Å; F47-L68 WeakPolarHBondContact O-CA 3.39Å; V61-L68 HydrophobicContact CG1-CD1 4.33Å; L68-L70 HydrophobicContact CD1-CD1 4.42Å; L68-L70 HydrophobicContact CD1-CG 4.13Å; L68-L70 HydrophobicContact CD2-CD1 3.83Å; L68-L70 HydrophobicContact CD2-CG 4.4Å; L68-L70 HydrophobicContact CG-CD1 4.03Å; L68-L70 HydrophobicContact CG-CG 4.08Å; L68-F83 HydrophobicContact CD2-CE1 4.33Å; L68-F86 HydrophobicContact CD2-CD1 4.02Å; L68-F86 HydrophobicContact CD2-CE1 3.67Å; L68-F86 HydrophobicContact CD2-CZ 4.26Å; L68-L89 HydrophobicContact CB-CD1 4.12Å; L68-L89 HydrophobicContact CB-CD2 3.78Å; L68-L89 HydrophobicContact CD2-CD1 4.47Å; L68-W91 PolarHBondContact N-O 3.5Å; L68-W91 WeakPolarHBondContact O-CZ3 3.01Å; L68-L92 HydrophobicContact CB-CD1 4.11Å; L68-L92 HydrophobicContact CD2-CD1 4.03Å; L68-L92 HydrophobicContact CG-CD1 4.11Å; L68-L92 WeakPolarHBondContact O-CA 3.46Å; L68-H93 PolarHBondContact O-N 2.81Å
69	S	96.9	Very high	90.3	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	123.6	174.2	-156.5	0	0	0	0	109.6	F47 C49 D50	F47-S69 PolarHBondContact O-N 2.96Å; C49-S69 WeakPolarHBondContact CA-O 3.25Å; C49-S69 WeakPolarHBondContact CB-O 3.22Å; C49-S69 PolarHBondContact N-O 3.37Å; D50-S69 VanDerWaalsContact CG-OG 3.32Å; D50-S69 VanDerWaalsContact OD1-C 3.27Å; D50-S69 WeakPolarHBondContact OD1-CB 3.49Å; D50-S69 PolarHBondContact OD1-OG 3.49Å; D50-S69 PolarHBondContact OD2-OG 3.01Å
70	L	96	Very high	91	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	21%	0.21	C	C	.	.			trans	-127.6	33.3	179.2	-74.6	166.3	0	0	0	110.2	C49 D50 L54 P57 L68 N73 I75 F83 H93 L94 N97	C49-L70 HydrophobicContact CB-CD2 3.74Å; D50-L70 PolarHBondContact OD1-N 3.4Å; L54-L70 HydrophobicContact CD1-CD2 3.75Å; P57-L70 HydrophobicContact CB-CD1 4.05Å; P57-L70 HydrophobicContact CG-CD1 4.04Å; L68-L70 HydrophobicContact CD1-CD1 4.42Å; L68-L70 HydrophobicContact CD1-CG 4.13Å; L68-L70 HydrophobicContact CD2-CD1 3.83Å; L68-L70 HydrophobicContact CD2-CG 4.4Å; L68-L70 HydrophobicContact CG-CD1 4.03Å; L68-L70 HydrophobicContact CG-CG 4.08Å; L70-N73 PolarHBondContact O-ND2 3.08Å; L70-I75 HydrophobicContact CB-CD1 4.11Å; L70-I75 HydrophobicContact CD1-CD1 4.27Å; L70-F83 HydrophobicContact CD1-CE1 4.37Å; L70-H93 PolarHBondContact N-O 3.43Å; L70-L94 HydrophobicContact CB-CD2 3.96Å; L70-L94 HydrophobicContact CD1-CD2 3.89Å; L70-N97 PolarHBondContact O-ND2 2.97Å
71	R	96.7	Very high	91.9	Very high	70 Å²	70	39 Å²	39	26%	0.264	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.6	154.8	-173.8	-60.5	175.9	149.3	134.8	8	112.6	D50 T51 N73 H93 D95	D50-R71 CarbonylContact C-O 3.25Å; D50-R71 VanDerWaalsContact CA-O 3.29Å; D50-R71 WeakPolarHBondContact CA-O 3.46Å; D50-R71 HydrophobicContact CB-CB 4.24Å; D50-R71 VanDerWaalsContact OD1-CB 3.23Å; D50-R71 WeakPolarHBondContact OD1-CB 2.99Å; D50-R71 WeakPolarHBondContact OD1-CG 3.33Å; D50-R71 PolarHBondContact OD1-N 3.41Å; T51-R71 PolarHBondContact N-O 3.26Å; R71-N73 PolarHBondContact O-N 2.81Å; R71-N73 PolarHBondContact O-ND2 3.17Å; R71-H93 HydrophobicContact CG-CB 3.97Å; R71-H93 PolarHBondContact NH1-ND1 3.28Å; R71-H93 PolarHBondContact NH2-CD2 2.9Å; R71-H93 VanDerWaalsContact NH2-CG 3.25Å; R71-H93 PolarHBondContact NH2-ND1 3.23Å; R71-D95 WeakPolarHBondContact CA-O 3.4Å; R71-D95 WeakPolarHBondContact CG-OD2 3.27Å; R71-D95 IonicContact CZ-OD1 2.81Å; R71-D95 VanDerWaalsContact NE-CG 3.31Å; R71-D95 IonicContact NE-OD1 2.66Å; R71-D95 PolarHBondContact NE-OD1 3.01Å; R71-D95 IonicContact NE-OD2 2.78Å; R71-D95 PolarHBondContact NE-OD2 3.01Å; R71-D95 VanDerWaalsContact NE-OD2 3.13Å; R71-D95 IonicContact NH2-OD1 3.36Å; R71-D95 PolarHBondContact NH2-OD1 2.82Å
72	H	96.7	Very high	92.6	Very high	97 Å²	97	41 Å²	41	45%	0.449	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	54	37	174.7	-60.8	-76.2	0	0	0	113.5	T51 D95 H96	T51-H72 WeakPolarHBondContact CA-O 3.43Å; T51-H72 HydrophobicContact CG2-CB 4.48Å; H72-D95 PolarHBondContact N-O 3.47Å; H72-H96 WeakPolarHBondContact CA-O 3.44Å; H72-H96 VanDerWaalsContact CE1-CB 3.48Å; H72-H96 WeakPolarHBondContact CE1-CB 3.08Å; H72-H96 AromaticContact CE1-CD2 3.82Å; H72-H96 AromaticContact CE1-CG 3.39Å; H72-H96 AromaticContact CE1-ND1 3.79Å; H72-H96 VanDerWaalsContact ND1-CB 3.34Å; H72-H96 WeakPolarHBondContact ND1-CB 3.41Å; H72-H96 AromaticContact ND1-CG 3.8Å; H72-H96 AromaticContact NE2-CG 3.97Å; H72-H96 AromaticContact NE2-ND1 3.95Å
73	N	96.3	Very high	93.5	Very high	6 Å²	6	39.4 Å²	39.4	3%	0.032	21%	0.209	C	C	.	.	S	Bend	trans	-106.9	-174.3	177.9	-80.7	-52.4	0	0	0	111	C49 Q52 E53 L54 L70 R71 I75 N97	C49-N73 PolarHBondContact O-ND2 3.25Å; Q52-N73 WeakPolarHBondContact CA-OD1 3.18Å; Q52-N73 PolarHBondContact N-OD1 2.7Å; E53-N73 PolarHBondContact N-OD1 2.68Å; E53-N73 VanDerWaalsContact N-OD1 3.1Å; L54-N73 HydrophobicContact CB-CB 4.25Å; L54-N73 PolarHBondContact N-OD1 2.84Å; L70-N73 PolarHBondContact O-ND2 3.08Å; R71-N73 PolarHBondContact O-N 2.81Å; R71-N73 PolarHBondContact O-ND2 3.17Å; N73-I75 HydrophobicContact CB-CG1 4.43Å; N73-N97 WeakPolarHBondContact CA-OD1 3.43Å; N73-N97 WeakPolarHBondContact CB-OD1 3.46Å; N73-N97 PolarHBondContact O-OD1 2.95Å
74	S	96.6	Very high	94.2	Very high	41 Å²	41	39.1 Å²	39.1	29%	0.287	21%	0.205	S	C	.	.			trans	-110.4	29.4	-176.4	-68.6	0	0	0	0	112.5	L54 T76	L54-S74 CarbonylContact O-C 3.08Å; L54-S74 VanDerWaalsContact O-C 3.25Å; L54-S74 WeakPolarHBondContact O-CA 3.48Å; L54-S74 PolarHBondContact O-N 3.04Å; S74-T76 PolarHBondContact O-N 3.37Å
75	I	96.5	Very high	94.5	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	21%	0.211	C	C	.	.			trans	-68.9	124.9	176.4	-55.4	166.5	0	0	0	108.4	L54 L70 N73 E77 L78 L94 N97 Q98 I99	L54-I75 PolarHBondContact O-N 3.43Å; L70-I75 HydrophobicContact CB-CD1 4.11Å; L70-I75 HydrophobicContact CD1-CD1 4.27Å; N73-I75 HydrophobicContact CB-CG1 4.43Å; I75-E77 WeakPolarHBondContact CG2-O 3.41Å; I75-L78 HydrophobicContact CG2-CD2 3.89Å; I75-L94 HydrophobicContact CD1-CD2 3.77Å; I75-N97 HydrophobicContact CB-CB 4.33Å; I75-N97 VanDerWaalsContact CB-OD1 3.31Å; I75-N97 WeakPolarHBondContact CB-OD1 3.45Å; I75-N97 WeakPolarHBondContact CG1-OD1 3.36Å; I75-N97 PolarHBondContact N-OD1 3.44Å; I75-N97 VanDerWaalsContact N-OD1 3.1Å; I75-Q98 CarbonylContact O-C 3.2Å; I75-Q98 WeakPolarHBondContact O-CA 3.27Å; I75-Q98 PolarHBondContact O-N 3.45Å; I75-I99 HydrophobicContact CB-CG1 4.31Å; I75-I99 HydrophobicContact CG2-CD1 4.33Å; I75-I99 HydrophobicContact CG2-CG1 4.02Å; I75-I99 WeakPolarHBondContact O-CG1 3.22Å; I75-I99 PolarHBondContact O-N 3.49Å; I75-I99 VanDerWaalsContact O-N 3.11Å
76	T	96.6	Very high	94.6	Very high	74 Å²	74	40.4 Å²	40.4	45%	0.454	21%	0.214	S	C	.	.			trans	-108.1	-21.9	-178.5	50.8	0	0	0	0	113.8	S74 Q98 I99 T100	S74-T76 PolarHBondContact O-N 3.37Å; T76-Q98 HydrophobicContact CG2-CB 4.16Å; T76-I99 WeakPolarHBondContact O-CA 3.49Å; T76-T100 PolarHBondContact O-N 2.87Å; T76-T100 PolarHBondContact O-OG1 3.04Å
77	E	96.4	Very high	94.4	Very high	73 Å²	73	39.2 Å²	39.2	34%	0.341	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-147	149.5	-175.3	179.6	157.9	-145.1	0	0	110.4	I75 T101 Q103	I75-E77 WeakPolarHBondContact CG2-O 3.41Å; E77-T101 WeakPolarHBondContact CA-O 3.04Å; E77-T101 HydrophobicContact CG-CG2 4.4Å; E77-T101 WeakPolarHBondContact OE1-CG2 3.21Å; E77-Q103 PolarHBondContact OE1-NE2 3.46Å
78	L	96.3	Very high	94.4	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	114.3	168	-53.8	179.8	0	0	0	108.9	I75 F83 L94 I99 T101 V102 Q103 A106 F107 L118	I75-L78 HydrophobicContact CG2-CD2 3.89Å; L78-F83 HydrophobicContact CD1-CE2 4.43Å; L78-F83 HydrophobicContact CD2-CE2 4.1Å; L78-F83 HydrophobicContact CD2-CZ 4.27Å; L78-L94 HydrophobicContact CD1-CD1 3.99Å; L78-L94 HydrophobicContact CD2-CD1 4.32Å; L78-I99 HydrophobicContact CD1-CD1 4.24Å; L78-I99 HydrophobicContact CD2-CD1 4.08Å; L78-I99 HydrophobicContact CG-CD1 4.18Å; L78-I99 HydrophobicContact CG-CG2 4.31Å; L78-T101 PolarHBondContact N-O 3.22Å; L78-V102 HydrophobicContact CB-CG1 4.29Å; L78-V102 HydrophobicContact CD1-CG1 4.23Å; L78-V102 HydrophobicContact CD1-CG2 3.98Å; L78-V102 HydrophobicContact CG-CG2 4.37Å; L78-Q103 PolarHBondContact O-N 3.46Å; L78-A106 HydrophobicContact CB-CB 4.03Å; L78-F107 HydrophobicContact CD1-CE1 3.83Å; L78-F107 HydrophobicContact CD1-CE2 4.37Å; L78-F107 HydrophobicContact CD1-CZ 3.45Å; L78-F107 VanDerWaalsContact CD1-CZ 3.45Å; L78-L118 HydrophobicContact CD1-CD2 4.18Å
79	S	94.7	Very high	94.4	Very high	51 Å²	51	42.2 Å²	42.2	36%	0.357	23%	0.226	S	C	.	.			trans	-77.3	160.6	178.5	-61.2	0	0	0	0	112.2	Q82 A106	S79-Q82 WeakPolarHBondContact O-CB 3.14Å; S79-Q82 PolarHBondContact O-N 3.31Å; S79-A106 VanDerWaalsContact O-CA 3.26Å; S79-A106 WeakPolarHBondContact O-CA 3.39Å; S79-A106 VanDerWaalsContact O-CB 3.26Å; S79-A106 WeakPolarHBondContact O-CB 3.27Å
80	P	94.4	Very high	94.5	Very high	64 Å²	64	44.1 Å²	44.1	42%	0.416	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.6	145.5	172.2	-21.1	34.1	0	0	0	111.2	Q82 Q103 E104	P80-Q82 PolarHBondContact O-N 3.25Å; P80-Q103 VanDerWaalsContact CD-OE1 3.31Å; P80-Q103 HydrophobicContact CG-CB 3.98Å; P80-E104 WeakPolarHBondContact CB-O 3.4Å
81	D	91.5	Very high	94.6	Very high	70 Å²	70	45.8 Å²	45.8	37%	0.374	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.9	10.4	-179.8	-73.3	-50.1	0	0	0	116.2	F83 Y84 D105 Q108	D81-F83 PolarHBondContact O-N 2.03Å; D81-Y84 WeakPolarHBondContact O-CB 3.43Å; D81-Y84 PolarHBondContact O-N 3.3Å; D81-Y84 VanDerWaalsContact OD1-CD2 3.25Å; D81-Y84 WeakPolarHBondContact OD1-CD2 3.35Å; D81-D105 PolarHBondContact N-O 3.18Å; D81-Q108 WeakPolarHBondContact OD1-CB 3.28Å; D81-Q108 WeakPolarHBondContact OD1-CG 3.47Å; D81-Q108 PolarHBondContact OD1-NE2 3.17Å; D81-Q108 PolarHBondContact OD2-NE2 3.07Å
82	Q	91.6	Very high	94.6	Very high	43 Å²	43	42.5 Å²	42.5	20%	0.201	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58	-24.1	-176.2	179.7	170.1	-52.9	0	0	113.7	P57 S79 P80	P57-Q82 HydrophobicContact CG-CG 4.08Å; S79-Q82 WeakPolarHBondContact O-CB 3.14Å; S79-Q82 PolarHBondContact O-N 3.31Å; P80-Q82 PolarHBondContact O-N 3.25Å
83	F	92.9	Very high	94.7	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.4	11.6	175.3	-59.4	-77	0	0	0	114.2	P57 L68 L70 L78 D81 G85 F86 L92 L94 A106 F107 L110	P57-F83 HydrophobicContact CB-CE1 4.23Å; P57-F83 HydrophobicContact CG-CD1 4.29Å; P57-F83 HydrophobicContact CG-CE1 3.49Å; P57-F83 VanDerWaalsContact CG-CE1 3.49Å; P57-F83 HydrophobicContact CG-CZ 3.83Å; L68-F83 HydrophobicContact CD2-CE1 4.33Å; L70-F83 HydrophobicContact CD1-CE1 4.37Å; L78-F83 HydrophobicContact CD1-CE2 4.43Å; L78-F83 HydrophobicContact CD2-CE2 4.1Å; L78-F83 HydrophobicContact CD2-CZ 4.27Å; D81-F83 PolarHBondContact O-N 2.03Å; F83-G85 VanDerWaalsContact C-N 3.34Å; F83-G85 PolarHBondContact O-N 3.26Å; F83-F86 HydrophobicContact CB-CD2 4.33Å; F83-F86 HydrophobicContact CD1-CD2 4.28Å; F83-F86 HydrophobicContact CD1-CE2 4.46Å; F83-F86 WeakPolarHBondContact O-CB 3Å; F83-F86 PolarHBondContact O-N 3.15Å; F83-L92 HydrophobicContact CD1-CD2 4.23Å; F83-L92 HydrophobicContact CD2-CD2 4.32Å; F83-L92 HydrophobicContact CE1-CD1 4.13Å; F83-L92 HydrophobicContact CE1-CD2 4.14Å; F83-L92 HydrophobicContact CE2-CD2 4.24Å; F83-L92 HydrophobicContact CG-CD2 4.32Å; F83-L92 HydrophobicContact CZ-CD2 4.16Å; F83-L94 HydrophobicContact CE2-CD1 4.16Å; F83-L94 HydrophobicContact CZ-CD1 3.89Å; F83-L94 HydrophobicContact CZ-CD2 4.16Å; F83-A106 WeakPolarHBondContact CD2-O 3.46Å; F83-F107 AromaticContact CD2-CD1 3.94Å; F83-F107 HydrophobicContact CD2-CD1 3.94Å; F83-F107 HydrophobicContact CD2-CE1 4.17Å; F83-F107 HydrophobicContact CE2-CD1 4.23Å; F83-F107 AromaticContact CE2-CE1 3.98Å; F83-F107 HydrophobicContact CE2-CE1 3.98Å; F83-L110 HydrophobicContact CB-CD1 3.76Å; F83-L110 HydrophobicContact CB-CD2 3.93Å; F83-L110 HydrophobicContact CB-CG 3.93Å; F83-L110 HydrophobicContact CG-CD1 4.25Å
84	Y	90.2	Very high	94.8	Very high	141 Å²	141	38.8 Å²	38.8	55%	0.553	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.4	-42.9	-172.5	-176.6	-88.2	0	0	0	114	D81 F86 Q108	D81-Y84 WeakPolarHBondContact O-CB 3.43Å; D81-Y84 PolarHBondContact O-N 3.3Å; D81-Y84 VanDerWaalsContact OD1-CD2 3.25Å; D81-Y84 WeakPolarHBondContact OD1-CD2 3.35Å; Y84-F86 PolarHBondContact O-N 3.5Å; Y84-Q108 HydrophobicContact CD2-CG 4.23Å
85	G	88.3	Confident	94.9	Very high	32 Å²	32	37.2 Å²	37.2	33%	0.33	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-28	178.7	0	0	0	0	0	113.7	D62 F83 S87	D62-G85 VanDerWaalsContact O-O 3.09Å; F83-G85 VanDerWaalsContact C-N 3.34Å; F83-G85 PolarHBondContact O-N 3.26Å; G85-S87 PolarHBondContact O-N 2.94Å
86	F	91.5	Very high	95	Very high	13 Å²	13	41 Å²	41	6%	0.057	22%	0.22	C	C	.	.			trans	-77.6	33.7	-174.6	-60.8	-101.8	0	0	0	113.6	P57 V61 D62 L68 F83 Y84 Q88 L89 L110	P57-F86 HydrophobicContact CB-CZ 4.39Å; V61-F86 HydrophobicContact CB-CE1 3.89Å; V61-F86 HydrophobicContact CB-CZ 4.41Å; V61-F86 HydrophobicContact CG1-CE1 3.89Å; D62-F86 HydrophobicContact CB-CD2 4.19Å; D62-F86 HydrophobicContact CB-CE2 4.11Å; D62-F86 HydrophobicContact CB-CG 4.47Å; D62-F86 HydrophobicContact CB-CZ 4.31Å; D62-F86 WeakPolarHBondContact O-CA 3.4Å; L68-F86 HydrophobicContact CD2-CD1 4.02Å; L68-F86 HydrophobicContact CD2-CE1 3.67Å; L68-F86 HydrophobicContact CD2-CZ 4.26Å; F83-F86 HydrophobicContact CB-CD2 4.33Å; F83-F86 HydrophobicContact CD1-CD2 4.28Å; F83-F86 HydrophobicContact CD1-CE2 4.46Å; F83-F86 WeakPolarHBondContact O-CB 3Å; F83-F86 PolarHBondContact O-N 3.15Å; Y84-F86 PolarHBondContact O-N 3.5Å; F86-Q88 PolarHBondContact O-N 3.49Å; F86-L89 HydrophobicContact CB-CD1 3.57Å; F86-L89 HydrophobicContact CB-CG 3.87Å; F86-L89 HydrophobicContact CD1-CD1 4.08Å; F86-L89 HydrophobicContact CD1-CG 4.48Å; F86-L89 HydrophobicContact CG-CD1 4.13Å; F86-L89 PolarHBondContact O-N 3.17Å; F86-L110 HydrophobicContact CB-CD2 4.03Å; F86-L110 WeakPolarHBondContact O-CD2 3.31Å
87	S	92.1	Very high	95	Very high	49 Å²	49	37.9 Å²	37.9	34%	0.343	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53	-12.8	-175.3	61.7	0	0	0	0	116.8	G85	G85-S87 PolarHBondContact O-N 2.94Å
88	Q	94.6	Very high	95.1	Very high	62 Å²	62	37.6 Å²	37.6	29%	0.29	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99	-7.3	179.2	-52.8	-48.5	-60.6	0	0	114.1	A65 L66 F86 T90	A65-Q88 CarbonylContact O-C 3.18Å; L66-Q88 HydrophobicContact CD2-CB 4.25Å; F86-Q88 PolarHBondContact O-N 3.49Å; Q88-T90 PolarHBondContact O-N 3.08Å
89	L	96.3	Very high	95.2	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	20%	0.199	C	C	.	.			trans	-58.9	136.7	-176.5	-77.4	178.6	0	0	0	112.4	A65 G67 L68 F86 L110 K112 L113	A65-L89 HydrophobicContact CB-CD2 3.95Å; A65-L89 WeakPolarHBondContact O-CA 3.4Å; A65-L89 PolarHBondContact O-N 3.42Å; A65-L89 VanDerWaalsContact O-N 3.15Å; G67-L89 VanDerWaalsContact C-CD2 3.47Å; L68-L89 HydrophobicContact CB-CD1 4.12Å; L68-L89 HydrophobicContact CB-CD2 3.78Å; L68-L89 HydrophobicContact CD2-CD1 4.47Å; F86-L89 HydrophobicContact CB-CD1 3.57Å; F86-L89 HydrophobicContact CB-CG 3.87Å; F86-L89 HydrophobicContact CD1-CD1 4.08Å; F86-L89 HydrophobicContact CD1-CG 4.48Å; F86-L89 HydrophobicContact CG-CD1 4.13Å; F86-L89 PolarHBondContact O-N 3.17Å; L89-L110 HydrophobicContact CB-CD2 4.27Å; L89-L110 HydrophobicContact CD1-CD2 4.1Å; L89-K112 CarbonylContact O-C 3.51Å; L89-K112 WeakPolarHBondContact O-CB 3.48Å; L89-L113 HydrophobicContact CB-CD1 3.99Å; L89-L113 WeakPolarHBondContact O-CA 3.14Å; L89-L113 PolarHBondContact O-N 2.98Å
90	T	97.8	Very high	95.3	Very high	40 Å²	40	38.2 Å²	38.2	25%	0.245	20%	0.201	C	C	.	.	S	Bend	trans	-111.2	-26.6	174.9	67.1	0	0	0	0	111.9	L66 Q88 K114 D115	L66-T90 PolarHBondContact O-N 3.23Å; L66-T90 PolarHBondContact O-OG1 2.73Å; Q88-T90 PolarHBondContact O-N 3.08Å; T90-K114 WeakPolarHBondContact O-CB 3.34Å; T90-K114 PolarHBondContact O-N 2.87Å; T90-D115 PolarHBondContact O-N 2.93Å
91	W	98.4	Very high	95.3	Very high	36 Å²	36	37.9 Å²	37.9	14%	0.136	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	144.6	171.8	59.9	-98.5	0	0	0	111.5	Q46 Y48 L68 H93 D115	Q46-W91 HydrophobicContact CB-CZ2 4.11Å; Q46-W91 HydrophobicContact CG-CZ2 4.15Å; Y48-W91 HydrophobicContact CD1-CH2 4.25Å; Y48-W91 AromaticContact CE1-CH2 3.61Å; Y48-W91 HydrophobicContact CE1-CH2 3.61Å; Y48-W91 HydrophobicContact CE1-CZ2 4.12Å; Y48-W91 AromaticContact CZ-CH2 3.97Å; L68-W91 PolarHBondContact N-O 3.5Å; L68-W91 WeakPolarHBondContact O-CZ3 3.01Å; W91-H93 AromaticContact CD2-CE1 3.97Å; W91-H93 AromaticContact CE3-CE1 3.29Å; W91-H93 AromaticContact CE3-CG 3.97Å; W91-H93 AromaticContact CE3-ND1 3.3Å; W91-H93 VanDerWaalsContact CE3-ND1 3.3Å; W91-H93 AromaticContact CE3-NE2 3.98Å; W91-H93 AromaticContact CZ3-CE1 3.61Å; W91-H93 AromaticContact CZ3-ND1 3.24Å; W91-H93 WeakPolarHBondContact CZ3-ND1 3.37Å; W91-D115 WeakPolarHBondContact CA-O 3.46Å; W91-D115 HydrophobicContact CB-CB 3.89Å
92	L	98	Very high	95.6	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	120.2	178.8	173.7	58.3	0	0	0	109.8	L68 F83 L94 F107 L110 L113 D115 L116 N117	L68-L92 HydrophobicContact CB-CD1 4.11Å; L68-L92 HydrophobicContact CD2-CD1 4.03Å; L68-L92 HydrophobicContact CG-CD1 4.11Å; L68-L92 WeakPolarHBondContact O-CA 3.46Å; F83-L92 HydrophobicContact CD1-CD2 4.23Å; F83-L92 HydrophobicContact CD2-CD2 4.32Å; F83-L92 HydrophobicContact CE1-CD1 4.13Å; F83-L92 HydrophobicContact CE1-CD2 4.14Å; F83-L92 HydrophobicContact CE2-CD2 4.24Å; F83-L92 HydrophobicContact CG-CD2 4.32Å; F83-L92 HydrophobicContact CZ-CD2 4.16Å; L92-L94 HydrophobicContact CD1-CD1 4.34Å; L92-L94 HydrophobicContact CD1-CG 4.17Å; L92-L94 HydrophobicContact CD2-CD1 3.99Å; L92-L94 HydrophobicContact CG-CD1 4.05Å; L92-L94 HydrophobicContact CG-CG 4.23Å; L92-F107 HydrophobicContact CD2-CD1 4.31Å; L92-F107 HydrophobicContact CD2-CE1 4.17Å; L92-L110 HydrophobicContact CD2-CD1 3.89Å; L92-L113 HydrophobicContact CB-CD1 3.85Å; L92-L113 HydrophobicContact CB-CD2 4.43Å; L92-D115 PolarHBondContact N-O 3.01Å; L92-L116 HydrophobicContact CB-CD1 4.12Å; L92-L116 HydrophobicContact CD2-CD1 3.97Å; L92-L116 HydrophobicContact CG-CD1 4.01Å; L92-N117 PolarHBondContact O-N 3.24Å
93	H	98.5	Very high	95.7	Very high	26 Å²	26	36.6 Å²	36.6	12%	0.12	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	116.2	178	-55.4	137.8	0	0	0	111.1	L68 L70 R71 W91	L68-H93 PolarHBondContact O-N 2.81Å; L70-H93 PolarHBondContact N-O 3.43Å; R71-H93 HydrophobicContact CG-CB 3.97Å; R71-H93 PolarHBondContact NH1-ND1 3.28Å; R71-H93 PolarHBondContact NH2-CD2 2.9Å; R71-H93 VanDerWaalsContact NH2-CG 3.25Å; R71-H93 PolarHBondContact NH2-ND1 3.23Å; W91-H93 AromaticContact CD2-CE1 3.97Å; W91-H93 AromaticContact CE3-CE1 3.29Å; W91-H93 AromaticContact CE3-CG 3.97Å; W91-H93 AromaticContact CE3-ND1 3.3Å; W91-H93 VanDerWaalsContact CE3-ND1 3.3Å; W91-H93 AromaticContact CE3-NE2 3.98Å; W91-H93 AromaticContact CZ3-CE1 3.61Å; W91-H93 AromaticContact CZ3-ND1 3.24Å; W91-H93 WeakPolarHBondContact CZ3-ND1 3.37Å
94	L	98.1	Very high	95.7	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	22%	0.216	C	C	.	.			trans	-119.9	15.8	177.5	-71.8	162.4	0	0	0	111.3	L70 I75 L78 F83 L92 N97 I99 F107 N117 L118 N121	L70-L94 HydrophobicContact CB-CD2 3.96Å; L70-L94 HydrophobicContact CD1-CD2 3.89Å; I75-L94 HydrophobicContact CD1-CD2 3.77Å; L78-L94 HydrophobicContact CD1-CD1 3.99Å; L78-L94 HydrophobicContact CD2-CD1 4.32Å; F83-L94 HydrophobicContact CE2-CD1 4.16Å; F83-L94 HydrophobicContact CZ-CD1 3.89Å; F83-L94 HydrophobicContact CZ-CD2 4.16Å; L92-L94 HydrophobicContact CD1-CD1 4.34Å; L92-L94 HydrophobicContact CD1-CG 4.17Å; L92-L94 HydrophobicContact CD2-CD1 3.99Å; L92-L94 HydrophobicContact CG-CD1 4.05Å; L92-L94 HydrophobicContact CG-CG 4.23Å; L94-N97 PolarHBondContact O-ND2 3.06Å; L94-I99 HydrophobicContact CB-CD1 4.14Å; L94-F107 HydrophobicContact CD1-CE1 4.13Å; L94-N117 WeakPolarHBondContact CA-O 3.42Å; L94-N117 PolarHBondContact N-O 3.23Å; L94-L118 HydrophobicContact CB-CD2 3.91Å; L94-L118 HydrophobicContact CD1-CD2 3.86Å; L94-N121 PolarHBondContact O-ND2 2.89Å
95	D	98.4	Very high	95.8	Very high	7 Å²	7	37.8 Å²	37.8	4%	0.037	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.1	156.8	-176.8	60.3	-97.7	0	0	0	113.9	R71 H72 N97 N117 S119	R71-D95 WeakPolarHBondContact CA-O 3.4Å; R71-D95 WeakPolarHBondContact CG-OD2 3.27Å; R71-D95 IonicContact CZ-OD1 2.81Å; R71-D95 VanDerWaalsContact NE-CG 3.31Å; R71-D95 IonicContact NE-OD1 2.66Å; R71-D95 PolarHBondContact NE-OD1 3.01Å; R71-D95 IonicContact NE-OD2 2.78Å; R71-D95 PolarHBondContact NE-OD2 3.01Å; R71-D95 VanDerWaalsContact NE-OD2 3.13Å; R71-D95 IonicContact NH2-OD1 3.36Å; R71-D95 PolarHBondContact NH2-OD1 2.82Å; H72-D95 PolarHBondContact N-O 3.47Å; D95-N97 PolarHBondContact O-N 3.23Å; D95-N97 PolarHBondContact O-ND2 3.43Å; D95-N117 WeakPolarHBondContact CB-OD1 3.44Å; D95-N117 PolarHBondContact N-O 3Å; D95-S119 WeakPolarHBondContact CA-O 3.23Å; D95-S119 WeakPolarHBondContact CB-O 3.48Å; D95-S119 WeakPolarHBondContact CB-OG 3.34Å
96	H	98.1	Very high	96.1	Very high	81 Å²	81	36.2 Å²	36.2	38%	0.375	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.5	33	-177.2	-56.6	89.5	0	0	0	114.2	H72 S119 S120	H72-H96 WeakPolarHBondContact CA-O 3.44Å; H72-H96 VanDerWaalsContact CE1-CB 3.48Å; H72-H96 WeakPolarHBondContact CE1-CB 3.08Å; H72-H96 AromaticContact CE1-CD2 3.82Å; H72-H96 AromaticContact CE1-CG 3.39Å; H72-H96 AromaticContact CE1-ND1 3.79Å; H72-H96 VanDerWaalsContact ND1-CB 3.34Å; H72-H96 WeakPolarHBondContact ND1-CB 3.41Å; H72-H96 AromaticContact ND1-CG 3.8Å; H72-H96 AromaticContact NE2-CG 3.97Å; H72-H96 AromaticContact NE2-ND1 3.95Å; H96-S119 PolarHBondContact N-O 3.15Å; H96-S119 VanDerWaalsContact N-O 3.11Å; H96-S120 WeakPolarHBondContact CA-O 3.46Å; H96-S120 WeakPolarHBondContact CD2-CB 3.33Å; H96-S120 PolarHBondContact CD2-OG 2.76Å; H96-S120 WeakPolarHBondContact NE2-CB 3.3Å; H96-S120 PolarHBondContact NE2-OG 3.46Å
97	N	97.8	Very high	96.3	Very high	7 Å²	7	35.7 Å²	35.7	4%	0.037	18%	0.184	C	C	.	.	S	Bend	trans	-97.1	-165.4	170.2	-84.1	-91.7	0	0	0	110.7	L70 N73 I75 L94 D95 I99 N121	L70-N97 PolarHBondContact O-ND2 2.97Å; N73-N97 WeakPolarHBondContact CA-OD1 3.43Å; N73-N97 WeakPolarHBondContact CB-OD1 3.46Å; N73-N97 PolarHBondContact O-OD1 2.95Å; I75-N97 HydrophobicContact CB-CB 4.33Å; I75-N97 VanDerWaalsContact CB-OD1 3.31Å; I75-N97 WeakPolarHBondContact CB-OD1 3.45Å; I75-N97 WeakPolarHBondContact CG1-OD1 3.36Å; I75-N97 PolarHBondContact N-OD1 3.44Å; I75-N97 VanDerWaalsContact N-OD1 3.1Å; L94-N97 PolarHBondContact O-ND2 3.06Å; D95-N97 PolarHBondContact O-N 3.23Å; D95-N97 PolarHBondContact O-ND2 3.43Å; N97-I99 HydrophobicContact CB-CD1 4.23Å; N97-I99 HydrophobicContact CB-CG1 4.04Å; N97-N121 WeakPolarHBondContact CA-OD1 3.11Å; N97-N121 WeakPolarHBondContact CB-OD1 3.39Å; N97-N121 PolarHBondContact O-OD1 3.45Å
98	Q	97.3	Very high	96.4	Very high	67 Å²	67	35.5 Å²	35.5	31%	0.313	18%	0.178	S	C	.	.			trans	-117.3	23.6	179.9	-59.6	-169.6	74.6	0	0	112.2	I75 T76 T100 N121	I75-Q98 CarbonylContact O-C 3.2Å; I75-Q98 WeakPolarHBondContact O-CA 3.27Å; I75-Q98 PolarHBondContact O-N 3.45Å; T76-Q98 HydrophobicContact CG2-CB 4.16Å; Q98-T100 PolarHBondContact O-N 3.12Å; Q98-T100 VanDerWaalsContact O-N 3.13Å; Q98-N121 PolarHBondContact N-OD1 3.09Å
99	I	98.1	Very high	96.3	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	17%	0.166	C	C	.	.			trans	-61.9	114.2	-170.8	-58.1	167.9	0	0	0	110	I75 T76 L78 L94 N97 T101 V102 L118 N121 R122 I123	I75-I99 HydrophobicContact CB-CG1 4.31Å; I75-I99 HydrophobicContact CG2-CD1 4.33Å; I75-I99 HydrophobicContact CG2-CG1 4.02Å; I75-I99 WeakPolarHBondContact O-CG1 3.22Å; I75-I99 PolarHBondContact O-N 3.49Å; I75-I99 VanDerWaalsContact O-N 3.11Å; T76-I99 WeakPolarHBondContact O-CA 3.49Å; L78-I99 HydrophobicContact CD1-CD1 4.24Å; L78-I99 HydrophobicContact CD2-CD1 4.08Å; L78-I99 HydrophobicContact CG-CD1 4.18Å; L78-I99 HydrophobicContact CG-CG2 4.31Å; L94-I99 HydrophobicContact CB-CD1 4.14Å; N97-I99 HydrophobicContact CB-CD1 4.23Å; N97-I99 HydrophobicContact CB-CG1 4.04Å; I99-T101 WeakPolarHBondContact CG2-O 3.3Å; I99-V102 HydrophobicContact CG2-CG2 3.89Å; I99-L118 HydrophobicContact CD1-CD2 4.24Å; I99-N121 HydrophobicContact CB-CB 4.26Å; I99-N121 VanDerWaalsContact CB-OD1 3.28Å; I99-N121 WeakPolarHBondContact CB-OD1 3.48Å; I99-N121 VanDerWaalsContact CG1-OD1 3.3Å; I99-N121 WeakPolarHBondContact CG1-OD1 3.33Å; I99-N121 PolarHBondContact N-OD1 3.29Å; I99-R122 CarbonylContact O-C 3.52Å; I99-R122 VanDerWaalsContact O-CA 3.27Å; I99-R122 WeakPolarHBondContact O-CA 3.47Å; I99-R122 PolarHBondContact O-N 3.41Å; I99-I123 HydrophobicContact CB-CG1 4.45Å; I99-I123 HydrophobicContact CG2-CD1 4.42Å; I99-I123 HydrophobicContact CG2-CG1 4.11Å; I99-I123 WeakPolarHBondContact O-CG1 3.34Å; I99-I123 PolarHBondContact O-N 2.89Å; I99-I123 VanDerWaalsContact O-N 3.08Å
100	T	97	Very high	96.3	Very high	64 Å²	64	32.8 Å²	32.8	39%	0.393	17%	0.166	S	C	.	.			trans	-96.6	-32.4	172.1	52.8	0	0	0	0	112.1	T76 Q98 R122	T76-T100 PolarHBondContact O-N 2.87Å; T76-T100 PolarHBondContact O-OG1 3.04Å; Q98-T100 PolarHBondContact O-N 3.12Å; Q98-T100 VanDerWaalsContact O-N 3.13Å; T100-R122 HydrophobicContact CG2-CB 3.82Å
101	T	95.6	Very high	96.2	Very high	57 Å²	57	36 Å²	36	35%	0.35	18%	0.175	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	131.1	-168.8	-46.7	0	0	0	0	109.9	E77 L78 I99 Q103	E77-T101 WeakPolarHBondContact CA-O 3.04Å; E77-T101 HydrophobicContact CG-CG2 4.4Å; E77-T101 WeakPolarHBondContact OE1-CG2 3.21Å; L78-T101 PolarHBondContact N-O 3.22Å; I99-T101 WeakPolarHBondContact CG2-O 3.3Å; T101-Q103 HydrophobicContact CG2-CG 4.33Å
102	V	96.9	Very high	96.1	Very high	9 Å²	9	39.1 Å²	39.1	6%	0.055	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	115.3	165.8	-178.4	0	0	0	0	105.3	L78 I99 A106 F107 I123 L126 T130	L78-V102 HydrophobicContact CB-CG1 4.29Å; L78-V102 HydrophobicContact CD1-CG1 4.23Å; L78-V102 HydrophobicContact CD1-CG2 3.98Å; L78-V102 HydrophobicContact CG-CG2 4.37Å; I99-V102 HydrophobicContact CG2-CG2 3.89Å; V102-A106 HydrophobicContact CG1-CB 3.97Å; V102-F107 HydrophobicContact CG1-CE2 3.86Å; V102-F107 HydrophobicContact CG1-CZ 4.39Å; V102-I123 HydrophobicContact CG2-CD1 4.21Å; V102-L126 HydrophobicContact CB-CD2 3.68Å; V102-L126 HydrophobicContact CG1-CD2 4.32Å; V102-L126 HydrophobicContact CG2-CD2 3.73Å; V102-T130 HydrophobicContact CG1-CG2 3.9Å
103	Q	94	Very high	96.1	Very high	77 Å²	77	39.1 Å²	39.1	36%	0.36	19%	0.189	S	C	.	.			trans	-74.9	167.2	179.5	-61.2	-161.6	15.7	0	0	111	E77 L78 P80 T101 A106	E77-Q103 PolarHBondContact OE1-NE2 3.46Å; L78-Q103 PolarHBondContact O-N 3.46Å; P80-Q103 VanDerWaalsContact CD-OE1 3.31Å; P80-Q103 HydrophobicContact CG-CB 3.98Å; T101-Q103 HydrophobicContact CG2-CG 4.33Å; Q103-A106 WeakPolarHBondContact O-CB 3.41Å
104	E	92.3	Very high	96.1	Very high	117 Å²	117	42.7 Å²	42.7	55%	0.547	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.1	143.7	173.5	-59.5	-171.8	170	0	0	109.8	P80 A106 P127	P80-E104 WeakPolarHBondContact CB-O 3.4Å; E104-A106 PolarHBondContact O-N 2.99Å; E104-P127 HydrophobicContact CG-CB 3.88Å; E104-P127 HydrophobicContact CG-CG 3.8Å
105	D	91.9	Very high	96.1	Very high	49 Å²	49	44.6 Å²	44.6	26%	0.262	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.7	18.7	177.5	-52.2	-22.8	0	0	0	116.1	D81 F107 Q108 H133	D81-D105 PolarHBondContact N-O 3.18Å; D105-F107 PolarHBondContact O-N 3.44Å; D105-F107 VanDerWaalsContact O-N 3.13Å; D105-Q108 HydrophobicContact CB-CB 4.17Å; D105-Q108 WeakPolarHBondContact O-CB 3.48Å; D105-Q108 PolarHBondContact O-N 2.87Å; D105-H133 IonicContact OD1-NE2 3.09Å
106	A	95.1	Very high	96.2	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-26.9	176.5	0	0	0	0	0	114.3	L78 S79 F83 V102 Q103 E104	L78-A106 HydrophobicContact CB-CB 4.03Å; S79-A106 VanDerWaalsContact O-CA 3.26Å; S79-A106 WeakPolarHBondContact O-CA 3.39Å; S79-A106 VanDerWaalsContact O-CB 3.26Å; S79-A106 WeakPolarHBondContact O-CB 3.27Å; F83-A106 WeakPolarHBondContact CD2-O 3.46Å; V102-A106 HydrophobicContact CG1-CB 3.97Å; Q103-A106 WeakPolarHBondContact O-CB 3.41Å; E104-A106 PolarHBondContact O-N 2.99Å
107	F	96.1	Very high	96.2	Very high	2 Å²	2	41.4 Å²	41.4	1%	0.009	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.3	17.8	175.5	-56.2	-65.7	0	0	0	113.6	L78 F83 L92 L94 V102 D105 L110 L116 L118 T130 F131 L134	L78-F107 HydrophobicContact CD1-CE1 3.83Å; L78-F107 HydrophobicContact CD1-CE2 4.37Å; L78-F107 HydrophobicContact CD1-CZ 3.45Å; L78-F107 VanDerWaalsContact CD1-CZ 3.45Å; F83-F107 AromaticContact CD2-CD1 3.94Å; F83-F107 HydrophobicContact CD2-CD1 3.94Å; F83-F107 HydrophobicContact CD2-CE1 4.17Å; F83-F107 HydrophobicContact CE2-CD1 4.23Å; F83-F107 AromaticContact CE2-CE1 3.98Å; F83-F107 HydrophobicContact CE2-CE1 3.98Å; L92-F107 HydrophobicContact CD2-CD1 4.31Å; L92-F107 HydrophobicContact CD2-CE1 4.17Å; L94-F107 HydrophobicContact CD1-CE1 4.13Å; V102-F107 HydrophobicContact CG1-CE2 3.86Å; V102-F107 HydrophobicContact CG1-CZ 4.39Å; D105-F107 PolarHBondContact O-N 3.44Å; D105-F107 VanDerWaalsContact O-N 3.13Å; F107-L110 HydrophobicContact CB-CD1 4.23Å; F107-L110 HydrophobicContact CD1-CD1 4.03Å; F107-L110 WeakPolarHBondContact O-CB 3.23Å; F107-L110 PolarHBondContact O-N 2.9Å; F107-L116 HydrophobicContact CD2-CD2 4.4Å; F107-L116 HydrophobicContact CE1-CD1 4.12Å; F107-L116 HydrophobicContact CE1-CD2 4.29Å; F107-L116 HydrophobicContact CE2-CD2 4.18Å; F107-L116 HydrophobicContact CZ-CD1 4.39Å; F107-L116 HydrophobicContact CZ-CD2 4.13Å; F107-L118 HydrophobicContact CE2-CD1 4.15Å; F107-L118 HydrophobicContact CZ-CD1 3.87Å; F107-L118 HydrophobicContact CZ-CD2 4.12Å; F107-L118 HydrophobicContact CZ-CG 4.49Å; F107-T130 HydrophobicContact CD2-CG2 3.83Å; F107-T130 WeakPolarHBondContact CD2-O 3.47Å; F107-T130 HydrophobicContact CE2-CG2 3.76Å; F107-F131 HydrophobicContact CD2-CD1 4.33Å; F107-F131 HydrophobicContact CD2-CE1 4.29Å; F107-F131 HydrophobicContact CE2-CE1 4.04Å; F107-L134 HydrophobicContact CB-CD1 4.42Å; F107-L134 HydrophobicContact CB-CD2 4.14Å
108	Q	94.4	Very high	96.2	Very high	45 Å²	45	41.1 Å²	41.1	21%	0.21	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	149.7	172.8	-178.9	161.2	-112.9	0	0	111.2	D81 Y84 D105 L110	D81-Q108 WeakPolarHBondContact OD1-CB 3.28Å; D81-Q108 WeakPolarHBondContact OD1-CG 3.47Å; D81-Q108 PolarHBondContact OD1-NE2 3.17Å; D81-Q108 PolarHBondContact OD2-NE2 3.07Å; Y84-Q108 HydrophobicContact CD2-CG 4.23Å; D105-Q108 HydrophobicContact CB-CB 4.17Å; D105-Q108 WeakPolarHBondContact O-CB 3.48Å; D105-Q108 PolarHBondContact O-N 2.87Å; Q108-L110 PolarHBondContact O-N 2.02Å
109	G	92.2	Very high	96.3	Very high	4 Å²	4	38.3 Å²	38.3	4%	0.041	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	82.8	-22.1	-173.8	0	0	0	0	0	115.3	Y111	G109-Y111 VanDerWaalsContact O-CD2 3.28Å; G109-Y111 WeakPolarHBondContact O-CD2 3.46Å; G109-Y111 PolarHBondContact O-N 2.98Å
110	L	96	Very high	96.3	Very high	1 Å²	1	39.9 Å²	39.9	1%	0.005	20%	0.198	C	C	.	.			trans	-78.4	39.4	-175.3	-61.5	-171.5	0	0	0	114.9	F83 F86 L89 L92 F107 Q108 K112 L113 L134	F83-L110 HydrophobicContact CB-CD1 3.76Å; F83-L110 HydrophobicContact CB-CD2 3.93Å; F83-L110 HydrophobicContact CB-CG 3.93Å; F83-L110 HydrophobicContact CG-CD1 4.25Å; F86-L110 HydrophobicContact CB-CD2 4.03Å; F86-L110 WeakPolarHBondContact O-CD2 3.31Å; L89-L110 HydrophobicContact CB-CD2 4.27Å; L89-L110 HydrophobicContact CD1-CD2 4.1Å; L92-L110 HydrophobicContact CD2-CD1 3.89Å; F107-L110 HydrophobicContact CB-CD1 4.23Å; F107-L110 HydrophobicContact CD1-CD1 4.03Å; F107-L110 WeakPolarHBondContact O-CB 3.23Å; F107-L110 PolarHBondContact O-N 2.9Å; Q108-L110 PolarHBondContact O-N 2.02Å; L110-K112 PolarHBondContact O-N 2.64Å; L110-L113 HydrophobicContact CB-CB 4.24Å; L110-L113 HydrophobicContact CD1-CD2 4.14Å; L110-L113 VanDerWaalsContact O-CB 3.28Å; L110-L113 WeakPolarHBondContact O-CB 3.08Å; L110-L113 PolarHBondContact O-N 2.89Å; L110-L134 HydrophobicContact CB-CD2 3.76Å
111	Y	95.3	Very high	96.4	Very high	107 Å²	107	37.2 Å²	37.2	42%	0.42	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-18.5	-174	-50.5	-66.6	0	0	0	114.7	G109 H133 N136	G109-Y111 VanDerWaalsContact O-CD2 3.28Å; G109-Y111 WeakPolarHBondContact O-CD2 3.46Å; G109-Y111 PolarHBondContact O-N 2.98Å; Y111-H133 HydrophobicContact CD1-CB 4.27Å; Y111-H133 HydrophobicContact CE1-CB 3.94Å; Y111-N136 PolarHBondContact O-ND2 2.97Å
112	K	97.1	Very high	96.5	Very high	102 Å²	102	40 Å²	40	44%	0.443	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.4	-6.3	178.4	-72.8	-172.4	176.7	-175.8	0	114.5	L89 L110	L89-K112 CarbonylContact O-C 3.51Å; L89-K112 WeakPolarHBondContact O-CB 3.48Å; L110-K112 PolarHBondContact O-N 2.64Å
113	L	98.3	Very high	96.6	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	18%	0.182	C	C	.	.			trans	-64.3	136.6	-174.6	-158.2	73.6	0	0	0	111.5	L89 L92 L110 L116 L134 N136 L137	L89-L113 HydrophobicContact CB-CD1 3.99Å; L89-L113 WeakPolarHBondContact O-CA 3.14Å; L89-L113 PolarHBondContact O-N 2.98Å; L92-L113 HydrophobicContact CB-CD1 3.85Å; L92-L113 HydrophobicContact CB-CD2 4.43Å; L110-L113 HydrophobicContact CB-CB 4.24Å; L110-L113 HydrophobicContact CD1-CD2 4.14Å; L110-L113 VanDerWaalsContact O-CB 3.28Å; L110-L113 WeakPolarHBondContact O-CB 3.08Å; L110-L113 PolarHBondContact O-N 2.89Å; L113-L116 HydrophobicContact CD2-CB 3.93Å; L113-L116 HydrophobicContact CD2-CD1 4.34Å; L113-L116 HydrophobicContact CD2-CD2 4.36Å; L113-L116 HydrophobicContact CD2-CG 4.44Å; L113-L134 HydrophobicContact CB-CD2 4.25Å; L113-L134 HydrophobicContact CD2-CD1 4.28Å; L113-L134 HydrophobicContact CD2-CD2 4.03Å; L113-N136 CarbonylContact O-C 3.05Å; L113-L137 HydrophobicContact CD2-CD1 4.16Å; L113-L137 HydrophobicContact CG-CD1 4.25Å; L113-L137 WeakPolarHBondContact O-CA 3.4Å; L113-L137 PolarHBondContact O-N 3.42Å
114	K	98.6	Very high	96.7	Very high	101 Å²	101	39.2 Å²	39.2	44%	0.439	19%	0.185	S	C	.	.			trans	-119.5	-33.2	178.5	-60.1	178.3	-171.5	169.7	0	112	T90 Q138 I139	T90-K114 WeakPolarHBondContact O-CB 3.34Å; T90-K114 PolarHBondContact O-N 2.87Å; K114-Q138 HydrophobicContact CB-CB 4.5Å; K114-Q138 HydrophobicContact CB-CG 4.26Å; K114-Q138 WeakPolarHBondContact O-CA 3.45Å; K114-Q138 PolarHBondContact O-N 2.91Å; K114-I139 PolarHBondContact O-N 2.94Å
115	D	98.8	Very high	96.8	Very high	39 Å²	39	39.7 Å²	39.7	21%	0.209	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	130.5	178.3	-162.1	-23.8	0	0	0	110.1	T90 W91 L92 I139	T90-D115 PolarHBondContact O-N 2.93Å; W91-D115 WeakPolarHBondContact CA-O 3.46Å; W91-D115 HydrophobicContact CB-CB 3.89Å; L92-D115 PolarHBondContact N-O 3.01Å; D115-I139 HydrophobicContact CB-CB 4.35Å
116	L	98.8	Very high	97	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	111.6	174.6	178.3	56	0	0	0	109.1	L92 F107 L113 L118 F131 L134 L137 I139 L140 D141	L92-L116 HydrophobicContact CB-CD1 4.12Å; L92-L116 HydrophobicContact CD2-CD1 3.97Å; L92-L116 HydrophobicContact CG-CD1 4.01Å; F107-L116 HydrophobicContact CD2-CD2 4.4Å; F107-L116 HydrophobicContact CE1-CD1 4.12Å; F107-L116 HydrophobicContact CE1-CD2 4.29Å; F107-L116 HydrophobicContact CE2-CD2 4.18Å; F107-L116 HydrophobicContact CZ-CD1 4.39Å; F107-L116 HydrophobicContact CZ-CD2 4.13Å; L113-L116 HydrophobicContact CD2-CB 3.93Å; L113-L116 HydrophobicContact CD2-CD1 4.34Å; L113-L116 HydrophobicContact CD2-CD2 4.36Å; L113-L116 HydrophobicContact CD2-CG 4.44Å; L116-L118 HydrophobicContact CD1-CD1 4.34Å; L116-L118 HydrophobicContact CD1-CG 4.17Å; L116-L118 HydrophobicContact CD2-CD1 3.98Å; L116-L118 HydrophobicContact CG-CD1 4.03Å; L116-L118 HydrophobicContact CG-CG 4.2Å; L116-F131 HydrophobicContact CD2-CD1 4.18Å; L116-F131 HydrophobicContact CD2-CE1 3.79Å; L116-L134 HydrophobicContact CD2-CD1 3.7Å; L116-L137 HydrophobicContact CB-CD1 3.89Å; L116-I139 PolarHBondContact N-O 3.45Å; L116-I139 VanDerWaalsContact N-O 3.16Å; L116-L140 HydrophobicContact CB-CD1 4.11Å; L116-L140 HydrophobicContact CD2-CD1 4.12Å; L116-L140 HydrophobicContact CG-CD1 4.1Å; L116-D141 PolarHBondContact O-N 2.84Å
117	N	98.8	Very high	97	Very high	22 Å²	22	39.2 Å²	39.2	12%	0.118	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	116.2	174.5	-157.5	-41.2	0	0	0	111	L92 L94 D95 S119 D141	L92-N117 PolarHBondContact O-N 3.24Å; L94-N117 WeakPolarHBondContact CA-O 3.42Å; L94-N117 PolarHBondContact N-O 3.23Å; D95-N117 WeakPolarHBondContact CB-OD1 3.44Å; D95-N117 PolarHBondContact N-O 3Å; N117-S119 WeakPolarHBondContact OD1-CB 3.38Å; N117-S119 PolarHBondContact OD1-N 3.41Å; N117-S119 PolarHBondContact OD1-OG 2.94Å; N117-D141 HydrophobicContact CB-CB 4.42Å; N117-D141 PolarHBondContact ND2-OD2 2.65Å; N117-D141 PolarHBondContact OD1-OD2 3.41Å
118	L	98.5	Very high	96.9	Very high	0 Å²	0	42 Å²	42	0%	0	20%	0.2	C	C	.	.			trans	-119	17.3	176.8	-74.3	163.3	0	0	0	111	L78 L94 I99 F107 L116 N121 I123 F131 D141 L142 N145	L78-L118 HydrophobicContact CD1-CD2 4.18Å; L94-L118 HydrophobicContact CB-CD2 3.91Å; L94-L118 HydrophobicContact CD1-CD2 3.86Å; I99-L118 HydrophobicContact CD1-CD2 4.24Å; F107-L118 HydrophobicContact CE2-CD1 4.15Å; F107-L118 HydrophobicContact CZ-CD1 3.87Å; F107-L118 HydrophobicContact CZ-CD2 4.12Å; F107-L118 HydrophobicContact CZ-CG 4.49Å; L116-L118 HydrophobicContact CD1-CD1 4.34Å; L116-L118 HydrophobicContact CD1-CG 4.17Å; L116-L118 HydrophobicContact CD2-CD1 3.98Å; L116-L118 HydrophobicContact CG-CD1 4.03Å; L116-L118 HydrophobicContact CG-CG 4.2Å; L118-N121 PolarHBondContact O-ND2 2.96Å; L118-N121 VanDerWaalsContact O-ND2 3.14Å; L118-I123 HydrophobicContact CB-CD1 4.22Å; L118-I123 HydrophobicContact CD2-CD1 4.46Å; L118-F131 HydrophobicContact CD1-CE1 4.2Å; L118-F131 HydrophobicContact CD1-CZ 4.34Å; L118-D141 CarbonylContact C-O 3.54Å; L118-D141 WeakPolarHBondContact CA-O 3.34Å; L118-D141 PolarHBondContact N-O 3.2Å; L118-L142 HydrophobicContact CB-CD2 3.87Å; L118-L142 HydrophobicContact CD1-CD2 3.93Å; L118-N145 PolarHBondContact O-ND2 3Å
119	S	98.7	Very high	96.8	Very high	8 Å²	8	41.9 Å²	41.9	6%	0.056	20%	0.202	C	C	.	.			trans	-69	164.8	-175.8	68.5	0	0	0	0	113.6	D95 H96 N117 N121 D141 S143	D95-S119 WeakPolarHBondContact CA-O 3.23Å; D95-S119 WeakPolarHBondContact CB-O 3.48Å; D95-S119 WeakPolarHBondContact CB-OG 3.34Å; H96-S119 PolarHBondContact N-O 3.15Å; H96-S119 VanDerWaalsContact N-O 3.11Å; N117-S119 WeakPolarHBondContact OD1-CB 3.38Å; N117-S119 PolarHBondContact OD1-N 3.41Å; N117-S119 PolarHBondContact OD1-OG 2.94Å; S119-N121 VanDerWaalsContact C-N 3.26Å; S119-N121 PolarHBondContact O-N 2.87Å; S119-N121 PolarHBondContact O-ND2 2.79Å; S119-D141 WeakPolarHBondContact CB-OD2 3.46Å; S119-D141 PolarHBondContact N-O 3.29Å; S119-D141 PolarHBondContact OG-OD2 3.07Å; S119-S143 CarbonylContact C-O 3.11Å; S119-S143 WeakPolarHBondContact CA-O 3.44Å; S119-S143 VanDerWaalsContact CB-O 3.31Å; S119-S143 WeakPolarHBondContact CB-O 3.33Å
120	S	98.5	Very high	96.9	Very high	34 Å²	34	41.8 Å²	41.8	24%	0.238	20%	0.201	C	C	.	.	S	Bend	trans	54	40.7	178.7	-63.9	0	0	0	0	113.4	H96 S143	H96-S120 WeakPolarHBondContact CA-O 3.46Å; H96-S120 WeakPolarHBondContact CD2-CB 3.33Å; H96-S120 PolarHBondContact CD2-OG 2.76Å; H96-S120 WeakPolarHBondContact NE2-CB 3.3Å; H96-S120 PolarHBondContact NE2-OG 3.46Å; S120-S143 PolarHBondContact N-O 3Å
121	N	98.6	Very high	96.9	Very high	7 Å²	7	41.8 Å²	41.8	4%	0.037	20%	0.201	C	C	.	.	S	Bend	trans	-115.6	-165.5	177.9	-87.9	-76	0	0	0	110.5	L94 N97 Q98 I99 L118 S119 I123 N145	L94-N121 PolarHBondContact O-ND2 2.89Å; N97-N121 WeakPolarHBondContact CA-OD1 3.11Å; N97-N121 WeakPolarHBondContact CB-OD1 3.39Å; N97-N121 PolarHBondContact O-OD1 3.45Å; Q98-N121 PolarHBondContact N-OD1 3.09Å; I99-N121 HydrophobicContact CB-CB 4.26Å; I99-N121 VanDerWaalsContact CB-OD1 3.28Å; I99-N121 WeakPolarHBondContact CB-OD1 3.48Å; I99-N121 VanDerWaalsContact CG1-OD1 3.3Å; I99-N121 WeakPolarHBondContact CG1-OD1 3.33Å; I99-N121 PolarHBondContact N-OD1 3.29Å; L118-N121 PolarHBondContact O-ND2 2.96Å; L118-N121 VanDerWaalsContact O-ND2 3.14Å; S119-N121 VanDerWaalsContact C-N 3.26Å; S119-N121 PolarHBondContact O-N 2.87Å; S119-N121 PolarHBondContact O-ND2 2.79Å; N121-I123 HydrophobicContact CB-CD1 4.41Å; N121-I123 HydrophobicContact CB-CG1 4.26Å; N121-N145 WeakPolarHBondContact CA-OD1 3.37Å; N121-N145 WeakPolarHBondContact CB-OD1 3.12Å; N121-N145 PolarHBondContact O-OD1 3.09Å
122	R	98.2	Very high	96.9	Very high	116 Å²	116	40.2 Å²	40.2	44%	0.438	20%	0.199	S	C	.	.			trans	-120.6	23.7	-177.4	-58.4	-174.1	-174.5	162	12.2	112.6	I99 T100 T124 N145	I99-R122 CarbonylContact O-C 3.52Å; I99-R122 VanDerWaalsContact O-CA 3.27Å; I99-R122 WeakPolarHBondContact O-CA 3.47Å; I99-R122 PolarHBondContact O-N 3.41Å; T100-R122 HydrophobicContact CG2-CB 3.82Å; R122-T124 PolarHBondContact O-N 3.31Å; R122-N145 PolarHBondContact N-OD1 3.33Å
123	I	98.3	Very high	96.6	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	19%	0.189	C	C	.	.			trans	-65.4	123.6	-175.4	-59	171.2	0	0	0	109.2	I99 V102 L118 N121 K125 L126 N145 Q146 M147	I99-I123 HydrophobicContact CB-CG1 4.45Å; I99-I123 HydrophobicContact CG2-CD1 4.42Å; I99-I123 HydrophobicContact CG2-CG1 4.11Å; I99-I123 WeakPolarHBondContact O-CG1 3.34Å; I99-I123 PolarHBondContact O-N 2.89Å; I99-I123 VanDerWaalsContact O-N 3.08Å; V102-I123 HydrophobicContact CG2-CD1 4.21Å; L118-I123 HydrophobicContact CB-CD1 4.22Å; L118-I123 HydrophobicContact CD2-CD1 4.46Å; N121-I123 HydrophobicContact CB-CD1 4.41Å; N121-I123 HydrophobicContact CB-CG1 4.26Å; I123-K125 VanDerWaalsContact CG2-O 3.28Å; I123-K125 WeakPolarHBondContact CG2-O 3.29Å; I123-L126 HydrophobicContact CG2-CD1 4.46Å; I123-L126 HydrophobicContact CG2-CD2 3.61Å; I123-L126 HydrophobicContact CG2-CG 3.77Å; I123-N145 HydrophobicContact CB-CB 4.33Å; I123-N145 VanDerWaalsContact CB-OD1 3.29Å; I123-N145 WeakPolarHBondContact CB-OD1 3.27Å; I123-N145 WeakPolarHBondContact CG1-OD1 3.23Å; I123-N145 PolarHBondContact N-OD1 2.93Å; I123-Q146 CarbonylContact O-C 3.22Å; I123-Q146 VanDerWaalsContact O-C 3.27Å; I123-Q146 WeakPolarHBondContact O-CA 3.13Å; I123-Q146 PolarHBondContact O-N 3.12Å; I123-M147 HydrophobicContact CG2-CG 4.29Å; I123-M147 HydrophobicContact CG2-SD 4.46Å; I123-M147 WeakPolarHBondContact O-CG 3.32Å; I123-M147 PolarHBondContact O-N 2.77Å
124	T	96.5	Very high	96.6	Very high	69 Å²	69	37.7 Å²	37.7	42%	0.423	19%	0.189	S	C	.	.			trans	-102.1	-25.5	-179.1	58.5	0	0	0	0	113.6	R122 Q146 M147	R122-T124 PolarHBondContact O-N 3.31Å; T124-Q146 HydrophobicContact CG2-CB 4.05Å; T124-M147 WeakPolarHBondContact O-CA 3.29Å
125	K	95.1	Very high	96.4	Very high	127 Å²	127	37.2 Å²	37.2	55%	0.552	19%	0.19	S	C	*	.			trans	-154	162.4	177.3	-67.9	-167	176.5	-164.4	0	109.7	I123	I123-K125 VanDerWaalsContact CG2-O 3.28Å; I123-K125 WeakPolarHBondContact CG2-O 3.29Å
126	L	96.2	Very high	96.4	Very high	7 Å²	7	37.5 Å²	37.5	4%	0.037	19%	0.192	C	C	.	.			trans	-138.1	135.1	168.8	-67.7	175.3	0	0	0	108.9	V102 I123 T130 F131 L142 M147 L154	V102-L126 HydrophobicContact CB-CD2 3.68Å; V102-L126 HydrophobicContact CG1-CD2 4.32Å; V102-L126 HydrophobicContact CG2-CD2 3.73Å; I123-L126 HydrophobicContact CG2-CD1 4.46Å; I123-L126 HydrophobicContact CG2-CD2 3.61Å; I123-L126 HydrophobicContact CG2-CG 3.77Å; L126-T130 HydrophobicContact CD2-CG2 4.25Å; L126-F131 HydrophobicContact CD1-CE2 3.73Å; L126-F131 HydrophobicContact CD1-CZ 3.6Å; L126-L142 HydrophobicContact CD1-CD1 4.23Å; L126-L142 HydrophobicContact CD1-CD2 3.89Å; L126-M147 HydrophobicContact CD1-SD 4.29Å; L126-L154 HydrophobicContact CB-CD1 3.66Å; L126-L154 HydrophobicContact CB-CD2 4.24Å; L126-L154 HydrophobicContact CD1-CD1 4.43Å; L126-L154 HydrophobicContact CD1-CD2 4.43Å
127	P	94.1	Very high	96.4	Very high	32 Å²	32	37.5 Å²	37.5	21%	0.208	19%	0.192	C	C	.	.			trans	-68	155.4	174.8	26.7	-33.1	0	0	0	112.1	E104 T129 T130 L154	E104-P127 HydrophobicContact CG-CB 3.88Å; E104-P127 HydrophobicContact CG-CG 3.8Å; P127-T129 PolarHBondContact O-N 3.26Å; P127-T129 VanDerWaalsContact O-N 3.15Å; P127-T130 WeakPolarHBondContact CD-OG1 3.41Å; P127-T130 WeakPolarHBondContact CG-OG1 3.32Å; P127-T130 WeakPolarHBondContact O-CB 3.41Å; P127-T130 PolarHBondContact O-N 2.86Å; P127-T130 VanDerWaalsContact O-N 3.11Å; P127-T130 PolarHBondContact O-OG1 2.57Å; P127-L154 VanDerWaalsContact O-CD1 3.31Å; P127-L154 WeakPolarHBondContact O-CD1 3.28Å
128	N	93.3	Very high	96.4	Very high	61 Å²	61	39.6 Å²	39.6	33%	0.326	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-29	-178.1	-71.8	-61.8	0	0	0	113.3	T130 E151 E153 L154	N128-T130 VanDerWaalsContact C-N 3.34Å; N128-T130 PolarHBondContact O-N 3.27Å; N128-E151 WeakPolarHBondContact OD1-CB 3.49Å; N128-E153 HydrophobicContact CB-CB 4.37Å; N128-E153 VanDerWaalsContact OD1-C 3.28Å; N128-E153 WeakPolarHBondContact OD1-CA 3.33Å; N128-E153 PolarHBondContact OD1-N 3Å; N128-L154 PolarHBondContact OD1-N 3.47Å; N128-L154 VanDerWaalsContact OD1-N 3.12Å
129	T	92.4	Very high	96.4	Very high	42 Å²	42	42 Å²	42	26%	0.258	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-22.9	179.2	46.9	0	0	0	0	113.9	P127 F131 I132	P127-T129 PolarHBondContact O-N 3.26Å; P127-T129 VanDerWaalsContact O-N 3.15Å; T129-F131 PolarHBondContact O-N 3.17Å; T129-I132 VanDerWaalsContact O-CG2 3.26Å; T129-I132 WeakPolarHBondContact O-CG2 3.2Å; T129-I132 PolarHBondContact O-N 2.93Å
130	T	95.8	Very high	96.4	Very high	3 Å²	3	41.7 Å²	41.7	2%	0.018	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-41.7	-45.6	-170.8	-50.2	0	0	0	0	114.3	V102 F107 L126 P127 N128	V102-T130 HydrophobicContact CG1-CG2 3.9Å; F107-T130 HydrophobicContact CD2-CG2 3.83Å; F107-T130 WeakPolarHBondContact CD2-O 3.47Å; F107-T130 HydrophobicContact CE2-CG2 3.76Å; L126-T130 HydrophobicContact CD2-CG2 4.25Å; P127-T130 WeakPolarHBondContact CD-OG1 3.41Å; P127-T130 WeakPolarHBondContact CG-OG1 3.32Å; P127-T130 WeakPolarHBondContact O-CB 3.41Å; P127-T130 PolarHBondContact O-N 2.86Å; P127-T130 VanDerWaalsContact O-N 3.11Å; P127-T130 PolarHBondContact O-OG1 2.57Å; N128-T130 VanDerWaalsContact C-N 3.34Å; N128-T130 PolarHBondContact O-N 3.27Å
131	F	96.5	Very high	96.4	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111	3.2	-173.5	-53.5	-50.6	0	0	0	114.1	F107 L116 L118 L126 T129 H133 L134 L140 L142 L154 F155 L158	F107-F131 HydrophobicContact CD2-CD1 4.33Å; F107-F131 HydrophobicContact CD2-CE1 4.29Å; F107-F131 HydrophobicContact CE2-CE1 4.04Å; L116-F131 HydrophobicContact CD2-CD1 4.18Å; L116-F131 HydrophobicContact CD2-CE1 3.79Å; L118-F131 HydrophobicContact CD1-CE1 4.2Å; L118-F131 HydrophobicContact CD1-CZ 4.34Å; L126-F131 HydrophobicContact CD1-CE2 3.73Å; L126-F131 HydrophobicContact CD1-CZ 3.6Å; T129-F131 PolarHBondContact O-N 3.17Å; F131-H133 PolarHBondContact O-N 3.49Å; F131-H133 VanDerWaalsContact O-N 3.13Å; F131-L134 HydrophobicContact CB-CD1 4.31Å; F131-L134 HydrophobicContact CD1-CD1 3.71Å; F131-L134 HydrophobicContact CG-CD1 4.45Å; F131-L134 WeakPolarHBondContact O-CB 3.4Å; F131-L134 PolarHBondContact O-N 2.91Å; F131-L140 HydrophobicContact CD2-CD2 4.07Å; F131-L140 HydrophobicContact CE1-CD1 4.2Å; F131-L140 HydrophobicContact CE1-CD2 4.48Å; F131-L140 HydrophobicContact CE2-CD2 3.82Å; F131-L140 HydrophobicContact CZ-CD1 4.1Å; F131-L140 HydrophobicContact CZ-CD2 4.03Å; F131-L142 HydrophobicContact CE2-CD1 4.12Å; F131-L142 HydrophobicContact CZ-CD1 4.15Å; F131-L142 HydrophobicContact CZ-CD2 4.29Å; F131-L154 HydrophobicContact CD2-CD1 3.85Å; F131-L154 HydrophobicContact CD2-CG 4.11Å; F131-L154 WeakPolarHBondContact CD2-O 3.47Å; F131-L154 HydrophobicContact CE2-CD1 3.89Å; F131-L154 HydrophobicContact CE2-CG 4.14Å; F131-F155 HydrophobicContact CD2-CD1 4.03Å; F131-F155 HydrophobicContact CD2-CE1 4.09Å; F131-F155 HydrophobicContact CE2-CD1 4.39Å; F131-F155 AromaticContact CE2-CE1 3.98Å; F131-F155 HydrophobicContact CE2-CE1 3.98Å; F131-L158 HydrophobicContact CB-CD1 4.01Å; F131-L158 HydrophobicContact CB-CD2 4.33Å; F131-L158 WeakPolarHBondContact O-CD2 3.42Å
132	I	93.5	Very high	96.4	Very high	74 Å²	74	40.8 Å²	40.8	38%	0.379	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-29.3	-169.9	-158.4	172.2	0	0	0	113.2	T129	T129-I132 VanDerWaalsContact O-CG2 3.26Å; T129-I132 WeakPolarHBondContact O-CG2 3.2Å; T129-I132 PolarHBondContact O-N 2.93Å
133	H	92.5	Very high	96.4	Very high	50 Å²	50	35.5 Å²	35.5	23%	0.231	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-12.6	177.7	-61.3	-55.3	0	0	0	114.1	D105 Y111 F131 I135	D105-H133 IonicContact OD1-NE2 3.09Å; Y111-H133 HydrophobicContact CD1-CB 4.27Å; Y111-H133 HydrophobicContact CE1-CB 3.94Å; F131-H133 PolarHBondContact O-N 3.49Å; F131-H133 VanDerWaalsContact O-N 3.13Å; H133-I135 PolarHBondContact O-N 3.22Å
134	L	96.9	Very high	96.5	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.208	C	C	.	.			trans	-82.8	48.5	-176.3	-54.4	-175.6	0	0	0	112.1	F107 L110 L113 L116 F131 N136 L137 L158	F107-L134 HydrophobicContact CB-CD1 4.42Å; F107-L134 HydrophobicContact CB-CD2 4.14Å; L110-L134 HydrophobicContact CB-CD2 3.76Å; L113-L134 HydrophobicContact CB-CD2 4.25Å; L113-L134 HydrophobicContact CD2-CD1 4.28Å; L113-L134 HydrophobicContact CD2-CD2 4.03Å; L116-L134 HydrophobicContact CD2-CD1 3.7Å; F131-L134 HydrophobicContact CB-CD1 4.31Å; F131-L134 HydrophobicContact CD1-CD1 3.71Å; F131-L134 HydrophobicContact CG-CD1 4.45Å; F131-L134 WeakPolarHBondContact O-CB 3.4Å; F131-L134 PolarHBondContact O-N 2.91Å; L134-N136 PolarHBondContact O-N 3.37Å; L134-L137 HydrophobicContact CB-CB 4.09Å; L134-L137 HydrophobicContact CB-CD2 4.33Å; L134-L137 HydrophobicContact CD1-CD1 4.38Å; L134-L137 HydrophobicContact CD1-CD2 4.09Å; L134-L137 VanDerWaalsContact O-CB 3.29Å; L134-L137 WeakPolarHBondContact O-CB 3.46Å; L134-L137 PolarHBondContact O-N 3.01Å; L134-L158 HydrophobicContact CB-CD2 4.22Å; L134-L158 WeakPolarHBondContact O-CD2 3.39Å
135	I	95.3	Very high	96.6	Very high	91 Å²	91	37.9 Å²	37.9	47%	0.467	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-11.4	-174.3	61	167.3	0	0	0	115	H133	H133-I135 PolarHBondContact O-N 3.22Å
136	N	98	Very high	96.7	Very high	45 Å²	45	36 Å²	36	24%	0.241	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.4	2.1	177.6	-75.3	-58.5	0	0	0	114.6	Y111 L113 L134 Q138 K160	Y111-N136 PolarHBondContact O-ND2 2.97Å; L113-N136 CarbonylContact O-C 3.05Å; L134-N136 PolarHBondContact O-N 3.37Å; N136-Q138 WeakPolarHBondContact O-CG 3.42Å; N136-K160 PolarHBondContact OD1-NZ 2.88Å
137	L	98.6	Very high	96.7	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	18%	0.181	C	C	.	.			trans	-61.4	138.4	-177.2	-154.7	68.8	0	0	0	111.7	L113 L116 L134 L140 L158 K160 L161	L113-L137 HydrophobicContact CD2-CD1 4.16Å; L113-L137 HydrophobicContact CG-CD1 4.25Å; L113-L137 WeakPolarHBondContact O-CA 3.4Å; L113-L137 PolarHBondContact O-N 3.42Å; L116-L137 HydrophobicContact CB-CD1 3.89Å; L134-L137 HydrophobicContact CB-CB 4.09Å; L134-L137 HydrophobicContact CB-CD2 4.33Å; L134-L137 HydrophobicContact CD1-CD1 4.38Å; L134-L137 HydrophobicContact CD1-CD2 4.09Å; L134-L137 VanDerWaalsContact O-CB 3.29Å; L134-L137 WeakPolarHBondContact O-CB 3.46Å; L134-L137 PolarHBondContact O-N 3.01Å; L137-L140 HydrophobicContact CD2-CB 3.92Å; L137-L140 HydrophobicContact CD2-CD1 4.34Å; L137-L140 HydrophobicContact CD2-CD2 4.15Å; L137-L140 HydrophobicContact CD2-CG 4.36Å; L137-L158 HydrophobicContact CB-CD2 4.39Å; L137-L158 HydrophobicContact CD2-CD1 4.38Å; L137-K160 CarbonylContact O-C 3.17Å; L137-K160 WeakPolarHBondContact O-CB 3.41Å; L137-L161 HydrophobicContact CB-CD1 4.49Å; L137-L161 HydrophobicContact CD2-CD1 4.17Å; L137-L161 HydrophobicContact CG-CD1 4.16Å; L137-L161 WeakPolarHBondContact O-CA 3.42Å; L137-L161 PolarHBondContact O-N 2.91Å
138	Q	98.7	Very high	96.8	Very high	65 Å²	65	36.8 Å²	36.8	30%	0.304	19%	0.187	S	C	.	.			trans	-125.3	-37.2	-176.4	-59.7	-175.9	-15	0	0	110.9	K114 N136 Q162 I163	K114-Q138 HydrophobicContact CB-CB 4.5Å; K114-Q138 HydrophobicContact CB-CG 4.26Å; K114-Q138 WeakPolarHBondContact O-CA 3.45Å; K114-Q138 PolarHBondContact O-N 2.91Å; N136-Q138 WeakPolarHBondContact O-CG 3.42Å; Q138-Q162 WeakPolarHBondContact O-CA 3.24Å; Q138-Q162 PolarHBondContact O-N 2.85Å; Q138-I163 PolarHBondContact O-N 3.26Å
139	I	98.9	Very high	96.8	Very high	52 Å²	52	36 Å²	36	27%	0.267	19%	0.186	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	131.4	177.5	-55.2	179.1	0	0	0	108.3	K114 D115 L116 I163	K114-I139 PolarHBondContact O-N 2.94Å; D115-I139 HydrophobicContact CB-CB 4.35Å; L116-I139 PolarHBondContact N-O 3.45Å; L116-I139 VanDerWaalsContact N-O 3.16Å; I139-I163 HydrophobicContact CD1-CD1 4.37Å; I139-I163 HydrophobicContact CG1-CB 4.32Å; I139-I163 HydrophobicContact CG1-CD1 4.28Å; I139-I163 HydrophobicContact CG2-CB 4.42Å
140	L	98.8	Very high	96.9	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	118.5	171.8	177.8	55.2	0	0	0	109.3	L116 F131 L137 L142 F155 L161 I163 L164 H165	L116-L140 HydrophobicContact CB-CD1 4.11Å; L116-L140 HydrophobicContact CD2-CD1 4.12Å; L116-L140 HydrophobicContact CG-CD1 4.1Å; F131-L140 HydrophobicContact CD2-CD2 4.07Å; F131-L140 HydrophobicContact CE1-CD1 4.2Å; F131-L140 HydrophobicContact CE1-CD2 4.48Å; F131-L140 HydrophobicContact CE2-CD2 3.82Å; F131-L140 HydrophobicContact CZ-CD1 4.1Å; F131-L140 HydrophobicContact CZ-CD2 4.03Å; L137-L140 HydrophobicContact CD2-CB 3.92Å; L137-L140 HydrophobicContact CD2-CD1 4.34Å; L137-L140 HydrophobicContact CD2-CD2 4.15Å; L137-L140 HydrophobicContact CD2-CG 4.36Å; L140-L142 HydrophobicContact CD1-CD1 4.33Å; L140-L142 HydrophobicContact CD1-CG 4.13Å; L140-L142 HydrophobicContact CD2-CD1 4.03Å; L140-L142 HydrophobicContact CG-CD1 4.07Å; L140-L142 HydrophobicContact CG-CG 4.2Å; L140-F155 HydrophobicContact CD2-CD1 4.11Å; L140-F155 HydrophobicContact CD2-CE1 3.77Å; L140-L161 HydrophobicContact CB-CD1 3.84Å; L140-I163 PolarHBondContact N-O 2.82Å; L140-L164 HydrophobicContact CB-CD1 4.02Å; L140-L164 HydrophobicContact CD2-CD1 3.97Å; L140-L164 HydrophobicContact CG-CD1 3.94Å; L140-L164 WeakPolarHBondContact O-CA 3.08Å; L140-H165 PolarHBondContact O-N 3.24Å
141	D	98.8	Very high	96.8	Very high	22 Å²	22	37.4 Å²	37.4	12%	0.118	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	115.2	176	-173.3	7	0	0	0	111.1	L116 N117 L118 S119 S143 H165	L116-D141 PolarHBondContact O-N 2.84Å; N117-D141 HydrophobicContact CB-CB 4.42Å; N117-D141 PolarHBondContact ND2-OD2 2.65Å; N117-D141 PolarHBondContact OD1-OD2 3.41Å; L118-D141 CarbonylContact C-O 3.54Å; L118-D141 WeakPolarHBondContact CA-O 3.34Å; L118-D141 PolarHBondContact N-O 3.2Å; S119-D141 WeakPolarHBondContact CB-OD2 3.46Å; S119-D141 PolarHBondContact N-O 3.29Å; S119-D141 PolarHBondContact OG-OD2 3.07Å; D141-S143 WeakPolarHBondContact OD1-CB 3.37Å; D141-S143 PolarHBondContact OD1-N 3.22Å; D141-S143 PolarHBondContact OD1-OG 3.21Å; D141-H165 HydrophobicContact CB-CB 4.3Å; D141-H165 WeakPolarHBondContact OD1-CB 3.32Å
142	L	98.6	Very high	96.6	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.208	C	C	.	.			trans	-118.3	19.3	177.1	-71.3	164.3	0	0	0	111	L118 L126 F131 L140 N145 M147 F155 H165 L166 N169	L118-L142 HydrophobicContact CB-CD2 3.87Å; L118-L142 HydrophobicContact CD1-CD2 3.93Å; L126-L142 HydrophobicContact CD1-CD1 4.23Å; L126-L142 HydrophobicContact CD1-CD2 3.89Å; F131-L142 HydrophobicContact CE2-CD1 4.12Å; F131-L142 HydrophobicContact CZ-CD1 4.15Å; F131-L142 HydrophobicContact CZ-CD2 4.29Å; L140-L142 HydrophobicContact CD1-CD1 4.33Å; L140-L142 HydrophobicContact CD1-CG 4.13Å; L140-L142 HydrophobicContact CD2-CD1 4.03Å; L140-L142 HydrophobicContact CG-CD1 4.07Å; L140-L142 HydrophobicContact CG-CG 4.2Å; L142-N145 PolarHBondContact O-ND2 3.21Å; L142-N145 VanDerWaalsContact O-ND2 3.13Å; L142-M147 HydrophobicContact CB-CE 3.7Å; L142-M147 HydrophobicContact CD1-CE 4.25Å; L142-M147 HydrophobicContact CG-CE 4.42Å; L142-F155 HydrophobicContact CD1-CE1 4.25Å; L142-F155 HydrophobicContact CD1-CZ 4.43Å; L142-H165 PolarHBondContact N-O 3.24Å; L142-L166 HydrophobicContact CB-CD2 4Å; L142-L166 HydrophobicContact CD1-CD2 4.05Å; L142-N169 PolarHBondContact O-ND2 2.76Å
143	S	98.7	Very high	96.6	Very high	6 Å²	6	41.7 Å²	41.7	4%	0.042	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66	157.9	-175.8	-54.8	0	0	0	0	113.2	S119 S120 D141 N145 H165 R167	S119-S143 CarbonylContact C-O 3.11Å; S119-S143 WeakPolarHBondContact CA-O 3.44Å; S119-S143 VanDerWaalsContact CB-O 3.31Å; S119-S143 WeakPolarHBondContact CB-O 3.33Å; S120-S143 PolarHBondContact N-O 3Å; D141-S143 WeakPolarHBondContact OD1-CB 3.37Å; D141-S143 PolarHBondContact OD1-N 3.22Å; D141-S143 PolarHBondContact OD1-OG 3.21Å; S143-N145 PolarHBondContact O-N 2.82Å; S143-N145 PolarHBondContact O-ND2 2.89Å; S143-H165 VanDerWaalsContact OG-CB 3.26Å; S143-H165 WeakPolarHBondContact OG-CB 3.45Å; S143-R167 CarbonylContact C-O 3.18Å; S143-R167 WeakPolarHBondContact CA-O 3.45Å; S143-R167 PolarHBondContact OG-N 2.61Å
144	F	98.6	Very high	96.7	Very high	112 Å²	112	39.5 Å²	39.5	49%	0.491	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.5	37.1	177.3	-56.5	-87.5	0	0	0	113.3	R167 S168	F144-R167 PolarHBondContact N-O 3.06Å; F144-S168 WeakPolarHBondContact CD1-OG 3.31Å; F144-S168 WeakPolarHBondContact CE1-OG 3.46Å
145	N	98.7	Very high	96.7	Very high	6 Å²	6	39.5 Å²	39.5	3%	0.032	20%	0.203	C	C	.	.	S	Bend	trans	-106.6	-173.8	171.2	-85.1	-75.1	0	0	0	110.6	L118 N121 R122 I123 L142 S143 M147 N169	L118-N145 PolarHBondContact O-ND2 3Å; N121-N145 WeakPolarHBondContact CA-OD1 3.37Å; N121-N145 WeakPolarHBondContact CB-OD1 3.12Å; N121-N145 PolarHBondContact O-OD1 3.09Å; R122-N145 PolarHBondContact N-OD1 3.33Å; I123-N145 HydrophobicContact CB-CB 4.33Å; I123-N145 VanDerWaalsContact CB-OD1 3.29Å; I123-N145 WeakPolarHBondContact CB-OD1 3.27Å; I123-N145 WeakPolarHBondContact CG1-OD1 3.23Å; I123-N145 PolarHBondContact N-OD1 2.93Å; L142-N145 PolarHBondContact O-ND2 3.21Å; L142-N145 VanDerWaalsContact O-ND2 3.13Å; S143-N145 PolarHBondContact O-N 2.82Å; S143-N145 PolarHBondContact O-ND2 2.89Å; N145-M147 HydrophobicContact CB-CG 4.49Å; N145-N169 VanDerWaalsContact CB-OD1 3.24Å; N145-N169 WeakPolarHBondContact CB-OD1 3.35Å; N145-N169 PolarHBondContact O-OD1 2.79Å
146	Q	98	Very high	96.6	Very high	88 Å²	88	39.8 Å²	39.8	41%	0.411	20%	0.203	S	C	.	.			trans	-114	21.9	-172.8	-56.9	-172	20.4	0	0	112.5	I123 T124 T148 L170	I123-Q146 CarbonylContact O-C 3.22Å; I123-Q146 VanDerWaalsContact O-C 3.27Å; I123-Q146 WeakPolarHBondContact O-CA 3.13Å; I123-Q146 PolarHBondContact O-N 3.12Å; T124-Q146 HydrophobicContact CG2-CB 4.05Å; Q146-T148 PolarHBondContact O-N 3.07Å; Q146-L170 HydrophobicContact CB-CD1 4.18Å
147	M	96.9	Very high	96.4	Very high	1 Å²	1	38.7 Å²	38.7	1%	0.005	20%	0.201	C	C	.	.			trans	-67.2	126.4	-174.1	-61.3	-173.9	-68.8	0	0	111.6	I123 T124 L126 L142 N145 L150 L166 N169 L170 L171	I123-M147 HydrophobicContact CG2-CG 4.29Å; I123-M147 HydrophobicContact CG2-SD 4.46Å; I123-M147 WeakPolarHBondContact O-CG 3.32Å; I123-M147 PolarHBondContact O-N 2.77Å; T124-M147 WeakPolarHBondContact O-CA 3.29Å; L126-M147 HydrophobicContact CD1-SD 4.29Å; L142-M147 HydrophobicContact CB-CE 3.7Å; L142-M147 HydrophobicContact CD1-CE 4.25Å; L142-M147 HydrophobicContact CG-CE 4.42Å; N145-M147 HydrophobicContact CB-CG 4.49Å; M147-L150 HydrophobicContact CB-CD2 4.39Å; M147-L150 HydrophobicContact CE-CD2 3.96Å; M147-L150 HydrophobicContact SD-CD2 3.73Å; M147-L166 HydrophobicContact CE-CD2 3.6Å; M147-N169 WeakPolarHBondContact CB-OD1 3.48Å; M147-N169 WeakPolarHBondContact CE-OD1 3.23Å; M147-N169 PolarHBondContact N-OD1 3.19Å; M147-N169 VanDerWaalsContact N-OD1 3.07Å; M147-L170 CarbonylContact O-C 3.27Å; M147-L170 VanDerWaalsContact O-CA 3.24Å; M147-L170 WeakPolarHBondContact O-CA 3.3Å; M147-L170 WeakPolarHBondContact O-CB 3.42Å; M147-L170 PolarHBondContact O-N 2.83Å; M147-L171 HydrophobicContact CB-CD2 4.19Å; M147-L171 PolarHBondContact O-N 3.28Å; M147-L171 VanDerWaalsContact O-N 3.17Å
148	T	95.3	Very high	96.3	Very high	55 Å²	55	38.8 Å²	38.8	34%	0.337	20%	0.202	S	C	.	.	S	Bend	trans	-98.6	-23.1	-177.2	53.7	0	0	0	0	113.9	Q146 L170 R172	Q146-T148 PolarHBondContact O-N 3.07Å; T148-L170 HydrophobicContact CG2-CB 3.87Å; T148-L170 HydrophobicContact CG2-CD1 4.23Å; T148-R172 PolarHBondContact O-N 2.88Å
149	S	93.9	Very high	96.2	Very high	44 Å²	44	42.2 Å²	42.2	31%	0.308	21%	0.212	S	C	.	.			trans	-147	162.8	171.5	52.5	0	0	0	0	108.8
150	L	94.2	Very high	96.1	Very high	13 Å²	13	44.4 Å²	44.4	7%	0.068	22%	0.22	C	C	.	.			trans	-114.6	140.1	164.9	-54.9	-179.9	0	0	0	107.8	M147 L154 F155 L166 L171 P175	M147-L150 HydrophobicContact CB-CD2 4.39Å; M147-L150 HydrophobicContact CE-CD2 3.96Å; M147-L150 HydrophobicContact SD-CD2 3.73Å; L150-L154 HydrophobicContact CB-CD2 4.3Å; L150-L154 HydrophobicContact CD2-CD2 4.15Å; L150-F155 HydrophobicContact CD1-CE2 3.87Å; L150-F155 HydrophobicContact CD1-CZ 4.1Å; L150-L166 HydrophobicContact CD1-CD1 3.67Å; L150-L166 HydrophobicContact CD1-CD2 3.95Å; L150-L166 HydrophobicContact CD1-CG 4.47Å; L150-L166 HydrophobicContact CD2-CD2 4.23Å; L150-L171 HydrophobicContact CD1-CD1 4.18Å; L150-L171 HydrophobicContact CD2-CD2 3.98Å; L150-L171 HydrophobicContact CG-CD1 4.22Å; L150-L171 HydrophobicContact CG-CD2 3.83Å; L150-P175 HydrophobicContact CB-CB 4.32Å; L150-P175 HydrophobicContact CB-CG 4.2Å; L150-P175 HydrophobicContact CD1-CG 4.29Å
151	E	93.3	Very high	96.1	Very high	62 Å²	62	44.4 Å²	44.4	29%	0.29	22%	0.22	S	C	.	.			trans	-71.7	150.2	179.1	-61.5	-57.7	150.2	0	0	111.3	N128 E153 L154	N128-E151 WeakPolarHBondContact OD1-CB 3.49Å; E151-E153 PolarHBondContact O-N 2.83Å; E151-L154 HydrophobicContact CB-CB 4.47Å; E151-L154 PolarHBondContact O-N 2.82Å
152	P	92.1	Very high	96.1	Very high	58 Å²	58	47.2 Å²	47.2	38%	0.377	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-15.4	-167.7	-24	35.6	0	0	0	115.9	R177 A178	P152-R177 CarbonylContact O-C 3.09Å; P152-R177 VanDerWaalsContact O-C 3.3Å; P152-A178 VanDerWaalsContact O-CA 3.24Å; P152-A178 WeakPolarHBondContact O-CA 3.26Å; P152-A178 PolarHBondContact O-N 3.47Å; P152-A178 VanDerWaalsContact O-N 3.16Å
153	E	93.4	Very high	96.1	Very high	106 Å²	106	49.6 Å²	49.6	50%	0.495	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-126.3	9.8	-174.8	-63.8	-179.9	-179.7	0	0	112.4	N128 E151 F155 H156	N128-E153 HydrophobicContact CB-CB 4.37Å; N128-E153 VanDerWaalsContact OD1-C 3.28Å; N128-E153 WeakPolarHBondContact OD1-CA 3.33Å; N128-E153 PolarHBondContact OD1-N 3Å; E151-E153 PolarHBondContact O-N 2.83Å; E153-F155 PolarHBondContact O-N 3.41Å; E153-F155 VanDerWaalsContact O-N 3.09Å; E153-H156 HydrophobicContact CB-CB 4.3Å; E153-H156 WeakPolarHBondContact O-CB 3.34Å; E153-H156 PolarHBondContact O-N 3.32Å
154	L	95.3	Very high	96.1	Very high	3 Å²	3	49.3 Å²	49.3	2%	0.016	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.2	-30.1	-178.1	179.5	62	0	0	0	114.5	L126 P127 N128 F131 L150 E151	L126-L154 HydrophobicContact CB-CD1 3.66Å; L126-L154 HydrophobicContact CB-CD2 4.24Å; L126-L154 HydrophobicContact CD1-CD1 4.43Å; L126-L154 HydrophobicContact CD1-CD2 4.43Å; P127-L154 VanDerWaalsContact O-CD1 3.31Å; P127-L154 WeakPolarHBondContact O-CD1 3.28Å; N128-L154 PolarHBondContact OD1-N 3.47Å; N128-L154 VanDerWaalsContact OD1-N 3.12Å; F131-L154 HydrophobicContact CD2-CD1 3.85Å; F131-L154 HydrophobicContact CD2-CG 4.11Å; F131-L154 WeakPolarHBondContact CD2-O 3.47Å; F131-L154 HydrophobicContact CE2-CD1 3.89Å; F131-L154 HydrophobicContact CE2-CG 4.14Å; L150-L154 HydrophobicContact CB-CD2 4.3Å; L150-L154 HydrophobicContact CD2-CD2 4.15Å; E151-L154 HydrophobicContact CB-CB 4.47Å; E151-L154 PolarHBondContact O-N 2.82Å
155	F	96.1	Very high	96.1	Very high	1 Å²	1	46.5 Å²	46.5	0%	0.004	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110.3	21.4	176.5	-46.8	-58	0	0	0	112.6	F131 L140 L142 L150 E153 L158 L164 A178 F179	F131-F155 HydrophobicContact CD2-CD1 4.03Å; F131-F155 HydrophobicContact CD2-CE1 4.09Å; F131-F155 HydrophobicContact CE2-CD1 4.39Å; F131-F155 AromaticContact CE2-CE1 3.98Å; F131-F155 HydrophobicContact CE2-CE1 3.98Å; L140-F155 HydrophobicContact CD2-CD1 4.11Å; L140-F155 HydrophobicContact CD2-CE1 3.77Å; L142-F155 HydrophobicContact CD1-CE1 4.25Å; L142-F155 HydrophobicContact CD1-CZ 4.43Å; L150-F155 HydrophobicContact CD1-CE2 3.87Å; L150-F155 HydrophobicContact CD1-CZ 4.1Å; E153-F155 PolarHBondContact O-N 3.41Å; E153-F155 VanDerWaalsContact O-N 3.09Å; F155-L158 HydrophobicContact CB-CD1 3.95Å; F155-L158 HydrophobicContact CB-CG 4.44Å; F155-L158 HydrophobicContact CD1-CD1 3.95Å; F155-L158 HydrophobicContact CG-CD1 4.42Å; F155-L158 WeakPolarHBondContact O-CB 3.19Å; F155-L158 PolarHBondContact O-N 3.41Å; F155-L164 HydrophobicContact CD2-CD2 4.17Å; F155-L164 HydrophobicContact CE1-CD1 4.27Å; F155-L164 HydrophobicContact CE1-CD2 4.42Å; F155-L164 HydrophobicContact CE2-CD2 3.83Å; F155-L164 HydrophobicContact CZ-CD1 4.21Å; F155-L164 HydrophobicContact CZ-CD2 3.96Å; F155-A178 WeakPolarHBondContact CB-O 3.47Å; F155-A178 HydrophobicContact CD2-CB 4.41Å; F155-F179 HydrophobicContact CD2-CD1 4.02Å; F155-F179 AromaticContact CD2-CE1 3.98Å; F155-F179 HydrophobicContact CD2-CE1 3.98Å; F155-F179 HydrophobicContact CE2-CD1 4.29Å; F155-F179 AromaticContact CE2-CE1 3.76Å; F155-F179 HydrophobicContact CE2-CE1 3.76Å
156	H	94.6	Very high	96.1	Very high	97 Å²	97	46.2 Å²	46.2	45%	0.449	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.2	142	175.5	-174	77.7	0	0	0	110.8	E153 L158	E153-H156 HydrophobicContact CB-CB 4.3Å; E153-H156 WeakPolarHBondContact O-CB 3.34Å; E153-H156 PolarHBondContact O-N 3.32Å; H156-L158 PolarHBondContact O-N 3.49Å; H156-L158 VanDerWaalsContact O-N 3.08Å
157	G	92.9	Very high	96.1	Very high	21 Å²	21	46.4 Å²	46.4	22%	0.216	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.1	-12	-179.5	0	0	0	0	0	116.2	R159	G157-R159 PolarHBondContact O-N 3.08Å
158	L	96.4	Very high	96.2	Very high	2 Å²	2	47.8 Å²	47.8	1%	0.01	24%	0.236	C	C	.	.			trans	-73.6	50.2	-178.9	-60.3	-170.3	0	0	0	113.9	F131 L134 L137 F155 H156 K160 L161	F131-L158 HydrophobicContact CB-CD1 4.01Å; F131-L158 HydrophobicContact CB-CD2 4.33Å; F131-L158 WeakPolarHBondContact O-CD2 3.42Å; L134-L158 HydrophobicContact CB-CD2 4.22Å; L134-L158 WeakPolarHBondContact O-CD2 3.39Å; L137-L158 HydrophobicContact CB-CD2 4.39Å; L137-L158 HydrophobicContact CD2-CD1 4.38Å; F155-L158 HydrophobicContact CB-CD1 3.95Å; F155-L158 HydrophobicContact CB-CG 4.44Å; F155-L158 HydrophobicContact CD1-CD1 3.95Å; F155-L158 HydrophobicContact CG-CD1 4.42Å; F155-L158 WeakPolarHBondContact O-CB 3.19Å; F155-L158 PolarHBondContact O-N 3.41Å; H156-L158 PolarHBondContact O-N 3.49Å; H156-L158 VanDerWaalsContact O-N 3.08Å; L158-K160 PolarHBondContact O-N 3.04Å; L158-K160 VanDerWaalsContact O-N 3.13Å; L158-L161 HydrophobicContact CB-CB 4.22Å; L158-L161 HydrophobicContact CD1-CD2 4.28Å; L158-L161 VanDerWaalsContact O-CB 3.3Å; L158-L161 WeakPolarHBondContact O-CB 3.24Å; L158-L161 PolarHBondContact O-N 3.47Å; L158-L161 VanDerWaalsContact O-N 3.13Å
159	R	96.1	Very high	96.3	Very high	137 Å²	137	45.3 Å²	45.3	52%	0.517	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-13	-174.1	-65.2	174.5	-177.8	167.7	6	114.2	G157 D181 N184	G157-R159 PolarHBondContact O-N 3.08Å; R159-D181 WeakPolarHBondContact CA-O 3.48Å; R159-D181 HydrophobicContact CG-CB 4.38Å; R159-D181 WeakPolarHBondContact CG-O 3.32Å; R159-D181 IonicContact CZ-OD2 3.51Å; R159-D181 VanDerWaalsContact CZ-OD2 3.27Å; R159-D181 IonicContact NE-OD2 3.82Å; R159-D181 PolarHBondContact NE-OD2 2.89Å; R159-D181 IonicContact NH2-OD2 3.04Å; R159-D181 PolarHBondContact NH2-OD2 2.92Å; R159-N184 PolarHBondContact O-ND2 2.81Å
160	K	98	Very high	96.5	Very high	98 Å²	98	45.5 Å²	45.5	43%	0.426	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.8	-4.9	177.3	-71.6	-178.2	-178.9	179.5	0	113.8	N136 L137 L158 Q162	N136-K160 PolarHBondContact OD1-NZ 2.88Å; L137-K160 CarbonylContact O-C 3.17Å; L137-K160 WeakPolarHBondContact O-CB 3.41Å; L158-K160 PolarHBondContact O-N 3.04Å; L158-K160 VanDerWaalsContact O-N 3.13Å; K160-Q162 PolarHBondContact O-N 3.31Å
161	L	98.6	Very high	96.6	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	22%	0.215	C	C	.	.			trans	-63.3	128.8	-179.9	-165.3	69.2	0	0	0	109.9	L137 L140 L158 L164 N184 L185	L137-L161 HydrophobicContact CB-CD1 4.49Å; L137-L161 HydrophobicContact CD2-CD1 4.17Å; L137-L161 HydrophobicContact CG-CD1 4.16Å; L137-L161 WeakPolarHBondContact O-CA 3.42Å; L137-L161 PolarHBondContact O-N 2.91Å; L140-L161 HydrophobicContact CB-CD1 3.84Å; L158-L161 HydrophobicContact CB-CB 4.22Å; L158-L161 HydrophobicContact CD1-CD2 4.28Å; L158-L161 VanDerWaalsContact O-CB 3.3Å; L158-L161 WeakPolarHBondContact O-CB 3.24Å; L158-L161 PolarHBondContact O-N 3.47Å; L158-L161 VanDerWaalsContact O-N 3.13Å; L161-L164 HydrophobicContact CD2-CB 4.13Å; L161-L164 HydrophobicContact CD2-CD2 4.28Å; L161-N184 CarbonylContact O-C 3.2Å; L161-L185 HydrophobicContact CB-CD1 4.35Å; L161-L185 HydrophobicContact CD2-CD1 3.98Å; L161-L185 HydrophobicContact CG-CD1 3.8Å; L161-L185 VanDerWaalsContact O-CA 3.23Å; L161-L185 WeakPolarHBondContact O-CA 3.49Å; L161-L185 PolarHBondContact O-N 3.28Å
162	Q	98.6	Very high	96.6	Very high	81 Å²	81	49.1 Å²	49.1	38%	0.379	23%	0.228	S	C	.	.			trans	-112.8	-38	-178.2	-68.2	175	-1.7	0	0	111.4	Q138 K160 E186 Y187	Q138-Q162 WeakPolarHBondContact O-CA 3.24Å; Q138-Q162 PolarHBondContact O-N 2.85Å; K160-Q162 PolarHBondContact O-N 3.31Å; Q162-E186 PolarHBondContact O-N 3.47Å; Q162-Y187 PolarHBondContact O-N 3.29Å
163	I	98.9	Very high	96.5	Very high	51 Å²	51	50.3 Å²	50.3	26%	0.262	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	125.2	-176.9	-53.8	-178.2	0	0	0	109.1	Q138 I139 L140 H165 Y187	Q138-I163 PolarHBondContact O-N 3.26Å; I139-I163 HydrophobicContact CD1-CD1 4.37Å; I139-I163 HydrophobicContact CG1-CB 4.32Å; I139-I163 HydrophobicContact CG1-CD1 4.28Å; I139-I163 HydrophobicContact CG2-CB 4.42Å; L140-I163 PolarHBondContact N-O 2.82Å; I163-H165 WeakPolarHBondContact CG2-NE2 3.19Å; I163-Y187 HydrophobicContact CG2-CD1 3.87Å; I163-Y187 HydrophobicContact CG2-CG 4.3Å
164	L	98.7	Very high	96.2	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	113.2	174.7	177.5	55.8	0	0	0	110.1	L140 F155 L161 L166 F179 L185 Y187 L188 G189	L140-L164 HydrophobicContact CB-CD1 4.02Å; L140-L164 HydrophobicContact CD2-CD1 3.97Å; L140-L164 HydrophobicContact CG-CD1 3.94Å; L140-L164 WeakPolarHBondContact O-CA 3.08Å; F155-L164 HydrophobicContact CD2-CD2 4.17Å; F155-L164 HydrophobicContact CE1-CD1 4.27Å; F155-L164 HydrophobicContact CE1-CD2 4.42Å; F155-L164 HydrophobicContact CE2-CD2 3.83Å; F155-L164 HydrophobicContact CZ-CD1 4.21Å; F155-L164 HydrophobicContact CZ-CD2 3.96Å; L161-L164 HydrophobicContact CD2-CB 4.13Å; L161-L164 HydrophobicContact CD2-CD2 4.28Å; L164-L166 HydrophobicContact CD1-CD1 4.4Å; L164-L166 HydrophobicContact CD1-CG 4.19Å; L164-L166 HydrophobicContact CD2-CD1 3.96Å; L164-L166 HydrophobicContact CG-CD1 3.98Å; L164-L166 HydrophobicContact CG-CG 4.15Å; L164-F179 HydrophobicContact CD2-CD1 4.23Å; L164-F179 HydrophobicContact CD2-CE1 3.75Å; L164-L185 HydrophobicContact CB-CD1 3.75Å; L164-L185 HydrophobicContact CB-CD2 4.3Å; L164-Y187 PolarHBondContact N-O 3.01Å; L164-Y187 VanDerWaalsContact N-O 3.12Å; L164-L188 HydrophobicContact CB-CD1 4.21Å; L164-L188 HydrophobicContact CD2-CD1 4.03Å; L164-L188 HydrophobicContact CG-CD1 4.09Å; L164-G189 PolarHBondContact O-N 3.15Å
165	H	98.7	Very high	95.5	Very high	53 Å²	53	46.2 Å²	46.2	25%	0.245	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	123.4	174.5	-54.8	-81.4	0	0	0	110.8	L140 D141 L142 S143 I163 Y187	L140-H165 PolarHBondContact O-N 3.24Å; D141-H165 HydrophobicContact CB-CB 4.3Å; D141-H165 WeakPolarHBondContact OD1-CB 3.32Å; L142-H165 PolarHBondContact N-O 3.24Å; S143-H165 VanDerWaalsContact OG-CB 3.26Å; S143-H165 WeakPolarHBondContact OG-CB 3.45Å; I163-H165 WeakPolarHBondContact CG2-NE2 3.19Å; H165-Y187 AromaticContact CE1-CD1 3.91Å; H165-Y187 AromaticContact CE1-CE1 3.48Å; H165-Y187 VanDerWaalsContact CE1-CE1 3.48Å; H165-Y187 WeakPolarHBondContact CE1-CE1 3.47Å; H165-Y187 AromaticContact ND1-CD1 3.99Å; H165-Y187 AromaticContact ND1-CE1 3.32Å; H165-Y187 VanDerWaalsContact ND1-CE1 3.32Å; H165-Y187 WeakPolarHBondContact ND1-CE1 3.5Å
166	L	98.1	Very high	94.9	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	24%	0.241	C	C	.	.			trans	-127.5	21.1	177.5	-70.4	161.8	0	0	0	110.4	L142 M147 L150 L164 N169 F179 L188 G189 L190 N193	L142-L166 HydrophobicContact CB-CD2 4Å; L142-L166 HydrophobicContact CD1-CD2 4.05Å; M147-L166 HydrophobicContact CE-CD2 3.6Å; L150-L166 HydrophobicContact CD1-CD1 3.67Å; L150-L166 HydrophobicContact CD1-CD2 3.95Å; L150-L166 HydrophobicContact CD1-CG 4.47Å; L150-L166 HydrophobicContact CD2-CD2 4.23Å; L164-L166 HydrophobicContact CD1-CD1 4.4Å; L164-L166 HydrophobicContact CD1-CG 4.19Å; L164-L166 HydrophobicContact CD2-CD1 3.96Å; L164-L166 HydrophobicContact CG-CD1 3.98Å; L164-L166 HydrophobicContact CG-CG 4.15Å; L166-N169 PolarHBondContact O-ND2 2.8Å; L166-F179 HydrophobicContact CD1-CE1 4.32Å; L166-F179 HydrophobicContact CD1-CZ 4.3Å; L166-L188 HydrophobicContact CD1-CD1 4.3Å; L166-G189 CarbonylContact C-O 3.43Å; L166-G189 VanDerWaalsContact CA-O 3.24Å; L166-G189 WeakPolarHBondContact CA-O 3.43Å; L166-G189 WeakPolarHBondContact CB-O 3.47Å; L166-G189 PolarHBondContact N-O 3Å; L166-L190 HydrophobicContact CB-CD2 3.96Å; L166-L190 HydrophobicContact CD1-CD2 3.79Å; L166-N193 PolarHBondContact O-ND2 3.05Å
167	R	98.1	Very high	94.6	Very high	92 Å²	92	53.4 Å²	53.4	35%	0.347	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.9	149.4	-172.7	178.1	178	174.5	100.6	-7.6	111.2	S143 F144 N169 G189 S191 E215	S143-R167 CarbonylContact C-O 3.18Å; S143-R167 WeakPolarHBondContact CA-O 3.45Å; S143-R167 PolarHBondContact OG-N 2.61Å; F144-R167 PolarHBondContact N-O 3.06Å; R167-N169 VanDerWaalsContact C-N 3.31Å; R167-N169 PolarHBondContact O-N 2.82Å; R167-N169 PolarHBondContact O-ND2 3.04Å; R167-G189 PolarHBondContact N-O 3.35Å; R167-S191 CarbonylContact C-O 3.58Å; R167-S191 VanDerWaalsContact CA-O 3.26Å; R167-S191 WeakPolarHBondContact CA-O 3.2Å; R167-S191 PolarHBondContact NH1-OG 3.07Å; R167-E215 IonicContact NH1-OE1 3.27Å; R167-E215 PolarHBondContact NH1-OE1 3.03Å
168	S	98.3	Very high	94.5	Very high	30 Å²	30	52.5 Å²	52.5	21%	0.21	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.6	40.7	174.5	-55.5	0	0	0	0	113.7	F144 S191 S192	F144-S168 WeakPolarHBondContact CD1-OG 3.31Å; F144-S168 WeakPolarHBondContact CE1-OG 3.46Å; S168-S191 PolarHBondContact N-O 2.98Å; S168-S192 WeakPolarHBondContact CA-O 3.45Å
169	N	98.4	Very high	94.3	Very high	3 Å²	3	52.4 Å²	52.4	2%	0.016	24%	0.239	C	C	.	.			trans	-105.1	-173.2	171.9	-87.3	-88	0	0	0	110.7	L142 N145 M147 L166 R167 L171 N193	L142-N169 PolarHBondContact O-ND2 2.76Å; N145-N169 VanDerWaalsContact CB-OD1 3.24Å; N145-N169 WeakPolarHBondContact CB-OD1 3.35Å; N145-N169 PolarHBondContact O-OD1 2.79Å; M147-N169 WeakPolarHBondContact CB-OD1 3.48Å; M147-N169 WeakPolarHBondContact CE-OD1 3.23Å; M147-N169 PolarHBondContact N-OD1 3.19Å; M147-N169 VanDerWaalsContact N-OD1 3.07Å; L166-N169 PolarHBondContact O-ND2 2.8Å; R167-N169 VanDerWaalsContact C-N 3.31Å; R167-N169 PolarHBondContact O-N 2.82Å; R167-N169 PolarHBondContact O-ND2 3.04Å; N169-L171 HydrophobicContact CB-CG 4.23Å; N169-N193 WeakPolarHBondContact CA-OD1 3.2Å; N169-N193 WeakPolarHBondContact CB-OD1 3.23Å; N169-N193 PolarHBondContact O-OD1 3.26Å
170	L	97.8	Very high	94.2	Very high	47 Å²	47	52 Å²	52	25%	0.246	24%	0.237	C	C	.	.			trans	-107.9	16.9	-175.9	-53.2	-178	0	0	0	113	Q146 M147 T148 R172	Q146-L170 HydrophobicContact CB-CD1 4.18Å; M147-L170 CarbonylContact O-C 3.27Å; M147-L170 VanDerWaalsContact O-CA 3.24Å; M147-L170 WeakPolarHBondContact O-CA 3.3Å; M147-L170 WeakPolarHBondContact O-CB 3.42Å; M147-L170 PolarHBondContact O-N 2.83Å; T148-L170 HydrophobicContact CG2-CB 3.87Å; T148-L170 HydrophobicContact CG2-CD1 4.23Å; L170-R172 PolarHBondContact O-N 3.07Å
171	L	96.5	Very high	94	Very high	1 Å²	1	47.9 Å²	47.9	1%	0.005	22%	0.22	C	C	.	.			trans	-60.8	124.9	-172	-58.8	176.3	0	0	0	111.3	M147 L150 N169 L190 N193 R194 L195	M147-L171 HydrophobicContact CB-CD2 4.19Å; M147-L171 PolarHBondContact O-N 3.28Å; M147-L171 VanDerWaalsContact O-N 3.17Å; L150-L171 HydrophobicContact CD1-CD1 4.18Å; L150-L171 HydrophobicContact CD2-CD2 3.98Å; L150-L171 HydrophobicContact CG-CD1 4.22Å; L150-L171 HydrophobicContact CG-CD2 3.83Å; N169-L171 HydrophobicContact CB-CG 4.23Å; L171-L190 HydrophobicContact CD1-CD2 3.9Å; L171-N193 HydrophobicContact CB-CB 4.35Å; L171-N193 VanDerWaalsContact CB-OD1 3.26Å; L171-N193 WeakPolarHBondContact CB-OD1 3.43Å; L171-N193 VanDerWaalsContact CG-OD1 3.28Å; L171-N193 WeakPolarHBondContact CG-OD1 3.44Å; L171-N193 PolarHBondContact N-OD1 3.18Å; L171-N193 VanDerWaalsContact N-OD1 3.1Å; L171-R194 CarbonylContact O-C 3.46Å; L171-R194 VanDerWaalsContact O-CA 3.23Å; L171-R194 WeakPolarHBondContact O-CA 3.36Å; L171-R194 WeakPolarHBondContact O-CB 3.38Å; L171-R194 PolarHBondContact O-N 2.92Å; L171-L195 HydrophobicContact CB-CD2 4.15Å; L171-L195 PolarHBondContact O-N 2.84Å; L171-L195 VanDerWaalsContact O-N 3.13Å
172	R	93.9	Very high	93.9	Very high	151 Å²	151	47.9 Å²	47.9	57%	0.57	22%	0.22	S	C	*	.			trans	-95.8	-24	-175.4	-56.4	-173.9	-174.1	-167.3	3.5	114.1	T148 L170 R196	T148-R172 PolarHBondContact O-N 2.88Å; L170-R172 PolarHBondContact O-N 3.07Å; R172-R196 PolarHBondContact O-N 3.31Å
173	T	89.7	Confident	93.7	Very high	83 Å²	83	49.6 Å²	49.6	51%	0.509	22%	0.223	S	C	.	.	S	Bend	trans	-139.8	149.2	-175.8	47.3	0	0	0	0	109.8	L195	T173-L195 WeakPolarHBondContact O-CD2 3.45Å
174	T	85.6	Confident	93.6	Very high	8 Å²	8	49.8 Å²	49.8	5%	0.049	23%	0.225	C	C	.	.	P	Polyproline II helix	trans	-69.2	122.5	167.1	52.8	0	0	0	0	108.6	L195 L198 A199 F203	T174-L195 HydrophobicContact CG2-CD1 4.38Å; T174-L195 HydrophobicContact CG2-CD2 4.42Å; T174-L198 HydrophobicContact CG2-CD2 3.59Å; T174-A199 WeakPolarHBondContact OG1-CB 3.33Å; T174-A199 PolarHBondContact OG1-N 3.3Å; T174-F203 HydrophobicContact CG2-CZ 4.01Å
175	P	82.2	Confident	93.6	Very high	15 Å²	15	49.8 Å²	49.8	10%	0.097	23%	0.225	C	C	.	.	P	Polyproline II helix	trans	-64.1	146.6	177.1	29.9	-37	0	0	0	110.2	L150 A178 F179	L150-P175 HydrophobicContact CB-CB 4.32Å; L150-P175 HydrophobicContact CB-CG 4.2Å; L150-P175 HydrophobicContact CD1-CG 4.29Å; P175-A178 HydrophobicContact CB-CB 3.78Å; P175-A178 HydrophobicContact CG-CB 3.78Å; P175-F179 HydrophobicContact CG-CE2 3.95Å; P175-F179 HydrophobicContact CG-CZ 4.11Å
176	V	83.3	Confident	93.6	Very high	82 Å²	82	50.4 Å²	50.4	50%	0.497	23%	0.228	S	C	.	.	S	Bend	trans	-98.8	140.8	175.4	-173.3	0	0	0	0	107.9	A178 A199	V176-A178 PolarHBondContact O-N 3.46Å; V176-A178 VanDerWaalsContact O-N 3.1Å; V176-A199 HydrophobicContact CG2-CB 4.09Å
177	R	87.4	Confident	93.7	Very high	166 Å²	166	52.7 Å²	52.7	63%	0.626	24%	0.237	S	C	*	.	S	Bend	trans	68.2	-23.6	-173.5	-57.6	180	-177.2	167.8	0.8	117.5	P152 F179 W180	P152-R177 CarbonylContact O-C 3.09Å; P152-R177 VanDerWaalsContact O-C 3.3Å; R177-F179 PolarHBondContact O-N 3.49Å; R177-W180 WeakPolarHBondContact O-CB 3.13Å; R177-W180 PolarHBondContact O-N 2.88Å
178	A	90.3	Very high	93.7	Very high	2 Å²	2	48.3 Å²	48.3	2%	0.017	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.8	-31.4	-177	0	0	0	0	0	114.8	P152 F155 P175 V176	P152-A178 VanDerWaalsContact O-CA 3.24Å; P152-A178 WeakPolarHBondContact O-CA 3.26Å; P152-A178 PolarHBondContact O-N 3.47Å; P152-A178 VanDerWaalsContact O-N 3.16Å; F155-A178 WeakPolarHBondContact CB-O 3.47Å; F155-A178 HydrophobicContact CD2-CB 4.41Å; P175-A178 HydrophobicContact CB-CB 3.78Å; P175-A178 HydrophobicContact CG-CB 3.78Å; V176-A178 PolarHBondContact O-N 3.46Å; V176-A178 VanDerWaalsContact O-N 3.1Å
179	F	93.5	Very high	93.7	Very high	1 Å²	1	46.9 Å²	46.9	0%	0.004	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.7	6.9	-179.8	-53.8	-53.8	0	0	0	115.1	F155 L164 L166 P175 R177 D181 C182 L188 A204 L206	F155-F179 HydrophobicContact CD2-CD1 4.02Å; F155-F179 AromaticContact CD2-CE1 3.98Å; F155-F179 HydrophobicContact CD2-CE1 3.98Å; F155-F179 HydrophobicContact CE2-CD1 4.29Å; F155-F179 AromaticContact CE2-CE1 3.76Å; F155-F179 HydrophobicContact CE2-CE1 3.76Å; L164-F179 HydrophobicContact CD2-CD1 4.23Å; L164-F179 HydrophobicContact CD2-CE1 3.75Å; L166-F179 HydrophobicContact CD1-CE1 4.32Å; L166-F179 HydrophobicContact CD1-CZ 4.3Å; P175-F179 HydrophobicContact CG-CE2 3.95Å; P175-F179 HydrophobicContact CG-CZ 4.11Å; R177-F179 PolarHBondContact O-N 3.49Å; F179-D181 PolarHBondContact O-N 2.96Å; F179-C182 PolarHBondContact O-N 3.1Å; F179-L188 HydrophobicContact CE1-CD1 4.25Å; F179-L188 HydrophobicContact CE2-CD2 4.28Å; F179-L188 HydrophobicContact CZ-CD1 4.33Å; F179-L188 HydrophobicContact CZ-CD2 4.28Å; F179-A204 CarbonylContact C-O 3.44Å; F179-L206 HydrophobicContact CB-CD1 4.02Å; F179-L206 HydrophobicContact CB-CD2 3.85Å; F179-L206 HydrophobicContact CB-CG 3.89Å; F179-L206 HydrophobicContact CD2-CD1 4.34Å; F179-L206 HydrophobicContact CG-CD1 4.2Å
180	W	92.8	Very high	93.6	Very high	127 Å²	127	46.8 Å²	46.8	48%	0.481	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-34.6	-165.9	-169	-84.4	0	0	0	114.6	R177 A204 G205	R177-W180 WeakPolarHBondContact O-CB 3.13Å; R177-W180 PolarHBondContact O-N 2.88Å; W180-A204 WeakPolarHBondContact CA-O 3.32Å; W180-A204 HydrophobicContact CE3-CB 3.75Å; W180-A204 HydrophobicContact CZ3-CB 3.7Å; W180-G205 WeakPolarHBondContact O-CA 3.26Å
181	D	94.3	Very high	93.6	Very high	13 Å²	13	44.5 Å²	44.5	7%	0.07	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.5	-0.3	-180	-108.7	20	0	0	0	113.9	R159 F179 R183	R159-D181 WeakPolarHBondContact CA-O 3.48Å; R159-D181 HydrophobicContact CG-CB 4.38Å; R159-D181 WeakPolarHBondContact CG-O 3.32Å; R159-D181 IonicContact CZ-OD2 3.51Å; R159-D181 VanDerWaalsContact CZ-OD2 3.27Å; R159-D181 IonicContact NE-OD2 3.82Å; R159-D181 PolarHBondContact NE-OD2 2.89Å; R159-D181 IonicContact NH2-OD2 3.04Å; R159-D181 PolarHBondContact NH2-OD2 2.92Å; F179-D181 PolarHBondContact O-N 2.96Å; D181-R183 PolarHBondContact O-N 3.03Å; D181-R183 IonicContact OD1-CZ 3.76Å; D181-R183 IonicContact OD1-NE 3.81Å; D181-R183 PolarHBondContact OD1-NE 3.15Å; D181-R183 IonicContact OD1-NH2 3.47Å; D181-R183 PolarHBondContact OD1-NH2 2.88Å
182	C	95.9	Very high	93.7	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	21%	0.211	C	C	.	.			trans	-76.5	49	178	-57.3	0	0	0	0	112.5	F179 N184 L185 L206	F179-C182 PolarHBondContact O-N 3.1Å; C182-N184 PolarHBondContact O-N 3.41Å; C182-L185 HydrophobicContact CB-CB 4.19Å; C182-L185 VanDerWaalsContact O-CB 3.27Å; C182-L185 WeakPolarHBondContact O-CB 3.39Å; C182-L185 PolarHBondContact O-N 2.9Å; C182-L185 VanDerWaalsContact O-N 3.07Å; C182-L206 HydrophobicContact CB-CD2 3.85Å
183	R	95.1	Very high	93.9	Very high	116 Å²	116	39.4 Å²	39.4	44%	0.438	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-12.3	-167.2	-56.8	-177.9	-159.9	-179.2	8.9	115.1	D181 I207	D181-R183 PolarHBondContact O-N 3.03Å; D181-R183 IonicContact OD1-CZ 3.76Å; D181-R183 IonicContact OD1-NE 3.81Å; D181-R183 PolarHBondContact OD1-NE 3.15Å; D181-R183 IonicContact OD1-NH2 3.47Å; D181-R183 PolarHBondContact OD1-NH2 2.88Å; R183-I207 HydrophobicContact CB-CD1 4.33Å; R183-I207 HydrophobicContact CB-CG1 4.32Å
184	N	97.9	Very high	94.3	Very high	56 Å²	56	41.1 Å²	41.1	30%	0.299	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.9	7.5	173.3	-73.1	-66.3	0	0	0	113.6	R159 L161 C182 E186 K208	R159-N184 PolarHBondContact O-ND2 2.81Å; L161-N184 CarbonylContact O-C 3.2Å; C182-N184 PolarHBondContact O-N 3.41Å; N184-E186 WeakPolarHBondContact O-CG 3.35Å; N184-E186 PolarHBondContact O-N 2.94Å; N184-K208 WeakPolarHBondContact OD1-CE 3.37Å; N184-K208 PolarHBondContact OD1-NZ 3.13Å
185	L	98.4	Very high	94.8	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	18%	0.18	C	C	.	.			trans	-67.8	123.9	179.4	-163	78.5	0	0	0	109.7	L161 L164 C182 L188 L206 K208 L209	L161-L185 HydrophobicContact CB-CD1 4.35Å; L161-L185 HydrophobicContact CD2-CD1 3.98Å; L161-L185 HydrophobicContact CG-CD1 3.8Å; L161-L185 VanDerWaalsContact O-CA 3.23Å; L161-L185 WeakPolarHBondContact O-CA 3.49Å; L161-L185 PolarHBondContact O-N 3.28Å; L164-L185 HydrophobicContact CB-CD1 3.75Å; L164-L185 HydrophobicContact CB-CD2 4.3Å; C182-L185 HydrophobicContact CB-CB 4.19Å; C182-L185 VanDerWaalsContact O-CB 3.27Å; C182-L185 WeakPolarHBondContact O-CB 3.39Å; C182-L185 PolarHBondContact O-N 2.9Å; C182-L185 VanDerWaalsContact O-N 3.07Å; L185-L188 HydrophobicContact CD2-CB 4.01Å; L185-L188 HydrophobicContact CD2-CD1 4.31Å; L185-L206 HydrophobicContact CB-CD2 3.88Å; L185-L206 HydrophobicContact CD2-CD1 4.47Å; L185-L206 HydrophobicContact CD2-CD2 3.59Å; L185-L206 HydrophobicContact CG-CD2 4.37Å; L185-K208 CarbonylContact O-C 3.54Å; L185-L209 HydrophobicContact CD2-CD1 4.09Å; L185-L209 HydrophobicContact CG-CD1 4.23Å; L185-L209 WeakPolarHBondContact O-CA 3.46Å; L185-L209 PolarHBondContact O-N 3.48Å
186	E	98.6	Very high	95.5	Very high	66 Å²	66	47.9 Å²	47.9	31%	0.308	21%	0.205	S	C	.	.			trans	-106.2	-28.2	179.4	-53.8	-156.4	143.6	0	0	111.8	Q162 N184 K210 E211	Q162-E186 PolarHBondContact O-N 3.47Å; N184-E186 WeakPolarHBondContact O-CG 3.35Å; N184-E186 PolarHBondContact O-N 2.94Å; E186-K210 HydrophobicContact CB-CD 4.33Å; E186-K210 VanDerWaalsContact CD-CE 3.47Å; E186-K210 PolarHBondContact O-N 3.05Å; E186-K210 WeakPolarHBondContact OE1-CE 3.03Å; E186-K210 IonicContact OE1-NZ 2.89Å; E186-K210 PolarHBondContact OE1-NZ 3.48Å; E186-K210 WeakPolarHBondContact OE2-CE 3.22Å; E186-K210 IonicContact OE2-NZ 2.64Å; E186-K210 PolarHBondContact OE2-NZ 3Å; E186-E211 PolarHBondContact O-N 3.12Å
187	Y	98.8	Very high	95.9	Very high	47 Å²	47	47.3 Å²	47.3	18%	0.184	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	131.2	178.9	-177.9	-80.3	0	0	0	112.2	Q162 I163 L164 H165 E211 H213	Q162-Y187 PolarHBondContact O-N 3.29Å; I163-Y187 HydrophobicContact CG2-CD1 3.87Å; I163-Y187 HydrophobicContact CG2-CG 4.3Å; L164-Y187 PolarHBondContact N-O 3.01Å; L164-Y187 VanDerWaalsContact N-O 3.12Å; H165-Y187 AromaticContact CE1-CD1 3.91Å; H165-Y187 AromaticContact CE1-CE1 3.48Å; H165-Y187 VanDerWaalsContact CE1-CE1 3.48Å; H165-Y187 WeakPolarHBondContact CE1-CE1 3.47Å; H165-Y187 AromaticContact ND1-CD1 3.99Å; H165-Y187 AromaticContact ND1-CE1 3.32Å; H165-Y187 VanDerWaalsContact ND1-CE1 3.32Å; H165-Y187 WeakPolarHBondContact ND1-CE1 3.5Å; Y187-E211 HydrophobicContact CD2-CB 3.78Å; Y187-E211 HydrophobicContact CD2-CG 4.48Å; Y187-E211 WeakPolarHBondContact CD2-OE2 3.3Å; Y187-E211 HydrophobicContact CE2-CB 4.28Å; Y187-E211 WeakPolarHBondContact CE2-OE2 3.28Å; Y187-H213 AromaticContact CE2-CD2 3.39Å; Y187-H213 WeakPolarHBondContact CE2-CD2 3.27Å; Y187-H213 AromaticContact CE2-NE2 3.42Å; Y187-H213 WeakPolarHBondContact CE2-NE2 3.49Å; Y187-H213 AromaticContact CZ-CD2 3.42Å; Y187-H213 VanDerWaalsContact CZ-CD2 3.42Å; Y187-H213 AromaticContact CZ-NE2 3.73Å; Y187-H213 PolarHBondContact OH-CD2 3.34Å; Y187-H213 PolarHBondContact OH-NE2 2.97Å
188	L	98.4	Very high	96.2	Very high	0 Å²	0	40 Å²	40	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	108.8	174.3	-179.8	54	0	0	0	112.4	L164 L166 F179 L185 L190 F203 L206 L209 E211 L212 H213	L164-L188 HydrophobicContact CB-CD1 4.21Å; L164-L188 HydrophobicContact CD2-CD1 4.03Å; L164-L188 HydrophobicContact CG-CD1 4.09Å; L166-L188 HydrophobicContact CD1-CD1 4.3Å; F179-L188 HydrophobicContact CE1-CD1 4.25Å; F179-L188 HydrophobicContact CE2-CD2 4.28Å; F179-L188 HydrophobicContact CZ-CD1 4.33Å; F179-L188 HydrophobicContact CZ-CD2 4.28Å; L185-L188 HydrophobicContact CD2-CB 4.01Å; L185-L188 HydrophobicContact CD2-CD1 4.31Å; L188-L190 HydrophobicContact CD1-CD1 4.31Å; L188-L190 HydrophobicContact CD1-CG 4.12Å; L188-L190 HydrophobicContact CD2-CD1 3.87Å; L188-L190 HydrophobicContact CG-CD1 3.96Å; L188-L190 HydrophobicContact CG-CG 4.09Å; L188-L190 PolarHBondContact O-N 2.9Å; L188-F203 HydrophobicContact CD2-CD1 4.1Å; L188-F203 HydrophobicContact CD2-CE1 4.08Å; L188-L206 HydrophobicContact CD2-CD1 3.64Å; L188-L209 HydrophobicContact CB-CD1 3.69Å; L188-L209 HydrophobicContact CB-CD2 4.33Å; L188-E211 PolarHBondContact N-O 3.01Å; L188-L212 HydrophobicContact CB-CD1 4.14Å; L188-L212 HydrophobicContact CD2-CD1 4.02Å; L188-L212 HydrophobicContact CG-CD1 4.09Å; L188-H213 PolarHBondContact O-N 2.89Å
189	G	98.1	Very high	96.2	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	85.8	-179.3	0	0	0	0	0	114.3	L164 L166 R167	L164-G189 PolarHBondContact O-N 3.15Å; L166-G189 CarbonylContact C-O 3.43Å; L166-G189 VanDerWaalsContact CA-O 3.24Å; L166-G189 WeakPolarHBondContact CA-O 3.43Å; L166-G189 WeakPolarHBondContact CB-O 3.47Å; L166-G189 PolarHBondContact N-O 3Å; R167-G189 PolarHBondContact N-O 3.35Å
190	L	97.6	Very high	95.8	Very high	1 Å²	1	49.6 Å²	49.6	1%	0.005	22%	0.221	C	C	.	.			trans	-102.8	15.1	177	-76.1	166.1	0	0	0	113.9	L166 L171 L188 N193 L195 F203 H213 L214 N217	L166-L190 HydrophobicContact CB-CD2 3.96Å; L166-L190 HydrophobicContact CD1-CD2 3.79Å; L171-L190 HydrophobicContact CD1-CD2 3.9Å; L188-L190 HydrophobicContact CD1-CD1 4.31Å; L188-L190 HydrophobicContact CD1-CG 4.12Å; L188-L190 HydrophobicContact CD2-CD1 3.87Å; L188-L190 HydrophobicContact CG-CD1 3.96Å; L188-L190 HydrophobicContact CG-CG 4.09Å; L188-L190 PolarHBondContact O-N 2.9Å; L190-N193 PolarHBondContact O-ND2 3.1Å; L190-N193 VanDerWaalsContact O-ND2 3.08Å; L190-L195 HydrophobicContact CB-CD1 4.37Å; L190-F203 HydrophobicContact CD1-CE1 3.87Å; L190-F203 HydrophobicContact CD1-CZ 4.44Å; L190-H213 CarbonylContact C-O 3.59Å; L190-H213 VanDerWaalsContact C-O 3.28Å; L190-H213 VanDerWaalsContact CA-O 3.23Å; L190-H213 WeakPolarHBondContact CA-O 3.31Å; L190-H213 VanDerWaalsContact CB-O 3.29Å; L190-H213 WeakPolarHBondContact CB-O 3.38Å; L190-H213 PolarHBondContact N-O 2.87Å; L190-L214 HydrophobicContact CB-CD2 3.86Å; L190-L214 HydrophobicContact CD1-CD2 4.13Å; L190-N217 PolarHBondContact O-ND2 3.31Å
191	S	97.9	Very high	95.4	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	22%	0.218	C	C	.	.			trans	-72.1	159	-175.3	48.1	0	0	0	0	115.4	R167 S168 N193 H213 E215	R167-S191 CarbonylContact C-O 3.58Å; R167-S191 VanDerWaalsContact CA-O 3.26Å; R167-S191 WeakPolarHBondContact CA-O 3.2Å; R167-S191 PolarHBondContact NH1-OG 3.07Å; S168-S191 PolarHBondContact N-O 2.98Å; S191-N193 VanDerWaalsContact C-N 3.26Å; S191-N193 PolarHBondContact O-N 3.13Å; S191-N193 PolarHBondContact O-ND2 3.15Å; S191-N193 VanDerWaalsContact O-ND2 3.16Å; S191-H213 PolarHBondContact N-O 3.35Å; S191-E215 CarbonylContact C-O 3.01Å; S191-E215 VanDerWaalsContact CA-O 3.23Å; S191-E215 WeakPolarHBondContact CA-O 3.36Å; S191-E215 WeakPolarHBondContact CB-O 3.15Å; S191-E215 WeakPolarHBondContact CB-OE1 3.33Å; S191-E215 WeakPolarHBondContact CB-OE2 3.32Å; S191-E215 PolarHBondContact OG-OE1 2.94Å
192	S	98.2	Very high	95.1	Very high	38 Å²	38	46.7 Å²	46.7	27%	0.266	22%	0.215	S	C	.	.	S	Bend	trans	56.5	36	-177.6	-56.1	0	0	0	0	114	S168 E215 H216	S168-S192 WeakPolarHBondContact CA-O 3.45Å; S192-E215 PolarHBondContact N-O 2.65Å; S192-H216 WeakPolarHBondContact CA-O 3.35Å
193	N	98.3	Very high	94.9	Very high	7 Å²	7	46.9 Å²	46.9	4%	0.037	22%	0.216	C	C	.	.	S	Bend	trans	-102.7	-165.8	176.1	-88.1	-84.5	0	0	0	111.2	L166 N169 L171 L190 S191 L195 N217	L166-N193 PolarHBondContact O-ND2 3.05Å; N169-N193 WeakPolarHBondContact CA-OD1 3.2Å; N169-N193 WeakPolarHBondContact CB-OD1 3.23Å; N169-N193 PolarHBondContact O-OD1 3.26Å; L171-N193 HydrophobicContact CB-CB 4.35Å; L171-N193 VanDerWaalsContact CB-OD1 3.26Å; L171-N193 WeakPolarHBondContact CB-OD1 3.43Å; L171-N193 VanDerWaalsContact CG-OD1 3.28Å; L171-N193 WeakPolarHBondContact CG-OD1 3.44Å; L171-N193 PolarHBondContact N-OD1 3.18Å; L171-N193 VanDerWaalsContact N-OD1 3.1Å; L190-N193 PolarHBondContact O-ND2 3.1Å; L190-N193 VanDerWaalsContact O-ND2 3.08Å; S191-N193 VanDerWaalsContact C-N 3.26Å; S191-N193 PolarHBondContact O-N 3.13Å; S191-N193 PolarHBondContact O-ND2 3.15Å; S191-N193 VanDerWaalsContact O-ND2 3.16Å; N193-L195 HydrophobicContact CB-CG 4.22Å; N193-N217 VanDerWaalsContact CA-OD1 3.31Å; N193-N217 WeakPolarHBondContact CA-OD1 3.29Å; N193-N217 WeakPolarHBondContact CB-OD1 3.39Å; N193-N217 PolarHBondContact O-OD1 3.42Å
194	R	97.7	Very high	94.7	Very high	118 Å²	118	41.5 Å²	41.5	45%	0.445	20%	0.196	S	C	.	.			trans	-117.5	26.2	-179.6	-59.5	-176.8	178.5	-171.9	0.9	112.1	L171 R196 N217	L171-R194 CarbonylContact O-C 3.46Å; L171-R194 VanDerWaalsContact O-CA 3.23Å; L171-R194 WeakPolarHBondContact O-CA 3.36Å; L171-R194 WeakPolarHBondContact O-CB 3.38Å; L171-R194 PolarHBondContact O-N 2.92Å; R194-R196 PolarHBondContact O-N 3.45Å; R194-N217 PolarHBondContact N-OD1 3.13Å
195	L	96.8	Very high	94.4	Very high	1 Å²	1	39.5 Å²	39.5	1%	0.005	19%	0.188	C	C	.	.			trans	-64.1	121.1	-176.4	-59.5	174.9	0	0	0	110.3	L171 T173 T174 L190 N193 L214 N217 Q218 L219	L171-L195 HydrophobicContact CB-CD2 4.15Å; L171-L195 PolarHBondContact O-N 2.84Å; L171-L195 VanDerWaalsContact O-N 3.13Å; T173-L195 WeakPolarHBondContact O-CD2 3.45Å; T174-L195 HydrophobicContact CG2-CD1 4.38Å; T174-L195 HydrophobicContact CG2-CD2 4.42Å; L190-L195 HydrophobicContact CB-CD1 4.37Å; N193-L195 HydrophobicContact CB-CG 4.22Å; L195-L214 HydrophobicContact CD1-CD2 3.73Å; L195-N217 HydrophobicContact CB-CB 4.24Å; L195-N217 VanDerWaalsContact CB-OD1 3.23Å; L195-N217 WeakPolarHBondContact CB-OD1 3.23Å; L195-N217 VanDerWaalsContact CG-OD1 3.23Å; L195-N217 WeakPolarHBondContact CG-OD1 3.23Å; L195-N217 PolarHBondContact N-OD1 2.75Å; L195-Q218 CarbonylContact O-C 3.19Å; L195-Q218 VanDerWaalsContact O-CA 3.23Å; L195-Q218 WeakPolarHBondContact O-CA 3.47Å; L195-Q218 WeakPolarHBondContact O-CB 3.27Å; L195-Q218 PolarHBondContact O-N 3.15Å; L195-L219 HydrophobicContact CB-CD2 4.04Å; L195-L219 WeakPolarHBondContact O-CD2 3.3Å; L195-L219 PolarHBondContact O-N 3.15Å; L195-L219 VanDerWaalsContact O-N 3.16Å
196	R	95.3	Very high	94.3	Very high	164 Å²	164	39.5 Å²	39.5	62%	0.619	19%	0.188	S	C	*	.			trans	-95.2	-24.3	179.7	-67.1	179.9	174.7	-178.2	-2.9	113.9	R172 R194 Q218	R172-R196 PolarHBondContact O-N 3.31Å; R194-R196 PolarHBondContact O-N 3.45Å; R196-Q218 HydrophobicContact CG-CB 4.09Å
197	S	93.1	Very high	94.1	Very high	71 Å²	71	40.5 Å²	40.5	50%	0.497	20%	0.195	S	C	.	.			trans	-155.7	161.3	179	57.1	0	0	0	0	110.6
198	L	92.8	Very high	94.1	Very high	13 Å²	13	42.7 Å²	42.7	7%	0.068	21%	0.205	C	C	.	.			trans	-107	130.1	175	-52.5	176.8	0	0	0	109.1	T174 F203 L214 L219 I222 H226 F227	T174-L198 HydrophobicContact CG2-CD2 3.59Å; L198-F203 HydrophobicContact CB-CE2 4.48Å; L198-F203 HydrophobicContact CD1-CE2 4.32Å; L198-F203 HydrophobicContact CD2-CE2 4.23Å; L198-F203 HydrophobicContact CD2-CZ 4.19Å; L198-L214 HydrophobicContact CD1-CD1 3.97Å; L198-L214 HydrophobicContact CD2-CD1 4.06Å; L198-L214 HydrophobicContact CD2-CD2 4.15Å; L198-L219 HydrophobicContact CD1-CD1 4.38Å; L198-L219 HydrophobicContact CD2-CD1 4.05Å; L198-L219 HydrophobicContact CD2-CD2 3.79Å; L198-L219 HydrophobicContact CG-CD1 4.28Å; L198-L219 HydrophobicContact CG-CD2 3.97Å; L198-I222 HydrophobicContact CD1-CD1 3.82Å; L198-H226 PolarHBondContact O-CE1 3.39Å; L198-H226 VanDerWaalsContact O-CE1 3.29Å; L198-H226 PolarHBondContact O-ND1 3.14Å; L198-H226 VanDerWaalsContact O-ND1 3.14Å; L198-F227 HydrophobicContact CD1-CE1 4.01Å; L198-F227 HydrophobicContact CD1-CZ 3.58Å
199	A	90.4	Very high	94.1	Very high	31 Å²	31	42.7 Å²	42.7	26%	0.256	21%	0.205	S	C	.	.			trans	-73.4	140.3	175.9	0	0	0	0	0	111.3	T174 V176 N201 G202	T174-A199 WeakPolarHBondContact OG1-CB 3.33Å; T174-A199 PolarHBondContact OG1-N 3.3Å; V176-A199 HydrophobicContact CG2-CB 4.09Å; A199-N201 PolarHBondContact O-N 2.83Å; A199-G202 PolarHBondContact O-N 2.93Å
200	R	85.3	Confident	94.1	Very high	173 Å²	173	46 Å²	46	65%	0.653	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.7	-25.3	-175.6	-173	175.6	-176	-177.1	3.6	115.2
201	N	84	Confident	94.1	Very high	78 Å²	78	49.1 Å²	49.1	42%	0.417	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-123.7	20.7	174.6	-70.1	-61.9	0	0	0	112.5	A199 F203 A204	A199-N201 PolarHBondContact O-N 2.83Å; N201-F203 VanDerWaalsContact C-N 3.28Å; N201-F203 PolarHBondContact O-N 3.43Å; N201-A204 HydrophobicContact CB-CB 4.4Å; N201-A204 WeakPolarHBondContact O-CB 3.49Å; N201-A204 PolarHBondContact O-N 2.69Å
202	G	88.9	Confident	94.2	Very high	1 Å²	1	49.1 Å²	49.1	1%	0.01	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-36.6	-177.1	0	0	0	0	0	113	A199	A199-G202 PolarHBondContact O-N 2.93Å
203	F	91.8	Very high	94.2	Very high	4 Å²	4	48.4 Å²	48.4	2%	0.018	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.3	20.4	179.6	-53.9	-68.3	0	0	0	113.7	T174 L188 L190 L198 N201 G205 L206 L212 L214 F227 L230	T174-F203 HydrophobicContact CG2-CZ 4.01Å; L188-F203 HydrophobicContact CD2-CD1 4.1Å; L188-F203 HydrophobicContact CD2-CE1 4.08Å; L190-F203 HydrophobicContact CD1-CE1 3.87Å; L190-F203 HydrophobicContact CD1-CZ 4.44Å; L198-F203 HydrophobicContact CB-CE2 4.48Å; L198-F203 HydrophobicContact CD1-CE2 4.32Å; L198-F203 HydrophobicContact CD2-CE2 4.23Å; L198-F203 HydrophobicContact CD2-CZ 4.19Å; N201-F203 VanDerWaalsContact C-N 3.28Å; N201-F203 PolarHBondContact O-N 3.43Å; F203-G205 PolarHBondContact O-N 2.76Å; F203-L206 HydrophobicContact CB-CD1 4.14Å; F203-L206 HydrophobicContact CD1-CD1 4.01Å; F203-L206 PolarHBondContact O-N 3.05Å; F203-L212 HydrophobicContact CE1-CD1 4.03Å; F203-L212 HydrophobicContact CE1-CD2 4.29Å; F203-L212 HydrophobicContact CE2-CD2 4.33Å; F203-L212 HydrophobicContact CZ-CD1 4.41Å; F203-L212 HydrophobicContact CZ-CD2 4.19Å; F203-L214 HydrophobicContact CZ-CD1 4.19Å; F203-L214 HydrophobicContact CZ-CD2 4.31Å; F203-F227 HydrophobicContact CD2-CD1 4.13Å; F203-F227 AromaticContact CD2-CE1 3.98Å; F203-F227 HydrophobicContact CD2-CE1 3.98Å; F203-F227 HydrophobicContact CE2-CD1 4.45Å; F203-F227 AromaticContact CE2-CE1 3.84Å; F203-F227 HydrophobicContact CE2-CE1 3.84Å; F203-L230 HydrophobicContact CB-CD1 4.28Å; F203-L230 HydrophobicContact CB-CD2 3.98Å; F203-L230 HydrophobicContact CB-CG 4.3Å; F203-L230 HydrophobicContact CG-CD1 4.5Å
204	A	90.4	Very high	94.2	Very high	3 Å²	3	48.1 Å²	48.1	3%	0.025	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.5	133.8	175	0	0	0	0	0	110.9	F179 W180 N201	F179-A204 CarbonylContact C-O 3.44Å; W180-A204 WeakPolarHBondContact CA-O 3.32Å; W180-A204 HydrophobicContact CE3-CB 3.75Å; W180-A204 HydrophobicContact CZ3-CB 3.7Å; N201-A204 HydrophobicContact CB-CB 4.4Å; N201-A204 WeakPolarHBondContact O-CB 3.49Å; N201-A204 PolarHBondContact O-N 2.69Å
205	G	90.9	Very high	94.2	Very high	13 Å²	13	43 Å²	43	13%	0.134	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	108	-27.6	-175.6	0	0	0	0	0	113.7	W180 F203 I207	W180-G205 WeakPolarHBondContact O-CA 3.26Å; F203-G205 PolarHBondContact O-N 2.76Å; G205-I207 PolarHBondContact O-N 3.4Å
206	L	96.2	Very high	94.3	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	23%	0.225	C	C	.	.			trans	-80.5	52	-171.4	-60.9	-174.9	0	0	0	114.1	F179 C182 L185 L188 F203 K208 L209 L230	F179-L206 HydrophobicContact CB-CD1 4.02Å; F179-L206 HydrophobicContact CB-CD2 3.85Å; F179-L206 HydrophobicContact CB-CG 3.89Å; F179-L206 HydrophobicContact CD2-CD1 4.34Å; F179-L206 HydrophobicContact CG-CD1 4.2Å; C182-L206 HydrophobicContact CB-CD2 3.85Å; L185-L206 HydrophobicContact CB-CD2 3.88Å; L185-L206 HydrophobicContact CD2-CD1 4.47Å; L185-L206 HydrophobicContact CD2-CD2 3.59Å; L185-L206 HydrophobicContact CG-CD2 4.37Å; L188-L206 HydrophobicContact CD2-CD1 3.64Å; F203-L206 HydrophobicContact CB-CD1 4.14Å; F203-L206 HydrophobicContact CD1-CD1 4.01Å; F203-L206 PolarHBondContact O-N 3.05Å; L206-K208 VanDerWaalsContact C-N 3.29Å; L206-K208 PolarHBondContact O-N 2.79Å; L206-L209 HydrophobicContact CB-CB 4.09Å; L206-L209 HydrophobicContact CB-CD2 4.36Å; L206-L209 HydrophobicContact CD1-CD2 4.07Å; L206-L209 WeakPolarHBondContact O-CB 3.41Å; L206-L209 PolarHBondContact O-N 2.97Å; L206-L230 HydrophobicContact CB-CD2 3.69Å; L206-L230 WeakPolarHBondContact O-CD2 3.29Å
207	I	95.6	Very high	94.4	Very high	88 Å²	88	39.7 Å²	39.7	45%	0.451	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-18	-171.8	60.6	172.7	0	0	0	115.1	R183 G205 A232	R183-I207 HydrophobicContact CB-CD1 4.33Å; R183-I207 HydrophobicContact CB-CG1 4.32Å; G205-I207 PolarHBondContact O-N 3.4Å; I207-A232 WeakPolarHBondContact O-CB 3.34Å
208	K	97.9	Very high	94.7	Very high	92 Å²	92	39.5 Å²	39.5	40%	0.4	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106.4	4.2	177.3	-77.3	-162.7	-177.3	173.6	0	114.2	N184 L185 L206 K210	N184-K208 WeakPolarHBondContact OD1-CE 3.37Å; N184-K208 PolarHBondContact OD1-NZ 3.13Å; L185-K208 CarbonylContact O-C 3.54Å; L206-K208 VanDerWaalsContact C-N 3.29Å; L206-K208 PolarHBondContact O-N 2.79Å; K208-K210 PolarHBondContact O-N 3Å
209	L	98.4	Very high	94.9	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	19%	0.186	C	C	.	.			trans	-64.5	122.6	-175.1	-167.2	74.2	0	0	0	110.2	L185 L188 L206 L212 L230 A232 L233	L185-L209 HydrophobicContact CD2-CD1 4.09Å; L185-L209 HydrophobicContact CG-CD1 4.23Å; L185-L209 WeakPolarHBondContact O-CA 3.46Å; L185-L209 PolarHBondContact O-N 3.48Å; L188-L209 HydrophobicContact CB-CD1 3.69Å; L188-L209 HydrophobicContact CB-CD2 4.33Å; L206-L209 HydrophobicContact CB-CB 4.09Å; L206-L209 HydrophobicContact CB-CD2 4.36Å; L206-L209 HydrophobicContact CD1-CD2 4.07Å; L206-L209 WeakPolarHBondContact O-CB 3.41Å; L206-L209 PolarHBondContact O-N 2.97Å; L209-L212 HydrophobicContact CD2-CB 4.03Å; L209-L212 HydrophobicContact CD2-CD1 4.34Å; L209-L212 HydrophobicContact CD2-CD2 4.44Å; L209-L212 HydrophobicContact CD2-CG 4.5Å; L209-L230 HydrophobicContact CB-CD2 4.2Å; L209-L230 HydrophobicContact CD2-CD1 4.3Å; L209-L230 HydrophobicContact CD2-CD2 3.86Å; L209-A232 CarbonylContact O-C 3.56Å; L209-L233 HydrophobicContact CB-CD1 4.32Å; L209-L233 HydrophobicContact CD2-CD1 3.91Å; L209-L233 HydrophobicContact CG-CD1 3.85Å; L209-L233 WeakPolarHBondContact O-CA 3.3Å; L209-L233 PolarHBondContact O-N 3.05Å
210	K	98.4	Very high	95.2	Very high	70 Å²	70	40.6 Å²	40.6	30%	0.304	19%	0.193	S	C	.	.			trans	-99.6	-37.9	178	-61.3	172.6	-170.9	162.9	0	111.2	E186 K208 L233 Q234 F235	E186-K210 HydrophobicContact CB-CD 4.33Å; E186-K210 VanDerWaalsContact CD-CE 3.47Å; E186-K210 PolarHBondContact O-N 3.05Å; E186-K210 WeakPolarHBondContact OE1-CE 3.03Å; E186-K210 IonicContact OE1-NZ 2.89Å; E186-K210 PolarHBondContact OE1-NZ 3.48Å; E186-K210 WeakPolarHBondContact OE2-CE 3.22Å; E186-K210 IonicContact OE2-NZ 2.64Å; E186-K210 PolarHBondContact OE2-NZ 3Å; K208-K210 PolarHBondContact O-N 3Å; K210-L233 WeakPolarHBondContact O-CD1 3.47Å; K210-Q234 PolarHBondContact O-N 2.92Å; K210-F235 PolarHBondContact O-N 3.32Å
211	E	98.7	Very high	95.7	Very high	67 Å²	67	39 Å²	39	31%	0.313	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	125.1	-175	-61.2	-171.5	-164.4	0	0	111.7	E186 Y187 L188 H213 F235	E186-E211 PolarHBondContact O-N 3.12Å; Y187-E211 HydrophobicContact CD2-CB 3.78Å; Y187-E211 HydrophobicContact CD2-CG 4.48Å; Y187-E211 WeakPolarHBondContact CD2-OE2 3.3Å; Y187-E211 HydrophobicContact CE2-CB 4.28Å; Y187-E211 WeakPolarHBondContact CE2-OE2 3.28Å; L188-E211 PolarHBondContact N-O 3.01Å; E211-H213 IonicContact OE2-NE2 2.64Å; E211-F235 HydrophobicContact CG-CB 4.18Å; E211-F235 HydrophobicContact CG-CD2 3.8Å; E211-F235 HydrophobicContact CG-CG 4.32Å
212	L	98.4	Very high	96.2	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	112.9	177.1	178.3	54.1	0	0	0	110.6	L188 F203 L209 L214 F227 L230 L233 F235 L236 Y237	L188-L212 HydrophobicContact CB-CD1 4.14Å; L188-L212 HydrophobicContact CD2-CD1 4.02Å; L188-L212 HydrophobicContact CG-CD1 4.09Å; F203-L212 HydrophobicContact CE1-CD1 4.03Å; F203-L212 HydrophobicContact CE1-CD2 4.29Å; F203-L212 HydrophobicContact CE2-CD2 4.33Å; F203-L212 HydrophobicContact CZ-CD1 4.41Å; F203-L212 HydrophobicContact CZ-CD2 4.19Å; L209-L212 HydrophobicContact CD2-CB 4.03Å; L209-L212 HydrophobicContact CD2-CD1 4.34Å; L209-L212 HydrophobicContact CD2-CD2 4.44Å; L209-L212 HydrophobicContact CD2-CG 4.5Å; L212-L214 HydrophobicContact CD1-CD1 4.36Å; L212-L214 HydrophobicContact CD1-CG 4.13Å; L212-L214 HydrophobicContact CD2-CD1 3.98Å; L212-L214 HydrophobicContact CG-CD1 3.99Å; L212-L214 HydrophobicContact CG-CG 4.11Å; L212-F227 HydrophobicContact CD2-CE1 4.15Å; L212-L230 HydrophobicContact CD2-CD1 3.79Å; L212-L233 HydrophobicContact CB-CD1 3.76Å; L212-L233 HydrophobicContact CB-CD2 4.17Å; L212-F235 PolarHBondContact N-O 2.77Å; L212-L236 HydrophobicContact CB-CD1 4.14Å; L212-L236 HydrophobicContact CD2-CD1 4.01Å; L212-L236 HydrophobicContact CG-CD1 4.05Å; L212-Y237 PolarHBondContact O-N 2.85Å
213	H	98.6	Very high	96.5	Very high	23 Å²	23	37.5 Å²	37.5	11%	0.106	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	110.3	179.6	-79.3	-96.2	0	0	0	111.5	Y187 L188 L190 S191 E211 E215 Y237	Y187-H213 AromaticContact CE2-CD2 3.39Å; Y187-H213 WeakPolarHBondContact CE2-CD2 3.27Å; Y187-H213 AromaticContact CE2-NE2 3.42Å; Y187-H213 WeakPolarHBondContact CE2-NE2 3.49Å; Y187-H213 AromaticContact CZ-CD2 3.42Å; Y187-H213 VanDerWaalsContact CZ-CD2 3.42Å; Y187-H213 AromaticContact CZ-NE2 3.73Å; Y187-H213 PolarHBondContact OH-CD2 3.34Å; Y187-H213 PolarHBondContact OH-NE2 2.97Å; L188-H213 PolarHBondContact O-N 2.89Å; L190-H213 CarbonylContact C-O 3.59Å; L190-H213 VanDerWaalsContact C-O 3.28Å; L190-H213 VanDerWaalsContact CA-O 3.23Å; L190-H213 WeakPolarHBondContact CA-O 3.31Å; L190-H213 VanDerWaalsContact CB-O 3.29Å; L190-H213 WeakPolarHBondContact CB-O 3.38Å; L190-H213 PolarHBondContact N-O 2.87Å; S191-H213 PolarHBondContact N-O 3.35Å; E211-H213 IonicContact OE2-NE2 2.64Å; H213-E215 VanDerWaalsContact CA-OE2 3.3Å; H213-E215 WeakPolarHBondContact CA-OE2 3.39Å; H213-E215 VanDerWaalsContact CB-OE2 3.24Å; H213-E215 WeakPolarHBondContact CB-OE2 3.16Å; H213-E215 IonicContact CE1-OE1 3.56Å; H213-E215 IonicContact CG-OE1 2.94Å; H213-E215 IonicContact CG-OE2 3.07Å; H213-E215 VanDerWaalsContact ND1-CD 3.34Å; H213-E215 IonicContact ND1-OE1 3.93Å; H213-E215 PolarHBondContact ND1-OE1 2.96Å; H213-E215 IonicContact ND1-OE2 2.81Å; H213-E215 PolarHBondContact ND1-OE2 3.02Å; H213-Y237 AromaticContact CD2-CD2 3.86Å; H213-Y237 AromaticContact CE1-CD2 3.41Å; H213-Y237 VanDerWaalsContact CE1-CD2 3.41Å; H213-Y237 WeakPolarHBondContact CE1-CD2 3.44Å; H213-Y237 AromaticContact CE1-CE2 3.63Å; H213-Y237 AromaticContact CE1-CG 3.95Å; H213-Y237 AromaticContact CG-CD2 3.99Å; H213-Y237 AromaticContact ND1-CD2 3.72Å; H213-Y237 AromaticContact NE2-CD2 3.52Å; H213-Y237 AromaticContact NE2-CE2 3.56Å
214	L	98.1	Very high	96.5	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	18%	0.183	C	C	.	.			trans	-124	12.1	176.9	-70.8	168.4	0	0	0	111.9	L190 L195 L198 F203 L212 N217 L219 L236 Y237 L238 N241	L190-L214 HydrophobicContact CB-CD2 3.86Å; L190-L214 HydrophobicContact CD1-CD2 4.13Å; L195-L214 HydrophobicContact CD1-CD2 3.73Å; L198-L214 HydrophobicContact CD1-CD1 3.97Å; L198-L214 HydrophobicContact CD2-CD1 4.06Å; L198-L214 HydrophobicContact CD2-CD2 4.15Å; F203-L214 HydrophobicContact CZ-CD1 4.19Å; F203-L214 HydrophobicContact CZ-CD2 4.31Å; L212-L214 HydrophobicContact CD1-CD1 4.36Å; L212-L214 HydrophobicContact CD1-CG 4.13Å; L212-L214 HydrophobicContact CD2-CD1 3.98Å; L212-L214 HydrophobicContact CG-CD1 3.99Å; L212-L214 HydrophobicContact CG-CG 4.11Å; L214-N217 WeakPolarHBondContact O-CB 3.29Å; L214-N217 PolarHBondContact O-ND2 3.18Å; L214-L219 HydrophobicContact CB-CD1 4.28Å; L214-L236 HydrophobicContact CD1-CD1 4.46Å; L214-Y237 CarbonylContact C-O 3.56Å; L214-Y237 WeakPolarHBondContact CA-O 3.49Å; L214-Y237 WeakPolarHBondContact CB-O 3.49Å; L214-Y237 PolarHBondContact N-O 3.46Å; L214-L238 HydrophobicContact CB-CD2 3.78Å; L214-L238 HydrophobicContact CD1-CD2 4.01Å; L214-N241 PolarHBondContact O-ND2 2.89Å
215	E	98.4	Very high	96.5	Very high	10 Å²	10	37.6 Å²	37.6	5%	0.047	18%	0.183	C	C	.	.			trans	-64.8	158.4	-179	72.5	-82.1	-176.1	0	0	113.8	R167 S191 S192 H213 N217 Y237 Q239	R167-E215 IonicContact NH1-OE1 3.27Å; R167-E215 PolarHBondContact NH1-OE1 3.03Å; S191-E215 CarbonylContact C-O 3.01Å; S191-E215 VanDerWaalsContact CA-O 3.23Å; S191-E215 WeakPolarHBondContact CA-O 3.36Å; S191-E215 WeakPolarHBondContact CB-O 3.15Å; S191-E215 WeakPolarHBondContact CB-OE1 3.33Å; S191-E215 WeakPolarHBondContact CB-OE2 3.32Å; S191-E215 PolarHBondContact OG-OE1 2.94Å; S192-E215 PolarHBondContact N-O 2.65Å; H213-E215 VanDerWaalsContact CA-OE2 3.3Å; H213-E215 WeakPolarHBondContact CA-OE2 3.39Å; H213-E215 VanDerWaalsContact CB-OE2 3.24Å; H213-E215 WeakPolarHBondContact CB-OE2 3.16Å; H213-E215 IonicContact CE1-OE1 3.56Å; H213-E215 IonicContact CG-OE1 2.94Å; H213-E215 IonicContact CG-OE2 3.07Å; H213-E215 VanDerWaalsContact ND1-CD 3.34Å; H213-E215 IonicContact ND1-OE1 3.93Å; H213-E215 PolarHBondContact ND1-OE1 2.96Å; H213-E215 IonicContact ND1-OE2 2.81Å; H213-E215 PolarHBondContact ND1-OE2 3.02Å; E215-N217 VanDerWaalsContact C-N 3.29Å; E215-N217 PolarHBondContact O-N 3.14Å; E215-N217 PolarHBondContact O-ND2 3.04Å; E215-Y237 PolarHBondContact N-O 3.19Å; E215-Y237 WeakPolarHBondContact OE2-CB 3.46Å; E215-Q239 CarbonylContact C-O 3.51Å; E215-Q239 WeakPolarHBondContact CA-O 3.5Å; E215-Q239 HydrophobicContact CB-CG 3.74Å; E215-Q239 VanDerWaalsContact CB-O 3.28Å; E215-Q239 WeakPolarHBondContact CB-O 3.46Å; E215-Q239 HydrophobicContact CG-CG 4.47Å
216	H	98.4	Very high	96.5	Very high	88 Å²	88	39.2 Å²	39.2	41%	0.407	19%	0.187	S	C	.	.	S	Bend	trans	54.4	38.9	-178.5	-61.9	-75.7	0	0	0	114.3	S192 Q239 W240	S192-H216 WeakPolarHBondContact CA-O 3.35Å; H216-Q239 PolarHBondContact N-O 3.45Å; H216-W240 WeakPolarHBondContact CA-O 3.24Å; H216-W240 AromaticContact CE1-CD1 3.24Å; H216-W240 AromaticContact CE1-CG 3.41Å; H216-W240 VanDerWaalsContact CE1-CG 3.41Å; H216-W240 VanDerWaalsContact ND1-CB 3.31Å; H216-W240 WeakPolarHBondContact ND1-CB 3.39Å; H216-W240 AromaticContact ND1-CD1 3.98Å; H216-W240 AromaticContact ND1-CG 3.76Å; H216-W240 AromaticContact NE2-CD1 3.55Å
217	N	98.5	Very high	96.3	Very high	8 Å²	8	39.2 Å²	39.2	4%	0.043	19%	0.188	C	C	.	.	S	Bend	trans	-107.1	-163.7	175.4	-88.5	-82	0	0	0	111.4	L190 N193 R194 L195 L214 E215 L219 N241	L190-N217 PolarHBondContact O-ND2 3.31Å; N193-N217 VanDerWaalsContact CA-OD1 3.31Å; N193-N217 WeakPolarHBondContact CA-OD1 3.29Å; N193-N217 WeakPolarHBondContact CB-OD1 3.39Å; N193-N217 PolarHBondContact O-OD1 3.42Å; R194-N217 PolarHBondContact N-OD1 3.13Å; L195-N217 HydrophobicContact CB-CB 4.24Å; L195-N217 VanDerWaalsContact CB-OD1 3.23Å; L195-N217 WeakPolarHBondContact CB-OD1 3.23Å; L195-N217 VanDerWaalsContact CG-OD1 3.23Å; L195-N217 WeakPolarHBondContact CG-OD1 3.23Å; L195-N217 PolarHBondContact N-OD1 2.75Å; L214-N217 WeakPolarHBondContact O-CB 3.29Å; L214-N217 PolarHBondContact O-ND2 3.18Å; E215-N217 VanDerWaalsContact C-N 3.29Å; E215-N217 PolarHBondContact O-N 3.14Å; E215-N217 PolarHBondContact O-ND2 3.04Å; N217-L219 HydrophobicContact CB-CG 4.27Å; N217-N241 VanDerWaalsContact CA-OD1 3.27Å; N217-N241 WeakPolarHBondContact CA-OD1 3.34Å; N217-N241 WeakPolarHBondContact CB-OD1 3.4Å; N217-N241 PolarHBondContact N-OD1 2.89Å; N217-N241 PolarHBondContact O-OD1 3.36Å
218	Q	97.9	Very high	96.1	Very high	68 Å²	68	37.6 Å²	37.6	32%	0.318	18%	0.183	S	C	.	.			trans	-118	24.1	-178.1	-56.8	-175.5	4.7	0	0	112.1	L195 R196 T220 N241	L195-Q218 CarbonylContact O-C 3.19Å; L195-Q218 VanDerWaalsContact O-CA 3.23Å; L195-Q218 WeakPolarHBondContact O-CA 3.47Å; L195-Q218 WeakPolarHBondContact O-CB 3.27Å; L195-Q218 PolarHBondContact O-N 3.15Å; R196-Q218 HydrophobicContact CG-CB 4.09Å; Q218-T220 PolarHBondContact O-N 2.83Å; Q218-N241 PolarHBondContact N-OD1 2.94Å
219	L	97.7	Very high	95.8	Very high	0 Å²	0	39 Å²	39	0%	0	19%	0.185	C	C	.	.			trans	-67.1	127.9	-176.3	-57.9	174	0	0	0	110	L195 L198 L214 N217 I222 L238 N241 K242 I243	L195-L219 HydrophobicContact CB-CD2 4.04Å; L195-L219 WeakPolarHBondContact O-CD2 3.3Å; L195-L219 PolarHBondContact O-N 3.15Å; L195-L219 VanDerWaalsContact O-N 3.16Å; L198-L219 HydrophobicContact CD1-CD1 4.38Å; L198-L219 HydrophobicContact CD2-CD1 4.05Å; L198-L219 HydrophobicContact CD2-CD2 3.79Å; L198-L219 HydrophobicContact CG-CD1 4.28Å; L198-L219 HydrophobicContact CG-CD2 3.97Å; L214-L219 HydrophobicContact CB-CD1 4.28Å; N217-L219 HydrophobicContact CB-CG 4.27Å; L219-I222 HydrophobicContact CD1-CD1 4.07Å; L219-L238 HydrophobicContact CD1-CD2 3.83Å; L219-N241 HydrophobicContact CB-CB 4.26Å; L219-N241 VanDerWaalsContact CB-OD1 3.28Å; L219-N241 WeakPolarHBondContact CB-OD1 3.32Å; L219-N241 VanDerWaalsContact CG-OD1 3.3Å; L219-N241 WeakPolarHBondContact CG-OD1 3.34Å; L219-N241 PolarHBondContact N-OD1 3.42Å; L219-K242 CarbonylContact O-C 3.45Å; L219-K242 VanDerWaalsContact O-CA 3.3Å; L219-K242 WeakPolarHBondContact O-CA 3.33Å; L219-K242 PolarHBondContact O-N 3.31Å; L219-I243 HydrophobicContact CB-CG1 4.27Å; L219-I243 PolarHBondContact O-N 3Å; L219-I243 VanDerWaalsContact O-N 3.11Å
220	T	96.6	Very high	95.6	Very high	67 Å²	67	39 Å²	39	41%	0.411	19%	0.186	S	C	.	.			trans	-102.8	-23.2	-176.4	51	0	0	0	0	114.3	Q218 K242 I243 N244	Q218-T220 PolarHBondContact O-N 2.83Å; T220-K242 WeakPolarHBondContact CA-O 3.29Å; T220-K242 HydrophobicContact CG2-CB 4.3Å; T220-I243 WeakPolarHBondContact O-CA 3.3Å; T220-N244 PolarHBondContact O-N 2.92Å; T220-N244 PolarHBondContact O-OD1 3.22Å
221	K	95.3	Very high	95.4	Very high	139 Å²	139	40 Å²	40	60%	0.604	20%	0.197	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-145.9	147.2	177.8	-62.4	-174.3	-179.6	-175.7	0	109.6	N245	K221-N245 WeakPolarHBondContact CA-O 3.49Å
222	I	95.6	Very high	95.4	Very high	6 Å²	6	38.2 Å²	38.2	3%	0.031	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	133.2	170.5	-62.8	-64.9	0	0	0	108.8	L198 L219 L224 F227 L238 I243 N245 V246 T247	L198-I222 HydrophobicContact CD1-CD1 3.82Å; L219-I222 HydrophobicContact CD1-CD1 4.07Å; I222-L224 HydrophobicContact CG2-CD2 4.28Å; I222-F227 HydrophobicContact CG2-CE2 4Å; I222-L238 HydrophobicContact CD1-CD1 4.27Å; I222-L238 HydrophobicContact CD1-CD2 3.81Å; I222-L238 HydrophobicContact CG1-CD1 4.14Å; I222-L238 HydrophobicContact CG1-CD2 4.4Å; I222-I243 HydrophobicContact CD1-CD1 4.19Å; I222-I243 HydrophobicContact CG1-CD1 3.58Å; I222-I243 HydrophobicContact CG1-CG1 3.95Å; I222-I243 HydrophobicContact CG1-CG2 4.15Å; I222-N245 PolarHBondContact N-O 3.03Å; I222-N245 VanDerWaalsContact N-O 3.15Å; I222-V246 HydrophobicContact CB-CG1 4.34Å; I222-V246 HydrophobicContact CB-CG2 4.47Å; I222-V246 HydrophobicContact CG2-CG1 4.33Å; I222-V246 CarbonylContact O-C 3.51Å; I222-V246 WeakPolarHBondContact O-CA 3.4Å; I222-T247 PolarHBondContact O-N 2.81Å
223	N	94.3	Very high	95.4	Very high	42 Å²	42	38.2 Å²	38.2	23%	0.225	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	118	169.3	-179.4	-3.6	0	0	0	107.6	A225 H226 T247 G249	N223-A225 PolarHBondContact O-N 3.29Å; N223-A225 VanDerWaalsContact O-N 3.15Å; N223-A225 VanDerWaalsContact OD1-CB 3.23Å; N223-A225 WeakPolarHBondContact OD1-CB 3.05Å; N223-A225 PolarHBondContact OD1-N 2.9Å; N223-H226 WeakPolarHBondContact O-CB 3.28Å; N223-H226 PolarHBondContact O-N 3.2Å; N223-H226 VanDerWaalsContact O-N 3.1Å; N223-T247 CarbonylContact C-O 3.09Å; N223-T247 VanDerWaalsContact CA-O 3.31Å; N223-T247 WeakPolarHBondContact CA-O 3.49Å; N223-T247 PolarHBondContact OD1-O 3.18Å; N223-G249 PolarHBondContact OD1-N 3.17Å
224	L	93.1	Very high	95.4	Very high	3 Å²	3	40.4 Å²	40.4	2%	0.016	20%	0.204	C	C	.	.	G	3₁₀ helix	trans	-60.6	-25.4	-178.8	-63.1	-171.2	0	0	0	112.2	I222 H226 F227 T247 W252 W254 V274 T277 L278	I222-L224 HydrophobicContact CG2-CD2 4.28Å; L224-H226 PolarHBondContact O-N 3.33Å; L224-F227 HydrophobicContact CD2-CD2 4.39Å; L224-F227 PolarHBondContact O-N 2.88Å; L224-T247 PolarHBondContact N-O 2.95Å; L224-W252 HydrophobicContact CB-CZ2 4.12Å; L224-W252 WeakPolarHBondContact O-CZ2 3.35Å; L224-W254 HydrophobicContact CD2-CZ3 4.31Å; L224-V274 HydrophobicContact CD1-CG1 4.03Å; L224-T277 HydrophobicContact CD1-CG2 3.87Å; L224-L278 HydrophobicContact CD1-CD1 4.38Å; L224-L278 HydrophobicContact CD1-CD2 4.3Å; L224-L278 HydrophobicContact CD1-CG 4.31Å
225	A	90.5	Very high	95.4	Very high	5 Å²	5	42.7 Å²	42.7	4%	0.041	21%	0.214	C	C	.	.	G	3₁₀ helix	trans	-63	-0.7	174.5	0	0	0	0	0	115.2	N223 P228 M250	N223-A225 PolarHBondContact O-N 3.29Å; N223-A225 VanDerWaalsContact O-N 3.15Å; N223-A225 VanDerWaalsContact OD1-CB 3.23Å; N223-A225 WeakPolarHBondContact OD1-CB 3.05Å; N223-A225 PolarHBondContact OD1-N 2.9Å; A225-P228 WeakPolarHBondContact O-CD 3.11Å; A225-M250 HydrophobicContact CB-CB 4.49Å; A225-M250 HydrophobicContact CB-CE 4.02Å; A225-M250 HydrophobicContact CB-CG 3.81Å; A225-M250 HydrophobicContact CB-SD 3.62Å
226	H	90.6	Very high	95.4	Very high	47 Å²	47	42.2 Å²	42.2	22%	0.218	21%	0.212	C	C	.	.	G	3₁₀ helix	trans	-88.8	-10.7	170.5	-65.7	-172.8	0	0	0	113.5	L198 N223 L224 P228	L198-H226 PolarHBondContact O-CE1 3.39Å; L198-H226 VanDerWaalsContact O-CE1 3.29Å; L198-H226 PolarHBondContact O-ND1 3.14Å; L198-H226 VanDerWaalsContact O-ND1 3.14Å; N223-H226 WeakPolarHBondContact O-CB 3.28Å; N223-H226 PolarHBondContact O-N 3.2Å; N223-H226 VanDerWaalsContact O-N 3.1Å; L224-H226 PolarHBondContact O-N 3.33Å; H226-P228 VanDerWaalsContact C-CD 3.4Å
227	F	92.6	Very high	95.4	Very high	1 Å²	1	39.8 Å²	39.8	0%	0.004	20%	0.199	C	C	.	.			trans	-109.7	7.9	-174.9	-53.4	-64.7	0	0	0	118.2	L198 F203 L212 I222 L224 R229 L230 L236 W252 W254	L198-F227 HydrophobicContact CD1-CE1 4.01Å; L198-F227 HydrophobicContact CD1-CZ 3.58Å; F203-F227 HydrophobicContact CD2-CD1 4.13Å; F203-F227 AromaticContact CD2-CE1 3.98Å; F203-F227 HydrophobicContact CD2-CE1 3.98Å; F203-F227 HydrophobicContact CE2-CD1 4.45Å; F203-F227 AromaticContact CE2-CE1 3.84Å; F203-F227 HydrophobicContact CE2-CE1 3.84Å; L212-F227 HydrophobicContact CD2-CE1 4.15Å; I222-F227 HydrophobicContact CG2-CE2 4Å; L224-F227 HydrophobicContact CD2-CD2 4.39Å; L224-F227 PolarHBondContact O-N 2.88Å; F227-R229 PolarHBondContact O-N 2.99Å; F227-L230 HydrophobicContact CB-CD1 4.32Å; F227-L230 HydrophobicContact CD1-CD1 3.68Å; F227-L230 HydrophobicContact CE1-CD1 4.47Å; F227-L230 HydrophobicContact CG-CD1 4.4Å; F227-L230 WeakPolarHBondContact O-CB 3.3Å; F227-L230 PolarHBondContact O-N 2.86Å; F227-L236 HydrophobicContact CE2-CD2 4.22Å; F227-L236 HydrophobicContact CZ-CD2 4.41Å; F227-W252 HydrophobicContact CB-CH2 4.31Å; F227-W254 HydrophobicContact CB-CH2 3.3Å; F227-W254 HydrophobicContact CB-CZ2 3.86Å; F227-W254 HydrophobicContact CB-CZ3 3.7Å; F227-W254 HydrophobicContact CD1-CH2 4.32Å; F227-W254 AromaticContact CD2-CH2 3.7Å; F227-W254 HydrophobicContact CD2-CH2 3.7Å; F227-W254 AromaticContact CD2-CZ3 3.67Å; F227-W254 HydrophobicContact CD2-CZ3 3.67Å; F227-W254 AromaticContact CG-CH2 3.54Å; F227-W254 HydrophobicContact CG-CH2 3.54Å; F227-W254 HydrophobicContact CG-CZ2 4.46Å; F227-W254 AromaticContact CG-CZ3 3.94Å; F227-W254 HydrophobicContact CG-CZ3 3.94Å
228	P	90.3	Very high	95.4	Very high	53 Å²	53	39.5 Å²	39.5	34%	0.344	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-7.9	-172.5	31.3	-39.8	0	0	0	115.3	A225 H226 M250 W252	A225-P228 WeakPolarHBondContact O-CD 3.11Å; H226-P228 VanDerWaalsContact C-CD 3.4Å; P228-M250 HydrophobicContact CB-CE 3.68Å; P228-M250 HydrophobicContact CG-CE 3.76Å; P228-W252 HydrophobicContact CB-CD2 4.5Å; P228-W252 HydrophobicContact CB-CE3 4.1Å; P228-W252 HydrophobicContact CB-CZ3 4.15Å
229	R	91.1	Very high	95.4	Very high	121 Å²	121	37.4 Å²	37.4	46%	0.457	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.8	-13.6	173.7	-63.1	-178.7	-177.7	-114.1	-1.2	113.1	F227 V231	F227-R229 PolarHBondContact O-N 2.99Å; R229-V231 PolarHBondContact O-N 3.38Å; R229-V231 VanDerWaalsContact O-N 3.09Å
230	L	95.2	Very high	95.5	Very high	2 Å²	2	43.2 Å²	43.2	1%	0.01	21%	0.21	C	C	.	.			trans	-86.6	53	179.5	-62	-172.8	0	0	0	111	F203 L206 L209 L212 F227 A232 L233 W254	F203-L230 HydrophobicContact CB-CD1 4.28Å; F203-L230 HydrophobicContact CB-CD2 3.98Å; F203-L230 HydrophobicContact CB-CG 4.3Å; F203-L230 HydrophobicContact CG-CD1 4.5Å; L206-L230 HydrophobicContact CB-CD2 3.69Å; L206-L230 WeakPolarHBondContact O-CD2 3.29Å; L209-L230 HydrophobicContact CB-CD2 4.2Å; L209-L230 HydrophobicContact CD2-CD1 4.3Å; L209-L230 HydrophobicContact CD2-CD2 3.86Å; L212-L230 HydrophobicContact CD2-CD1 3.79Å; F227-L230 HydrophobicContact CB-CD1 4.32Å; F227-L230 HydrophobicContact CD1-CD1 3.68Å; F227-L230 HydrophobicContact CE1-CD1 4.47Å; F227-L230 HydrophobicContact CG-CD1 4.4Å; F227-L230 WeakPolarHBondContact O-CB 3.3Å; F227-L230 PolarHBondContact O-N 2.86Å; L230-A232 PolarHBondContact O-N 3.21Å; L230-A232 VanDerWaalsContact O-N 3.09Å; L230-L233 HydrophobicContact CB-CB 4.07Å; L230-L233 HydrophobicContact CD1-CD2 4.19Å; L230-L233 WeakPolarHBondContact O-CB 3.34Å; L230-L233 PolarHBondContact O-N 3.33Å; L230-W254 HydrophobicContact CB-CZ2 4.11Å; L230-W254 PolarHBondContact O-NE1 2.88Å
231	V	94.6	Very high	95.6	Very high	90 Å²	90	40.5 Å²	40.5	55%	0.545	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-19.4	-171.1	-63.4	0	0	0	0	114	R229 T256	R229-V231 PolarHBondContact O-N 3.38Å; R229-V231 VanDerWaalsContact O-N 3.09Å; V231-T256 WeakPolarHBondContact O-CB 3.36Å; V231-T256 VanDerWaalsContact O-CG2 3.25Å; V231-T256 WeakPolarHBondContact O-CG2 3.33Å; V231-T256 PolarHBondContact O-OG1 3.42Å
232	A	97.5	Very high	95.7	Very high	29 Å²	29	39.1 Å²	39.1	24%	0.24	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.6	1.3	178.7	0	0	0	0	0	114.5	I207 L209 L230 Q234	I207-A232 WeakPolarHBondContact O-CB 3.34Å; L209-A232 CarbonylContact O-C 3.56Å; L230-A232 PolarHBondContact O-N 3.21Å; L230-A232 VanDerWaalsContact O-N 3.09Å; A232-Q234 PolarHBondContact O-N 3.49Å
233	L	98.1	Very high	95.8	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	19%	0.186	C	C	.	.			trans	-72.3	127.1	-170.5	-161.6	80.2	0	0	0	111.9	L209 K210 L212 L230 L236 W254 T256 L257	L209-L233 HydrophobicContact CB-CD1 4.32Å; L209-L233 HydrophobicContact CD2-CD1 3.91Å; L209-L233 HydrophobicContact CG-CD1 3.85Å; L209-L233 WeakPolarHBondContact O-CA 3.3Å; L209-L233 PolarHBondContact O-N 3.05Å; K210-L233 WeakPolarHBondContact O-CD1 3.47Å; L212-L233 HydrophobicContact CB-CD1 3.76Å; L212-L233 HydrophobicContact CB-CD2 4.17Å; L230-L233 HydrophobicContact CB-CB 4.07Å; L230-L233 HydrophobicContact CD1-CD2 4.19Å; L230-L233 WeakPolarHBondContact O-CB 3.34Å; L230-L233 PolarHBondContact O-N 3.33Å; L233-L236 HydrophobicContact CD2-CB 4.02Å; L233-L236 HydrophobicContact CD2-CD1 4.36Å; L233-W254 HydrophobicContact CB-CZ2 3.77Å; L233-W254 HydrophobicContact CD2-CH2 3.82Å; L233-W254 HydrophobicContact CD2-CZ2 3.46Å; L233-W254 VanDerWaalsContact CD2-CZ2 3.46Å; L233-W254 HydrophobicContact CG-CZ2 4.22Å; L233-T256 CarbonylContact O-C 3.3Å; L233-T256 VanDerWaalsContact O-O 3.08Å; L233-L257 HydrophobicContact CD2-CD1 4.03Å; L233-L257 HydrophobicContact CG-CD1 4.29Å; L233-L257 VanDerWaalsContact O-CA 3.3Å; L233-L257 WeakPolarHBondContact O-CA 3.36Å; L233-L257 PolarHBondContact O-N 3.19Å
234	Q	98.4	Very high	96	Very high	69 Å²	69	40.4 Å²	40.4	32%	0.322	19%	0.194	S	C	.	.			trans	-109.5	-33.9	-179	-69.4	169.9	-14.6	0	0	111.9	K210 A232 T256 E258 K259	K210-Q234 PolarHBondContact O-N 2.92Å; A232-Q234 PolarHBondContact O-N 3.49Å; Q234-T256 WeakPolarHBondContact CA-O 3.47Å; Q234-E258 HydrophobicContact CB-CG 4.43Å; Q234-E258 PolarHBondContact O-N 2.91Å; Q234-K259 PolarHBondContact O-N 2.8Å
235	F	98.8	Very high	96	Very high	48 Å²	48	43 Å²	43	21%	0.211	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	119	-175.1	-50.9	-91.9	0	0	0	111	K210 E211 L212 Y237 K259	K210-F235 PolarHBondContact O-N 3.32Å; E211-F235 HydrophobicContact CG-CB 4.18Å; E211-F235 HydrophobicContact CG-CD2 3.8Å; E211-F235 HydrophobicContact CG-CG 4.32Å; L212-F235 PolarHBondContact N-O 2.77Å; F235-Y237 HydrophobicContact CB-CD2 4.49Å; F235-Y237 HydrophobicContact CB-CE2 3.76Å; F235-K259 HydrophobicContact CD1-CB 3.66Å; F235-K259 HydrophobicContact CD1-CD 4.15Å; F235-K259 HydrophobicContact CD1-CG 4.44Å; F235-K259 HydrophobicContact CE1-CB 4.28Å
236	L	98.6	Very high	96.2	Very high	1 Å²	1	43 Å²	43	1%	0.005	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	113.7	176.2	179.9	54.7	0	0	0	110.7	L212 L214 F227 L233 L238 W254 L257 K259 L260 D261	L212-L236 HydrophobicContact CB-CD1 4.14Å; L212-L236 HydrophobicContact CD2-CD1 4.01Å; L212-L236 HydrophobicContact CG-CD1 4.05Å; L214-L236 HydrophobicContact CD1-CD1 4.46Å; F227-L236 HydrophobicContact CE2-CD2 4.22Å; F227-L236 HydrophobicContact CZ-CD2 4.41Å; L233-L236 HydrophobicContact CD2-CB 4.02Å; L233-L236 HydrophobicContact CD2-CD1 4.36Å; L236-L238 HydrophobicContact CD1-CD1 4.25Å; L236-L238 HydrophobicContact CD1-CG 4.15Å; L236-L238 HydrophobicContact CD2-CD1 3.89Å; L236-L238 HydrophobicContact CG-CD1 3.84Å; L236-L238 HydrophobicContact CG-CG 4.11Å; L236-W254 HydrophobicContact CD2-CH2 4.04Å; L236-W254 HydrophobicContact CD2-CZ3 4.24Å; L236-L257 HydrophobicContact CB-CD1 3.88Å; L236-K259 PolarHBondContact N-O 3.31Å; L236-L260 HydrophobicContact CB-CD1 4.31Å; L236-L260 HydrophobicContact CD2-CD1 4.05Å; L236-L260 HydrophobicContact CG-CD1 4.14Å; L236-D261 PolarHBondContact O-N 3.41Å
237	Y	98.7	Very high	96.4	Very high	36 Å²	36	43.3 Å²	43.3	14%	0.141	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	113.7	-178.7	-64.3	-77.9	0	0	0	110.7	L212 H213 L214 E215 F235 Q239 K259 D261	L212-Y237 PolarHBondContact O-N 2.85Å; H213-Y237 AromaticContact CD2-CD2 3.86Å; H213-Y237 AromaticContact CE1-CD2 3.41Å; H213-Y237 VanDerWaalsContact CE1-CD2 3.41Å; H213-Y237 WeakPolarHBondContact CE1-CD2 3.44Å; H213-Y237 AromaticContact CE1-CE2 3.63Å; H213-Y237 AromaticContact CE1-CG 3.95Å; H213-Y237 AromaticContact CG-CD2 3.99Å; H213-Y237 AromaticContact ND1-CD2 3.72Å; H213-Y237 AromaticContact NE2-CD2 3.52Å; H213-Y237 AromaticContact NE2-CE2 3.56Å; L214-Y237 CarbonylContact C-O 3.56Å; L214-Y237 WeakPolarHBondContact CA-O 3.49Å; L214-Y237 WeakPolarHBondContact CB-O 3.49Å; L214-Y237 PolarHBondContact N-O 3.46Å; E215-Y237 PolarHBondContact N-O 3.19Å; E215-Y237 WeakPolarHBondContact OE2-CB 3.46Å; F235-Y237 HydrophobicContact CB-CD2 4.49Å; F235-Y237 HydrophobicContact CB-CE2 3.76Å; Y237-Q239 VanDerWaalsContact CB-OE1 3.3Å; Y237-K259 HydrophobicContact CE1-CD 4.17Å; Y237-D261 HydrophobicContact CD1-CB 3.96Å
238	L	98.5	Very high	96.3	Very high	2 Å²	2	44.1 Å²	44.1	1%	0.01	22%	0.218	C	C	.	.			trans	-127.8	9.5	-177	-74.9	165.7	0	0	0	112.5	L214 L219 I222 L236 N241 I243 L260 D261 L262 N265	L214-L238 HydrophobicContact CB-CD2 3.78Å; L214-L238 HydrophobicContact CD1-CD2 4.01Å; L219-L238 HydrophobicContact CD1-CD2 3.83Å; I222-L238 HydrophobicContact CD1-CD1 4.27Å; I222-L238 HydrophobicContact CD1-CD2 3.81Å; I222-L238 HydrophobicContact CG1-CD1 4.14Å; I222-L238 HydrophobicContact CG1-CD2 4.4Å; L236-L238 HydrophobicContact CD1-CD1 4.25Å; L236-L238 HydrophobicContact CD1-CG 4.15Å; L236-L238 HydrophobicContact CD2-CD1 3.89Å; L236-L238 HydrophobicContact CG-CD1 3.84Å; L236-L238 HydrophobicContact CG-CG 4.11Å; L238-N241 PolarHBondContact O-ND2 2.77Å; L238-I243 HydrophobicContact CB-CD1 3.96Å; L238-I243 HydrophobicContact CD2-CD1 4.27Å; L238-I243 HydrophobicContact CG-CD1 4.5Å; L238-L260 HydrophobicContact CD1-CD1 4.17Å; L238-D261 CarbonylContact C-O 3.59Å; L238-D261 WeakPolarHBondContact CA-O 3.09Å; L238-D261 WeakPolarHBondContact CB-O 3.47Å; L238-D261 PolarHBondContact N-O 3.18Å; L238-L262 HydrophobicContact CB-CD2 3.86Å; L238-L262 HydrophobicContact CD1-CD2 3.97Å; L238-N265 PolarHBondContact O-ND2 2.89Å
239	Q	98.4	Very high	95.9	Very high	25 Å²	25	44.3 Å²	44.3	12%	0.117	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.1	153.2	-176.9	66.4	-78	15.3	0	0	113.7	E215 H216 Y237 N241 D261 T263	E215-Q239 CarbonylContact C-O 3.51Å; E215-Q239 WeakPolarHBondContact CA-O 3.5Å; E215-Q239 HydrophobicContact CB-CG 3.74Å; E215-Q239 VanDerWaalsContact CB-O 3.28Å; E215-Q239 WeakPolarHBondContact CB-O 3.46Å; E215-Q239 HydrophobicContact CG-CG 4.47Å; H216-Q239 PolarHBondContact N-O 3.45Å; Y237-Q239 VanDerWaalsContact CB-OE1 3.3Å; Q239-N241 VanDerWaalsContact C-N 3.29Å; Q239-N241 PolarHBondContact O-N 3.03Å; Q239-N241 PolarHBondContact O-ND2 3.16Å; Q239-D261 PolarHBondContact N-O 2.8Å; Q239-T263 CarbonylContact C-O 3.24Å; Q239-T263 WeakPolarHBondContact CA-O 3.44Å; Q239-T263 WeakPolarHBondContact CB-O 3.13Å
240	W	98.5	Very high	95.7	Very high	122 Å²	122	41.6 Å²	41.6	46%	0.462	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.2	39.6	-179.7	-56.4	108.3	0	0	0	114.2	H216 T263 G264 N288	H216-W240 WeakPolarHBondContact CA-O 3.24Å; H216-W240 AromaticContact CE1-CD1 3.24Å; H216-W240 AromaticContact CE1-CG 3.41Å; H216-W240 VanDerWaalsContact CE1-CG 3.41Å; H216-W240 VanDerWaalsContact ND1-CB 3.31Å; H216-W240 WeakPolarHBondContact ND1-CB 3.39Å; H216-W240 AromaticContact ND1-CD1 3.98Å; H216-W240 AromaticContact ND1-CG 3.76Å; H216-W240 AromaticContact NE2-CD1 3.55Å; W240-T263 PolarHBondContact N-O 3.4Å; W240-G264 WeakPolarHBondContact CA-O 3.24Å; W240-N288 WeakPolarHBondContact CH2-ND2 3.27Å; W240-N288 WeakPolarHBondContact CZ3-ND2 3.33Å
241	N	98.7	Very high	95.4	Very high	10 Å²	10	51.2 Å²	51.2	5%	0.053	27%	0.268	C	S	.	.	S	Bend	trans	-99.9	-158.8	167.9	-87	-86.2	0	0	0	109.9	L214 N217 Q218 L219 L238 Q239 I243 N265	L214-N241 PolarHBondContact O-ND2 2.89Å; N217-N241 VanDerWaalsContact CA-OD1 3.27Å; N217-N241 WeakPolarHBondContact CA-OD1 3.34Å; N217-N241 WeakPolarHBondContact CB-OD1 3.4Å; N217-N241 PolarHBondContact N-OD1 2.89Å; N217-N241 PolarHBondContact O-OD1 3.36Å; Q218-N241 PolarHBondContact N-OD1 2.94Å; L219-N241 HydrophobicContact CB-CB 4.26Å; L219-N241 VanDerWaalsContact CB-OD1 3.28Å; L219-N241 WeakPolarHBondContact CB-OD1 3.32Å; L219-N241 VanDerWaalsContact CG-OD1 3.3Å; L219-N241 WeakPolarHBondContact CG-OD1 3.34Å; L219-N241 PolarHBondContact N-OD1 3.42Å; L238-N241 PolarHBondContact O-ND2 2.77Å; Q239-N241 VanDerWaalsContact C-N 3.29Å; Q239-N241 PolarHBondContact O-N 3.03Å; Q239-N241 PolarHBondContact O-ND2 3.16Å; N241-I243 HydrophobicContact CB-CD1 3.97Å; N241-I243 HydrophobicContact CB-CG1 3.92Å; N241-N265 VanDerWaalsContact CA-OD1 3.3Å; N241-N265 WeakPolarHBondContact CA-OD1 3.31Å; N241-N265 WeakPolarHBondContact CB-OD1 3.47Å; N241-N265 PolarHBondContact N-OD1 2.98Å; N241-N265 PolarHBondContact O-OD1 2.91Å
242	K	98.1	Very high	95.3	Very high	109 Å²	109	49.3 Å²	49.3	47%	0.474	25%	0.251	S	S	.	.			trans	-122	28.9	175.9	-57.8	-166.6	176.7	-164.1	0	111.7	L219 T220 N244 N265	L219-K242 CarbonylContact O-C 3.45Å; L219-K242 VanDerWaalsContact O-CA 3.3Å; L219-K242 WeakPolarHBondContact O-CA 3.33Å; L219-K242 PolarHBondContact O-N 3.31Å; T220-K242 WeakPolarHBondContact CA-O 3.29Å; T220-K242 HydrophobicContact CG2-CB 4.3Å; K242-N244 PolarHBondContact O-N 3.05Å; K242-N244 VanDerWaalsContact O-N 3.15Å; K242-N265 PolarHBondContact N-OD1 2.66Å
243	I	98.4	Very high	95	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	27%	0.265	C	S	.	.			trans	-67.2	116.1	-171.1	-59.6	162.2	0	0	0	107.8	L219 T220 I222 L238 N241 N245 V246 L262 N265 E266 I267	L219-I243 HydrophobicContact CB-CG1 4.27Å; L219-I243 PolarHBondContact O-N 3Å; L219-I243 VanDerWaalsContact O-N 3.11Å; T220-I243 WeakPolarHBondContact O-CA 3.3Å; I222-I243 HydrophobicContact CD1-CD1 4.19Å; I222-I243 HydrophobicContact CG1-CD1 3.58Å; I222-I243 HydrophobicContact CG1-CG1 3.95Å; I222-I243 HydrophobicContact CG1-CG2 4.15Å; L238-I243 HydrophobicContact CB-CD1 3.96Å; L238-I243 HydrophobicContact CD2-CD1 4.27Å; L238-I243 HydrophobicContact CG-CD1 4.5Å; N241-I243 HydrophobicContact CB-CD1 3.97Å; N241-I243 HydrophobicContact CB-CG1 3.92Å; I243-N245 WeakPolarHBondContact CG2-O 3.39Å; I243-V246 HydrophobicContact CG2-CG2 3.79Å; I243-L262 HydrophobicContact CD1-CD2 4.01Å; I243-N265 HydrophobicContact CB-CB 4.24Å; I243-N265 VanDerWaalsContact CB-OD1 3.29Å; I243-N265 WeakPolarHBondContact CB-OD1 3.37Å; I243-N265 WeakPolarHBondContact CG1-OD1 3.28Å; I243-N265 PolarHBondContact N-OD1 2.9Å; I243-E266 CarbonylContact O-C 3.53Å; I243-E266 WeakPolarHBondContact O-CA 3.28Å; I243-E266 PolarHBondContact O-N 2.91Å; I243-I267 HydrophobicContact CG2-CD1 4.45Å; I243-I267 HydrophobicContact CG2-CG1 4.23Å; I243-I267 VanDerWaalsContact O-CG1 3.26Å; I243-I267 WeakPolarHBondContact O-CG1 3.37Å; I243-I267 PolarHBondContact O-N 3.11Å
244	N	96.6	Very high	94.9	Very high	75 Å²	75	52.2 Å²	52.2	40%	0.401	27%	0.266	S	S	.	.			trans	-104.5	-13.3	177.6	64.5	28.2	0	0	0	113.5	T220 K242 E266	T220-N244 PolarHBondContact O-N 2.92Å; T220-N244 PolarHBondContact O-OD1 3.22Å; K242-N244 PolarHBondContact O-N 3.05Å; K242-N244 VanDerWaalsContact O-N 3.15Å; N244-E266 HydrophobicContact CB-CB 4.23Å
245	N	93.9	Very high	94.7	Very high	59 Å²	59	52.8 Å²	52.8	32%	0.316	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	136.1	179.3	-167.5	-11.8	0	0	0	110	K221 I222 I243 T247	K221-N245 WeakPolarHBondContact CA-O 3.49Å; I222-N245 PolarHBondContact N-O 3.03Å; I222-N245 VanDerWaalsContact N-O 3.15Å; I243-N245 WeakPolarHBondContact CG2-O 3.39Å; N245-T247 VanDerWaalsContact OD1-CG2 3.27Å; N245-T247 WeakPolarHBondContact OD1-CG2 3.45Å
246	V	95.4	Very high	94.6	Very high	5 Å²	5	52.4 Å²	52.4	3%	0.03	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	130.9	170.6	-174.7	0	0	0	0	106.5	I222 I243 L262 I267 V274	I222-V246 HydrophobicContact CB-CG1 4.34Å; I222-V246 HydrophobicContact CB-CG2 4.47Å; I222-V246 HydrophobicContact CG2-CG1 4.33Å; I222-V246 CarbonylContact O-C 3.51Å; I222-V246 WeakPolarHBondContact O-CA 3.4Å; I243-V246 HydrophobicContact CG2-CG2 3.79Å; V246-L262 HydrophobicContact CG2-CD1 4.4Å; V246-L262 HydrophobicContact CG2-CD2 4.49Å; V246-I267 HydrophobicContact CG2-CD1 4.09Å; V246-V274 HydrophobicContact CB-CG1 4.41Å; V246-V274 HydrophobicContact CB-CG2 4.43Å; V246-V274 HydrophobicContact CG1-CG1 3.68Å; V246-V274 HydrophobicContact CG1-CG2 4.11Å; V246-V274 VanDerWaalsContact O-CG2 3.3Å; V246-V274 WeakPolarHBondContact O-CG2 3.23Å
247	T	93.8	Very high	94.5	Very high	52 Å²	52	52.4 Å²	52.4	32%	0.319	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	160.4	-178.5	66.3	0	0	0	0	112.2	I222 N223 L224 N245	I222-T247 PolarHBondContact O-N 2.81Å; N223-T247 CarbonylContact C-O 3.09Å; N223-T247 VanDerWaalsContact CA-O 3.31Å; N223-T247 WeakPolarHBondContact CA-O 3.49Å; N223-T247 PolarHBondContact OD1-O 3.18Å; L224-T247 PolarHBondContact N-O 2.95Å; N245-T247 VanDerWaalsContact OD1-CG2 3.27Å; N245-T247 WeakPolarHBondContact OD1-CG2 3.45Å
248	C	90.3	Very high	94.5	Very high	19 Å²	19	53.7 Å²	53.7	13%	0.128	28%	0.283	C	S	.	.			trans	-114.1	102.8	166.7	-154	0	0	0	0	111.3	M250 W252 D273 T277	C248-M250 PolarHBondContact O-N 2.78Å; C248-M250 VanDerWaalsContact O-N 3.17Å; C248-M250 PolarHBondContact SG-O 2.94Å; C248-W252 VanDerWaalsContact SG-CD1 3.53Å; C248-W252 PolarHBondContact SG-NE1 3.31Å; C248-D273 HydrophobicContact CB-CB 4.41Å; C248-D273 WeakPolarHBondContact CB-OD2 3.24Å; C248-D273 PolarHBondContact N-OD2 3.16Å; C248-T277 PolarHBondContact SG-OG1 2.94Å
249	G	83.3	Confident	94.5	Very high	56 Å²	56	55.4 Å²	55.4	58%	0.577	29%	0.29	S	S	*	.	S	Bend	trans	-78.3	13.5	-176.9	0	0	0	0	0	116.3	N223	N223-G249 PolarHBondContact OD1-N 3.17Å
250	M	86.9	Confident	94.5	Very high	65 Å²	65	54.4 Å²	54.4	32%	0.32	29%	0.285	S	S	.	.	S	Bend	trans	-165.7	156	177.3	70.5	-163.3	-172.6	0	0	110.2	A225 P228 C248 W252	A225-M250 HydrophobicContact CB-CB 4.49Å; A225-M250 HydrophobicContact CB-CE 4.02Å; A225-M250 HydrophobicContact CB-CG 3.81Å; A225-M250 HydrophobicContact CB-SD 3.62Å; P228-M250 HydrophobicContact CB-CE 3.68Å; P228-M250 HydrophobicContact CG-CE 3.76Å; C248-M250 PolarHBondContact O-N 2.78Å; C248-M250 VanDerWaalsContact O-N 3.17Å; C248-M250 PolarHBondContact SG-O 2.94Å; M250-W252 HydrophobicContact CE-CB 4Å; M250-W252 VanDerWaalsContact CE-CD1 3.46Å; M250-W252 HydrophobicContact CE-CD2 3.7Å; M250-W252 HydrophobicContact CE-CG 3.44Å; M250-W252 VanDerWaalsContact CE-CG 3.44Å; M250-W252 HydrophobicContact CG-CG 4.31Å; M250-W252 PolarHBondContact O-N 2.87Å
251	E	87.2	Confident	94.5	Very high	203 Å²	203	49.2 Å²	49.2	95%	0.949	27%	0.267	S	S	*	.			trans	-76.8	118.8	170.7	-68.2	172.1	-165.3	0	0	110.5
252	W	92.4	Very high	94.5	Very high	50 Å²	50	48.9 Å²	48.9	19%	0.189	27%	0.265	C	S	.	.			trans	-161.7	174	173.1	73.8	-58.6	0	0	0	110.2	L224 F227 P228 C248 M250 W254 T277	L224-W252 HydrophobicContact CB-CZ2 4.12Å; L224-W252 WeakPolarHBondContact O-CZ2 3.35Å; F227-W252 HydrophobicContact CB-CH2 4.31Å; P228-W252 HydrophobicContact CB-CD2 4.5Å; P228-W252 HydrophobicContact CB-CE3 4.1Å; P228-W252 HydrophobicContact CB-CZ3 4.15Å; C248-W252 VanDerWaalsContact SG-CD1 3.53Å; C248-W252 PolarHBondContact SG-NE1 3.31Å; M250-W252 HydrophobicContact CE-CB 4Å; M250-W252 VanDerWaalsContact CE-CD1 3.46Å; M250-W252 HydrophobicContact CE-CD2 3.7Å; M250-W252 HydrophobicContact CE-CG 3.44Å; M250-W252 VanDerWaalsContact CE-CG 3.44Å; M250-W252 HydrophobicContact CG-CG 4.31Å; M250-W252 PolarHBondContact O-N 2.87Å; W252-W254 HydrophobicContact CH2-CB 3.86Å; W252-W254 AromaticContact CH2-CD2 3.48Å; W252-W254 HydrophobicContact CH2-CD2 3.48Å; W252-W254 VanDerWaalsContact CH2-CD2 3.48Å; W252-W254 AromaticContact CH2-CE3 3.51Å; W252-W254 HydrophobicContact CH2-CE3 3.51Å; W252-W254 AromaticContact CH2-CG 3.68Å; W252-W254 HydrophobicContact CH2-CG 3.68Å; W252-W254 HydrophobicContact CH2-CZ3 4.19Å; W252-W254 HydrophobicContact CZ2-CB 4.44Å; W252-W254 HydrophobicContact CZ2-CD2 4.23Å; W252-W254 AromaticContact CZ2-CE3 3.83Å; W252-W254 HydrophobicContact CZ2-CE3 3.83Å; W252-W254 HydrophobicContact CZ2-CZ3 4.41Å; W252-W254 HydrophobicContact CZ3-CB 3.9Å; W252-W254 HydrophobicContact CZ3-CD2 4.16Å; W252-W254 AromaticContact CZ3-CG 3.89Å; W252-W254 HydrophobicContact CZ3-CG 3.89Å; W252-T277 HydrophobicContact CD2-CG2 4.19Å; W252-T277 HydrophobicContact CG-CG2 4.34Å; W252-T277 HydrophobicContact CZ2-CG2 4.06Å
253	T	92.9	Very high	94.5	Very high	88 Å²	88	44.9 Å²	44.9	54%	0.54	25%	0.25	S	C	.	.			trans	-130.2	139.3	175.3	50.6	0	0	0	0	111.4
254	W	94.5	Very high	94.5	Very high	3 Å²	3	45.3 Å²	45.3	1%	0.011	25%	0.254	C	S	.	.			trans	-110.6	80.9	177.8	-156.8	-12.3	0	0	0	109.1	L224 F227 L230 L233 L236 W252 T256 L257 T277 L278	L224-W254 HydrophobicContact CD2-CZ3 4.31Å; F227-W254 HydrophobicContact CB-CH2 3.3Å; F227-W254 HydrophobicContact CB-CZ2 3.86Å; F227-W254 HydrophobicContact CB-CZ3 3.7Å; F227-W254 HydrophobicContact CD1-CH2 4.32Å; F227-W254 AromaticContact CD2-CH2 3.7Å; F227-W254 HydrophobicContact CD2-CH2 3.7Å; F227-W254 AromaticContact CD2-CZ3 3.67Å; F227-W254 HydrophobicContact CD2-CZ3 3.67Å; F227-W254 AromaticContact CG-CH2 3.54Å; F227-W254 HydrophobicContact CG-CH2 3.54Å; F227-W254 HydrophobicContact CG-CZ2 4.46Å; F227-W254 AromaticContact CG-CZ3 3.94Å; F227-W254 HydrophobicContact CG-CZ3 3.94Å; L230-W254 HydrophobicContact CB-CZ2 4.11Å; L230-W254 PolarHBondContact O-NE1 2.88Å; L233-W254 HydrophobicContact CB-CZ2 3.77Å; L233-W254 HydrophobicContact CD2-CH2 3.82Å; L233-W254 HydrophobicContact CD2-CZ2 3.46Å; L233-W254 VanDerWaalsContact CD2-CZ2 3.46Å; L233-W254 HydrophobicContact CG-CZ2 4.22Å; L236-W254 HydrophobicContact CD2-CH2 4.04Å; L236-W254 HydrophobicContact CD2-CZ3 4.24Å; W252-W254 HydrophobicContact CH2-CB 3.86Å; W252-W254 AromaticContact CH2-CD2 3.48Å; W252-W254 HydrophobicContact CH2-CD2 3.48Å; W252-W254 VanDerWaalsContact CH2-CD2 3.48Å; W252-W254 AromaticContact CH2-CE3 3.51Å; W252-W254 HydrophobicContact CH2-CE3 3.51Å; W252-W254 AromaticContact CH2-CG 3.68Å; W252-W254 HydrophobicContact CH2-CG 3.68Å; W252-W254 HydrophobicContact CH2-CZ3 4.19Å; W252-W254 HydrophobicContact CZ2-CB 4.44Å; W252-W254 HydrophobicContact CZ2-CD2 4.23Å; W252-W254 AromaticContact CZ2-CE3 3.83Å; W252-W254 HydrophobicContact CZ2-CE3 3.83Å; W252-W254 HydrophobicContact CZ2-CZ3 4.41Å; W252-W254 HydrophobicContact CZ3-CB 3.9Å; W252-W254 HydrophobicContact CZ3-CD2 4.16Å; W252-W254 AromaticContact CZ3-CG 3.89Å; W252-W254 HydrophobicContact CZ3-CG 3.89Å; W254-T256 PolarHBondContact O-N 3.08Å; W254-L257 HydrophobicContact CD2-CB 4.06Å; W254-L257 HydrophobicContact CD2-CD2 4.35Å; W254-L257 HydrophobicContact CE3-CD2 4.08Å; W254-L257 HydrophobicContact CG-CB 4.02Å; W254-L257 HydrophobicContact CZ2-CD1 4.35Å; W254-L257 HydrophobicContact CZ3-CD2 4.26Å; W254-T277 PolarHBondContact N-O 3.47Å; W254-L278 HydrophobicContact CB-CD2 3.81Å; W254-L278 HydrophobicContact CD2-CD2 4.36Å; W254-L278 HydrophobicContact CE3-CD2 3.88Å; W254-L278 HydrophobicContact CG-CD2 4.38Å
255	T	94.3	Very high	94.6	Very high	80 Å²	80	42 Å²	42	49%	0.491	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-9.4	-172.4	53.2	0	0	0	0	114.6	N280	T255-N280 PolarHBondContact O-ND2 2.85Å
256	T	96.8	Very high	94.8	Very high	41 Å²	41	42.3 Å²	42.3	25%	0.252	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103	-15.5	-175.9	37.2	0	0	0	0	114.8	V231 L233 Q234 W254 E258	V231-T256 WeakPolarHBondContact O-CB 3.36Å; V231-T256 VanDerWaalsContact O-CG2 3.25Å; V231-T256 WeakPolarHBondContact O-CG2 3.33Å; V231-T256 PolarHBondContact O-OG1 3.42Å; L233-T256 CarbonylContact O-C 3.3Å; L233-T256 VanDerWaalsContact O-O 3.08Å; Q234-T256 WeakPolarHBondContact CA-O 3.47Å; W254-T256 PolarHBondContact O-N 3.08Å; T256-E258 PolarHBondContact O-N 3.01Å
257	L	97.7	Very high	95	Very high	1 Å²	1	42 Å²	42	1%	0.005	24%	0.235	C	C	.	.			trans	-77.2	113.1	-175.2	-167.1	75.3	0	0	0	111.4	L233 L236 W254 L260 L278 L281	L233-L257 HydrophobicContact CD2-CD1 4.03Å; L233-L257 HydrophobicContact CG-CD1 4.29Å; L233-L257 VanDerWaalsContact O-CA 3.3Å; L233-L257 WeakPolarHBondContact O-CA 3.36Å; L233-L257 PolarHBondContact O-N 3.19Å; L236-L257 HydrophobicContact CB-CD1 3.88Å; W254-L257 HydrophobicContact CD2-CB 4.06Å; W254-L257 HydrophobicContact CD2-CD2 4.35Å; W254-L257 HydrophobicContact CE3-CD2 4.08Å; W254-L257 HydrophobicContact CG-CB 4.02Å; W254-L257 HydrophobicContact CZ2-CD1 4.35Å; W254-L257 HydrophobicContact CZ3-CD2 4.26Å; L257-L260 HydrophobicContact CD2-CB 4.39Å; L257-L278 HydrophobicContact CD2-CD1 4.34Å; L257-L278 HydrophobicContact CD2-CD2 3.78Å; L257-L281 HydrophobicContact CD2-CD1 4.37Å; L257-L281 HydrophobicContact CG-CD1 4.43Å; L257-L281 WeakPolarHBondContact O-CA 3.44Å
258	E	97.9	Very high	95.1	Very high	63 Å²	63	47.3 Å²	47.3	29%	0.294	25%	0.248	S	C	.	.			trans	-98.6	-31.9	-178.7	-51.7	-153.3	157.6	0	0	113.1	Q234 T256 K282 I283	Q234-E258 HydrophobicContact CB-CG 4.43Å; Q234-E258 PolarHBondContact O-N 2.91Å; T256-E258 PolarHBondContact O-N 3.01Å; E258-K282 HydrophobicContact CB-CD 4.3Å; E258-K282 HydrophobicContact CB-CG 4.47Å; E258-K282 VanDerWaalsContact CD-CE 3.46Å; E258-K282 WeakPolarHBondContact O-CA 3.23Å; E258-K282 PolarHBondContact O-N 3.17Å; E258-K282 WeakPolarHBondContact OE1-CE 3.18Å; E258-K282 IonicContact OE1-NZ 2.68Å; E258-K282 PolarHBondContact OE1-NZ 3.13Å; E258-K282 WeakPolarHBondContact OE2-CE 3.43Å; E258-K282 IonicContact OE2-NZ 2.7Å; E258-K282 PolarHBondContact OE2-NZ 3.27Å; E258-I283 PolarHBondContact O-N 3.07Å
259	K	98.6	Very high	95.3	Very high	37 Å²	37	50.5 Å²	50.5	16%	0.161	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	130.9	179.7	179.4	171.3	178.5	177.6	0	112.4	Q234 F235 L236 Y237 I283	Q234-K259 PolarHBondContact O-N 2.8Å; F235-K259 HydrophobicContact CD1-CB 3.66Å; F235-K259 HydrophobicContact CD1-CD 4.15Å; F235-K259 HydrophobicContact CD1-CG 4.44Å; F235-K259 HydrophobicContact CE1-CB 4.28Å; L236-K259 PolarHBondContact N-O 3.31Å; Y237-K259 HydrophobicContact CE1-CD 4.17Å; K259-I283 WeakPolarHBondContact CA-O 3.45Å; K259-I283 HydrophobicContact CB-CB 4.06Å; K259-I283 HydrophobicContact CD-CB 4.4Å; K259-I283 HydrophobicContact CD-CD1 4.43Å; K259-I283 HydrophobicContact CD-CG2 4.07Å; K259-I283 HydrophobicContact CG-CB 3.94Å; K259-I283 HydrophobicContact CG-CG2 3.91Å
260	L	98.4	Very high	95.9	Very high	4 Å²	4	48.2 Å²	48.2	2%	0.021	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	113.8	170.1	177.5	56.3	0	0	0	109.4	L236 L238 L257 L262 L278 L281 I283 L284 L285	L236-L260 HydrophobicContact CB-CD1 4.31Å; L236-L260 HydrophobicContact CD2-CD1 4.05Å; L236-L260 HydrophobicContact CG-CD1 4.14Å; L238-L260 HydrophobicContact CD1-CD1 4.17Å; L257-L260 HydrophobicContact CD2-CB 4.39Å; L260-L262 HydrophobicContact CD1-CD1 4.33Å; L260-L262 HydrophobicContact CD1-CD2 4.43Å; L260-L262 HydrophobicContact CD1-CG 4.08Å; L260-L262 HydrophobicContact CD2-CD1 3.93Å; L260-L262 HydrophobicContact CG-CD1 3.96Å; L260-L262 HydrophobicContact CG-CG 4.05Å; L260-L278 HydrophobicContact CD2-CD1 3.85Å; L260-L281 HydrophobicContact CB-CD1 3.8Å; L260-L281 HydrophobicContact CB-CD2 4.38Å; L260-I283 PolarHBondContact N-O 2.9Å; L260-L284 HydrophobicContact CB-CD1 4.37Å; L260-L284 HydrophobicContact CD2-CD1 4.25Å; L260-L284 HydrophobicContact CG-CD1 4.31Å; L260-L285 PolarHBondContact O-N 2.89Å
261	D	98.7	Very high	96.1	Very high	13 Å²	13	47.4 Å²	47.4	7%	0.07	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	108.8	178.8	-166.5	-15.6	0	0	0	110.6	L236 Y237 L238 Q239 T263	L236-D261 PolarHBondContact O-N 3.41Å; Y237-D261 HydrophobicContact CD1-CB 3.96Å; L238-D261 CarbonylContact C-O 3.59Å; L238-D261 WeakPolarHBondContact CA-O 3.09Å; L238-D261 WeakPolarHBondContact CB-O 3.47Å; L238-D261 PolarHBondContact N-O 3.18Å; Q239-D261 PolarHBondContact N-O 2.8Å; D261-T263 VanDerWaalsContact OD1-CB 3.24Å; D261-T263 WeakPolarHBondContact OD1-CB 3.16Å; D261-T263 PolarHBondContact OD1-N 3.47Å; D261-T263 VanDerWaalsContact OD1-N 3.15Å; D261-T263 PolarHBondContact OD1-OG1 3.44Å
262	L	98.4	Very high	96.4	Very high	3 Å²	3	39.5 Å²	39.5	2%	0.016	21%	0.207	C	C	.	.			trans	-114.4	15.2	179.4	-70	166.2	0	0	0	111.7	L238 I243 V246 L260 N265 I267 L285 L286 N289	L238-L262 HydrophobicContact CB-CD2 3.86Å; L238-L262 HydrophobicContact CD1-CD2 3.97Å; I243-L262 HydrophobicContact CD1-CD2 4.01Å; V246-L262 HydrophobicContact CG2-CD1 4.4Å; V246-L262 HydrophobicContact CG2-CD2 4.49Å; L260-L262 HydrophobicContact CD1-CD1 4.33Å; L260-L262 HydrophobicContact CD1-CD2 4.43Å; L260-L262 HydrophobicContact CD1-CG 4.08Å; L260-L262 HydrophobicContact CD2-CD1 3.93Å; L260-L262 HydrophobicContact CG-CD1 3.96Å; L260-L262 HydrophobicContact CG-CG 4.05Å; L262-N265 WeakPolarHBondContact O-CB 3.26Å; L262-N265 PolarHBondContact O-ND2 3.01Å; L262-I267 HydrophobicContact CB-CD1 4.08Å; L262-I267 HydrophobicContact CD1-CD1 4.01Å; L262-I267 HydrophobicContact CD2-CD1 4.29Å; L262-I267 HydrophobicContact CG-CD1 4.36Å; L262-L285 CarbonylContact C-O 3.51Å; L262-L285 WeakPolarHBondContact CA-O 3.23Å; L262-L285 WeakPolarHBondContact CB-O 3.26Å; L262-L285 PolarHBondContact N-O 3.36Å; L262-L286 HydrophobicContact CB-CD2 3.99Å; L262-L286 HydrophobicContact CD1-CD2 3.91Å; L262-N289 PolarHBondContact O-ND2 3.03Å
263	T	98.7	Very high	96.3	Very high	25 Å²	25	39.7 Å²	39.7	15%	0.153	21%	0.212	C	C	.	.			trans	-52.3	140.7	-177.9	-55	0	0	0	0	112.6	Q239 W240 D261 N265 L285 D287	Q239-T263 CarbonylContact C-O 3.24Å; Q239-T263 WeakPolarHBondContact CA-O 3.44Å; Q239-T263 WeakPolarHBondContact CB-O 3.13Å; W240-T263 PolarHBondContact N-O 3.4Å; D261-T263 VanDerWaalsContact OD1-CB 3.24Å; D261-T263 WeakPolarHBondContact OD1-CB 3.16Å; D261-T263 PolarHBondContact OD1-N 3.47Å; D261-T263 VanDerWaalsContact OD1-N 3.15Å; D261-T263 PolarHBondContact OD1-OG1 3.44Å; T263-N265 PolarHBondContact O-ND2 3.36Å; T263-L285 PolarHBondContact N-O 3.27Å; T263-L285 WeakPolarHBondContact OG1-CB 3.45Å; T263-D287 CarbonylContact C-O 3.48Å; T263-D287 WeakPolarHBondContact CA-O 3.36Å; T263-D287 HydrophobicContact CG2-CB 4.15Å
264	G	98.3	Very high	96.3	Very high	9 Å²	9	35.6 Å²	35.6	9%	0.093	19%	0.186	C	C	.	.	S	Bend	trans	67.6	39.1	171.9	0	0	0	0	0	114.5	W240 D287 N288	W240-G264 WeakPolarHBondContact CA-O 3.24Å; G264-D287 PolarHBondContact N-O 2.89Å; G264-N288 CarbonylContact C-O 3.05Å; G264-N288 WeakPolarHBondContact CA-O 3.49Å; G264-N288 PolarHBondContact N-O 2.93Å
265	N	98.8	Very high	96.3	Very high	7 Å²	7	35.7 Å²	35.7	4%	0.037	19%	0.187	C	C	.	.	S	Bend	trans	-111.8	-167.9	178	-86.8	-78.2	0	0	0	111.6	L238 N241 K242 I243 L262 T263 I267 N288 N289	L238-N265 PolarHBondContact O-ND2 2.89Å; N241-N265 VanDerWaalsContact CA-OD1 3.3Å; N241-N265 WeakPolarHBondContact CA-OD1 3.31Å; N241-N265 WeakPolarHBondContact CB-OD1 3.47Å; N241-N265 PolarHBondContact N-OD1 2.98Å; N241-N265 PolarHBondContact O-OD1 2.91Å; K242-N265 PolarHBondContact N-OD1 2.66Å; I243-N265 HydrophobicContact CB-CB 4.24Å; I243-N265 VanDerWaalsContact CB-OD1 3.29Å; I243-N265 WeakPolarHBondContact CB-OD1 3.37Å; I243-N265 WeakPolarHBondContact CG1-OD1 3.28Å; I243-N265 PolarHBondContact N-OD1 2.9Å; L262-N265 WeakPolarHBondContact O-CB 3.26Å; L262-N265 PolarHBondContact O-ND2 3.01Å; T263-N265 PolarHBondContact O-ND2 3.36Å; N265-I267 HydrophobicContact CB-CD1 4.48Å; N265-I267 HydrophobicContact CB-CG1 4.22Å; N265-N288 PolarHBondContact N-O 3.07Å; N265-N289 WeakPolarHBondContact CA-OD1 3.38Å; N265-N289 WeakPolarHBondContact CB-OD1 3.4Å; N265-N289 PolarHBondContact O-OD1 3.47Å
266	E	98.3	Very high	96.2	Very high	64 Å²	64	38.3 Å²	38.3	30%	0.299	19%	0.194	S	C	.	.			trans	-113.4	20.9	-177.6	-60.3	-158.3	-130.8	0	0	113.1	I243 N244 R268 K290	I243-E266 CarbonylContact O-C 3.53Å; I243-E266 WeakPolarHBondContact O-CA 3.28Å; I243-E266 PolarHBondContact O-N 2.91Å; N244-E266 HydrophobicContact CB-CB 4.23Å; E266-R268 PolarHBondContact O-N 3.43Å; E266-K290 HydrophobicContact CB-CD 4.16Å; E266-K290 HydrophobicContact CG-CD 4.49Å; E266-K290 IonicContact OE2-NZ 2.83Å; E266-K290 PolarHBondContact OE2-NZ 2.86Å
267	I	98.1	Very high	96	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	18%	0.184	C	C	.	.			trans	-67	128.3	-173.4	-54.4	173.8	0	0	0	109.5	I243 V246 L262 N265 V269 L270 L286 N289 K290 L291	I243-I267 HydrophobicContact CG2-CD1 4.45Å; I243-I267 HydrophobicContact CG2-CG1 4.23Å; I243-I267 VanDerWaalsContact O-CG1 3.26Å; I243-I267 WeakPolarHBondContact O-CG1 3.37Å; I243-I267 PolarHBondContact O-N 3.11Å; V246-I267 HydrophobicContact CG2-CD1 4.09Å; L262-I267 HydrophobicContact CB-CD1 4.08Å; L262-I267 HydrophobicContact CD1-CD1 4.01Å; L262-I267 HydrophobicContact CD2-CD1 4.29Å; L262-I267 HydrophobicContact CG-CD1 4.36Å; N265-I267 HydrophobicContact CB-CD1 4.48Å; N265-I267 HydrophobicContact CB-CG1 4.22Å; I267-V269 WeakPolarHBondContact CG2-O 3.26Å; I267-L270 HydrophobicContact CG2-CD2 3.77Å; I267-L270 HydrophobicContact CG2-CG 4.24Å; I267-L286 HydrophobicContact CD1-CD2 4.19Å; I267-N289 HydrophobicContact CB-CB 4.5Å; I267-N289 WeakPolarHBondContact CB-OD1 3.49Å; I267-N289 VanDerWaalsContact CG1-OD1 3.32Å; I267-N289 WeakPolarHBondContact CG1-OD1 3.28Å; I267-N289 PolarHBondContact N-OD1 3.39Å; I267-N289 VanDerWaalsContact N-OD1 3.14Å; I267-K290 CarbonylContact O-C 3.55Å; I267-K290 VanDerWaalsContact O-CA 3.22Å; I267-K290 WeakPolarHBondContact O-CA 3.43Å; I267-K290 WeakPolarHBondContact O-CB 3.15Å; I267-K290 PolarHBondContact O-N 3.35Å; I267-L291 HydrophobicContact CB-CD2 4.46Å; I267-L291 HydrophobicContact CG2-CD2 3.89Å; I267-L291 PolarHBondContact O-N 3.16Å
268	R	96.3	Very high	95.9	Very high	162 Å²	162	36.9 Å²	36.9	61%	0.611	19%	0.185	S	C	*	.			trans	-109.1	-31.9	180	-57.6	-175.6	-171	-165.8	1.3	114.2	E266 K290	E266-R268 PolarHBondContact O-N 3.43Å; R268-K290 WeakPolarHBondContact CA-O 3.47Å; R268-K290 HydrophobicContact CG-CB 3.97Å
269	V	94.8	Very high	95.7	Very high	87 Å²	87	36.5 Å²	36.5	53%	0.527	19%	0.188	S	C	.	.			trans	-137.6	143.6	-177.1	-179.5	0	0	0	0	107.1	I267	I267-V269 WeakPolarHBondContact CG2-O 3.26Å
270	L	95.5	Very high	95.6	Very high	7 Å²	7	38.3 Å²	38.3	4%	0.037	20%	0.199	C	C	.	.			trans	-117.2	142	171.1	-73	177.6	0	0	0	108.2	I267 F275 L286 L291 L294 V298 W302	I267-L270 HydrophobicContact CG2-CD2 3.77Å; I267-L270 HydrophobicContact CG2-CG 4.24Å; L270-F275 HydrophobicContact CB-CE2 4.06Å; L270-F275 HydrophobicContact CD1-CE2 4.07Å; L270-F275 HydrophobicContact CD1-CZ 4.01Å; L270-F275 HydrophobicContact CD2-CE2 4.07Å; L270-F275 HydrophobicContact CD2-CZ 4.15Å; L270-F275 HydrophobicContact CG-CE2 4.3Å; L270-L286 HydrophobicContact CD1-CD1 3.63Å; L270-L286 HydrophobicContact CD1-CD2 4.19Å; L270-L291 HydrophobicContact CD1-CD1 4.35Å; L270-L291 HydrophobicContact CD1-CD2 4.4Å; L270-L291 HydrophobicContact CG-CD2 4.11Å; L270-L294 HydrophobicContact CB-CD2 4.38Å; L270-L294 HydrophobicContact CD1-CD2 3.95Å; L270-L294 HydrophobicContact CG-CD2 4.5Å; L270-V298 HydrophobicContact CB-CG1 4.18Å; L270-V298 HydrophobicContact CB-CG2 4.48Å; L270-V298 WeakPolarHBondContact O-CG2 3.46Å; L270-W302 HydrophobicContact CD1-CZ2 4.12Å
271	T	92.8	Very high	95.6	Very high	48 Å²	48	38.4 Å²	38.4	29%	0.294	20%	0.2	S	C	.	.			trans	-113.8	143.9	-177.8	54.9	0	0	0	0	110.7	D273 V274	T271-D273 VanDerWaalsContact C-N 3.33Å; T271-D273 WeakPolarHBondContact CB-OD1 3.1Å; T271-D273 PolarHBondContact O-N 3.26Å; T271-D273 PolarHBondContact OG1-OD1 2.96Å; T271-V274 WeakPolarHBondContact O-CB 3.31Å; T271-V274 PolarHBondContact O-N 3.08Å
272	P	92.6	Very high	95.5	Very high	38 Å²	38	41.7 Å²	41.7	25%	0.247	21%	0.213	C	C	.	.	H	α-helix	trans	-63.7	-30	-172.2	-26.4	35.8	0	0	0	115.4	V274 F275 Q276 Q297 V298	P272-V274 PolarHBondContact O-N 3.32Å; P272-F275 PolarHBondContact O-N 2.88Å; P272-Q276 PolarHBondContact O-N 2.96Å; P272-Q297 HydrophobicContact CB-CB 4.34Å; P272-Q297 HydrophobicContact CG-CB 3.65Å; P272-V298 HydrophobicContact CG-CG2 3.96Å
273	D	91.1	Very high	95.5	Very high	53 Å²	53	43.8 Å²	43.8	28%	0.283	22%	0.224	S	C	.	.	H	α-helix	trans	-54.8	-36.8	177.9	65.2	-55.8	0	0	0	112.7	C248 T271 F275 T277	C248-D273 HydrophobicContact CB-CB 4.41Å; C248-D273 WeakPolarHBondContact CB-OD2 3.24Å; C248-D273 PolarHBondContact N-OD2 3.16Å; T271-D273 VanDerWaalsContact C-N 3.33Å; T271-D273 WeakPolarHBondContact CB-OD1 3.1Å; T271-D273 PolarHBondContact O-N 3.26Å; T271-D273 PolarHBondContact OG1-OD1 2.96Å; D273-F275 VanDerWaalsContact C-N 3.29Å; D273-F275 PolarHBondContact O-N 3.1Å; D273-T277 PolarHBondContact O-N 3.29Å; D273-T277 PolarHBondContact O-OG1 2.92Å
274	V	92.7	Very high	95.5	Very high	2 Å²	2	42.6 Å²	42.6	1%	0.012	22%	0.217	C	C	.	.	H	α-helix	trans	-62.7	-36.9	177.8	175.3	0	0	0	0	111.2	L224 V246 T271 P272 T277 L278	L224-V274 HydrophobicContact CD1-CG1 4.03Å; V246-V274 HydrophobicContact CB-CG1 4.41Å; V246-V274 HydrophobicContact CB-CG2 4.43Å; V246-V274 HydrophobicContact CG1-CG1 3.68Å; V246-V274 HydrophobicContact CG1-CG2 4.11Å; V246-V274 VanDerWaalsContact O-CG2 3.3Å; V246-V274 WeakPolarHBondContact O-CG2 3.23Å; T271-V274 WeakPolarHBondContact O-CB 3.31Å; T271-V274 PolarHBondContact O-N 3.08Å; P272-V274 PolarHBondContact O-N 3.32Å; V274-T277 WeakPolarHBondContact O-CB 3.23Å; V274-L278 WeakPolarHBondContact O-CG 3.44Å
275	F	93.5	Very high	95.5	Very high	5 Å²	5	43.5 Å²	43.5	2%	0.022	22%	0.219	C	C	.	.	H	α-helix	trans	-94.6	-29	-176.1	-63.7	-79.1	0	0	0	113	L270 P272 D273 T277 L278 L284 V298 M301 W302	L270-F275 HydrophobicContact CB-CE2 4.06Å; L270-F275 HydrophobicContact CD1-CE2 4.07Å; L270-F275 HydrophobicContact CD1-CZ 4.01Å; L270-F275 HydrophobicContact CD2-CE2 4.07Å; L270-F275 HydrophobicContact CD2-CZ 4.15Å; L270-F275 HydrophobicContact CG-CE2 4.3Å; P272-F275 PolarHBondContact O-N 2.88Å; D273-F275 VanDerWaalsContact C-N 3.29Å; D273-F275 PolarHBondContact O-N 3.1Å; F275-T277 PolarHBondContact O-N 3.5Å; F275-L278 PolarHBondContact O-N 3.33Å; F275-L284 HydrophobicContact CD1-CD2 4.39Å; F275-L284 HydrophobicContact CE1-CD1 4.12Å; F275-L284 HydrophobicContact CE1-CD2 3.59Å; F275-L284 HydrophobicContact CZ-CD2 4.2Å; F275-V298 HydrophobicContact CD2-CG1 3.91Å; F275-V298 HydrophobicContact CE2-CG1 4.02Å; F275-M301 HydrophobicContact CB-CB 3.63Å; F275-M301 HydrophobicContact CB-CG 4.22Å; F275-W302 AromaticContact CD1-CD1 3.73Å; F275-W302 AromaticContact CD1-NE1 3.19Å; F275-W302 AromaticContact CD2-NE1 3.82Å; F275-W302 HydrophobicContact CE1-CZ2 4.48Å; F275-W302 AromaticContact CE1-NE1 3.45Å; F275-W302 AromaticContact CG-CD1 3.91Å; F275-W302 AromaticContact CG-NE1 3.39Å; F275-W302 HydrophobicContact CZ-CZ2 4.3Å; F275-W302 AromaticContact CZ-NE1 3.87Å
276	Q	92.3	Very high	95.5	Very high	136 Å²	136	43.2 Å²	43.2	64%	0.636	22%	0.218	S	C	*	.	H	α-helix	trans	-56.5	-30.9	165.4	-170.4	-178.3	8.9	0	0	111.7	P272 L278 M301	P272-Q276 PolarHBondContact O-N 2.96Å; Q276-L278 VanDerWaalsContact C-N 3.27Å; Q276-L278 PolarHBondContact O-N 2.91Å; Q276-M301 HydrophobicContact CB-SD 4.13Å
277	T	93.4	Very high	95.5	Very high	6 Å²	6	41 Å²	41	4%	0.037	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-21.1	173.6	-56.2	0	0	0	0	113.2	L224 C248 W252 W254 D273 V274 F275 P279	L224-T277 HydrophobicContact CD1-CG2 3.87Å; C248-T277 PolarHBondContact SG-OG1 2.94Å; W252-T277 HydrophobicContact CD2-CG2 4.19Å; W252-T277 HydrophobicContact CG-CG2 4.34Å; W252-T277 HydrophobicContact CZ2-CG2 4.06Å; W254-T277 PolarHBondContact N-O 3.47Å; D273-T277 PolarHBondContact O-N 3.29Å; D273-T277 PolarHBondContact O-OG1 2.92Å; V274-T277 WeakPolarHBondContact O-CB 3.23Å; F275-T277 PolarHBondContact O-N 3.5Å; T277-P279 WeakPolarHBondContact O-CD 3.47Å
278	L	95.2	Very high	95.5	Very high	6 Å²	6	44.3 Å²	44.3	3%	0.031	23%	0.226	C	C	.	.			trans	-120.5	56	-165.7	-57.2	-179.6	0	0	0	113.6	L224 W254 L257 L260 V274 F275 Q276 N280 L281	L224-L278 HydrophobicContact CD1-CD1 4.38Å; L224-L278 HydrophobicContact CD1-CD2 4.3Å; L224-L278 HydrophobicContact CD1-CG 4.31Å; W254-L278 HydrophobicContact CB-CD2 3.81Å; W254-L278 HydrophobicContact CD2-CD2 4.36Å; W254-L278 HydrophobicContact CE3-CD2 3.88Å; W254-L278 HydrophobicContact CG-CD2 4.38Å; L257-L278 HydrophobicContact CD2-CD1 4.34Å; L257-L278 HydrophobicContact CD2-CD2 3.78Å; L260-L278 HydrophobicContact CD2-CD1 3.85Å; V274-L278 WeakPolarHBondContact O-CG 3.44Å; F275-L278 PolarHBondContact O-N 3.33Å; Q276-L278 VanDerWaalsContact C-N 3.27Å; Q276-L278 PolarHBondContact O-N 2.91Å; L278-N280 VanDerWaalsContact C-N 3.27Å; L278-N280 PolarHBondContact O-N 2.74Å; L278-N280 VanDerWaalsContact O-N 3.15Å; L278-L281 HydrophobicContact CB-CB 4.25Å; L278-L281 HydrophobicContact CD1-CD2 4.28Å; L278-L281 WeakPolarHBondContact O-CB 3.5Å; L278-L281 PolarHBondContact O-N 3.3Å
279	P	94.1	Very high	95.6	Very high	55 Å²	55	36.9 Å²	36.9	36%	0.357	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-25.2	-168.3	27	-36.7	0	0	0	114.9	T277 S304	T277-P279 WeakPolarHBondContact O-CD 3.47Å; P279-S304 WeakPolarHBondContact O-CB 3.49Å; P279-S304 PolarHBondContact O-OG 3.37Å
280	N	95.9	Very high	95.8	Very high	74 Å²	74	36.2 Å²	36.2	40%	0.396	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.1	12.6	-175.5	-68.3	-14.3	0	0	0	113.4	T255 L278 K282	T255-N280 PolarHBondContact O-ND2 2.85Å; L278-N280 VanDerWaalsContact C-N 3.27Å; L278-N280 PolarHBondContact O-N 2.74Å; L278-N280 VanDerWaalsContact O-N 3.15Å; N280-K282 PolarHBondContact O-N 3.16Å
281	L	97.4	Very high	95.9	Very high	6 Å²	6	35.9 Å²	35.9	3%	0.031	19%	0.186	C	C	.	.			trans	-64.6	126.7	-180	-170	70	0	0	0	110.6	L257 L260 L278 L284 S304 L305	L257-L281 HydrophobicContact CD2-CD1 4.37Å; L257-L281 HydrophobicContact CG-CD1 4.43Å; L257-L281 WeakPolarHBondContact O-CA 3.44Å; L260-L281 HydrophobicContact CB-CD1 3.8Å; L260-L281 HydrophobicContact CB-CD2 4.38Å; L278-L281 HydrophobicContact CB-CB 4.25Å; L278-L281 HydrophobicContact CD1-CD2 4.28Å; L278-L281 WeakPolarHBondContact O-CB 3.5Å; L278-L281 PolarHBondContact O-N 3.3Å; L281-L284 HydrophobicContact CD2-CB 4.02Å; L281-L284 HydrophobicContact CD2-CD1 4.24Å; L281-L284 HydrophobicContact CD2-CD2 4.48Å; L281-L284 HydrophobicContact CD2-CG 4.48Å; L281-S304 CarbonylContact O-C 3.53Å; L281-S304 VanDerWaalsContact O-CB 3.26Å; L281-S304 WeakPolarHBondContact O-CB 3.5Å; L281-L305 HydrophobicContact CB-CD2 4.42Å; L281-L305 HydrophobicContact CD2-CD2 4.14Å; L281-L305 HydrophobicContact CG-CD2 4Å; L281-L305 PolarHBondContact O-N 3.04Å
282	K	97.8	Very high	96	Very high	82 Å²	82	35.8 Å²	35.8	36%	0.357	19%	0.188	S	C	.	.			trans	-107.1	-34.5	-178.4	-54.7	178.6	-167.5	166.7	0	112.3	E258 N280 S306 T307	E258-K282 HydrophobicContact CB-CD 4.3Å; E258-K282 HydrophobicContact CB-CG 4.47Å; E258-K282 VanDerWaalsContact CD-CE 3.46Å; E258-K282 WeakPolarHBondContact O-CA 3.23Å; E258-K282 PolarHBondContact O-N 3.17Å; E258-K282 WeakPolarHBondContact OE1-CE 3.18Å; E258-K282 IonicContact OE1-NZ 2.68Å; E258-K282 PolarHBondContact OE1-NZ 3.13Å; E258-K282 WeakPolarHBondContact OE2-CE 3.43Å; E258-K282 IonicContact OE2-NZ 2.7Å; E258-K282 PolarHBondContact OE2-NZ 3.27Å; N280-K282 PolarHBondContact O-N 3.16Å; K282-S306 PolarHBondContact O-N 2.68Å; K282-S306 PolarHBondContact O-OG 3.44Å; K282-T307 PolarHBondContact O-N 2.98Å
283	I	98.6	Very high	96.2	Very high	47 Å²	47	35.9 Å²	35.9	24%	0.241	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	115.4	-175.7	-55.1	179.7	0	0	0	109	E258 K259 L260 L285 T307	E258-I283 PolarHBondContact O-N 3.07Å; K259-I283 WeakPolarHBondContact CA-O 3.45Å; K259-I283 HydrophobicContact CB-CB 4.06Å; K259-I283 HydrophobicContact CD-CB 4.4Å; K259-I283 HydrophobicContact CD-CD1 4.43Å; K259-I283 HydrophobicContact CD-CG2 4.07Å; K259-I283 HydrophobicContact CG-CB 3.94Å; K259-I283 HydrophobicContact CG-CG2 3.91Å; L260-I283 PolarHBondContact N-O 2.9Å; I283-L285 HydrophobicContact CG2-CD2 4.27Å; I283-L285 HydrophobicContact CG2-CG 4.12Å; I283-T307 WeakPolarHBondContact CA-O 3.42Å; I283-T307 HydrophobicContact CG2-CG2 4.39Å
284	L	98.4	Very high	96.4	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	115.8	174.9	176.3	59.2	0	0	0	109.2	L260 F275 L281 L286 W302 L305 T307 I308 G309	L260-L284 HydrophobicContact CB-CD1 4.37Å; L260-L284 HydrophobicContact CD2-CD1 4.25Å; L260-L284 HydrophobicContact CG-CD1 4.31Å; F275-L284 HydrophobicContact CD1-CD2 4.39Å; F275-L284 HydrophobicContact CE1-CD1 4.12Å; F275-L284 HydrophobicContact CE1-CD2 3.59Å; F275-L284 HydrophobicContact CZ-CD2 4.2Å; L281-L284 HydrophobicContact CD2-CB 4.02Å; L281-L284 HydrophobicContact CD2-CD1 4.24Å; L281-L284 HydrophobicContact CD2-CD2 4.48Å; L281-L284 HydrophobicContact CD2-CG 4.48Å; L284-L286 HydrophobicContact CD1-CD1 4.1Å; L284-L286 HydrophobicContact CD1-CG 4.02Å; L284-L286 HydrophobicContact CD2-CD1 3.8Å; L284-L286 HydrophobicContact CG-CD1 3.83Å; L284-L286 HydrophobicContact CG-CG 4.09Å; L284-W302 HydrophobicContact CD2-CD2 4.23Å; L284-W302 HydrophobicContact CD2-CH2 4.21Å; L284-W302 HydrophobicContact CD2-CZ2 3.6Å; L284-L305 HydrophobicContact CB-CD1 4.05Å; L284-L305 HydrophobicContact CB-CD2 3.7Å; L284-L305 HydrophobicContact CD2-CD1 4.13Å; L284-T307 PolarHBondContact N-O 2.97Å; L284-T307 VanDerWaalsContact N-O 3.07Å; L284-I308 HydrophobicContact CB-CD1 4.12Å; L284-I308 HydrophobicContact CD2-CD1 4.05Å; L284-I308 HydrophobicContact CG-CD1 4.1Å; L284-I308 CarbonylContact O-C 3.57Å; L284-I308 WeakPolarHBondContact O-CA 3.43Å; L284-G309 PolarHBondContact O-N 2.86Å
285	L	98.6	Very high	96.4	Very high	29 Å²	29	38.7 Å²	38.7	15%	0.152	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	116.4	177.4	-55	178.5	0	0	0	109.7	L260 L262 T263 I283	L260-L285 PolarHBondContact O-N 2.89Å; L262-L285 CarbonylContact C-O 3.51Å; L262-L285 WeakPolarHBondContact CA-O 3.23Å; L262-L285 WeakPolarHBondContact CB-O 3.26Å; L262-L285 PolarHBondContact N-O 3.36Å; T263-L285 PolarHBondContact N-O 3.27Å; T263-L285 WeakPolarHBondContact OG1-CB 3.45Å; I283-L285 HydrophobicContact CG2-CD2 4.27Å; I283-L285 HydrophobicContact CG2-CG 4.12Å
286	L	98.1	Very high	96.4	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	22%	0.217	C	C	.	.			trans	-124	13.1	-179.2	-70.8	160.9	0	0	0	111.5	L262 I267 L270 L284 N289 L291 W302 G309 L310 N313	L262-L286 HydrophobicContact CB-CD2 3.99Å; L262-L286 HydrophobicContact CD1-CD2 3.91Å; I267-L286 HydrophobicContact CD1-CD2 4.19Å; L270-L286 HydrophobicContact CD1-CD1 3.63Å; L270-L286 HydrophobicContact CD1-CD2 4.19Å; L284-L286 HydrophobicContact CD1-CD1 4.1Å; L284-L286 HydrophobicContact CD1-CG 4.02Å; L284-L286 HydrophobicContact CD2-CD1 3.8Å; L284-L286 HydrophobicContact CG-CD1 3.83Å; L284-L286 HydrophobicContact CG-CG 4.09Å; L286-N289 WeakPolarHBondContact O-CB 3.38Å; L286-N289 PolarHBondContact O-ND2 3.34Å; L286-L291 HydrophobicContact CB-CD1 4.29Å; L286-L291 HydrophobicContact CD1-CD1 4.43Å; L286-W302 HydrophobicContact CD1-CH2 4.06Å; L286-W302 HydrophobicContact CD1-CZ2 4.1Å; L286-G309 CarbonylContact C-O 3.17Å; L286-G309 WeakPolarHBondContact CA-O 3.46Å; L286-G309 WeakPolarHBondContact CB-O 3.23Å; L286-G309 PolarHBondContact N-O 2.87Å; L286-L310 HydrophobicContact CB-CD2 4.1Å; L286-L310 HydrophobicContact CD1-CD2 4.08Å; L286-N313 PolarHBondContact O-ND2 2.83Å
287	D	98.4	Very high	96.6	Very high	18 Å²	18	39.6 Å²	39.6	10%	0.096	21%	0.21	C	C	.	.			trans	-57.8	152.2	-180	-52.4	-90.1	0	0	0	112.3	T263 G264 N289 G309 L310 S311	T263-D287 CarbonylContact C-O 3.48Å; T263-D287 WeakPolarHBondContact CA-O 3.36Å; T263-D287 HydrophobicContact CG2-CB 4.15Å; G264-D287 PolarHBondContact N-O 2.89Å; D287-N289 VanDerWaalsContact C-N 3.3Å; D287-N289 PolarHBondContact O-N 2.96Å; D287-N289 PolarHBondContact O-ND2 3.48Å; D287-G309 VanDerWaalsContact CG-C 3.47Å; D287-G309 PolarHBondContact N-O 3.02Å; D287-G309 VanDerWaalsContact OD1-C 3.32Å; D287-G309 VanDerWaalsContact OD2-C 3.27Å; D287-G309 WeakPolarHBondContact OD2-CA 3.17Å; D287-L310 PolarHBondContact OD1-N 2.78Å; D287-S311 CarbonylContact C-O 3.51Å; D287-S311 VanDerWaalsContact CA-O 3.28Å; D287-S311 WeakPolarHBondContact CA-O 3.42Å; D287-S311 WeakPolarHBondContact OD1-CB 3.41Å; D287-S311 PolarHBondContact OD1-N 2.64Å; D287-S311 PolarHBondContact OD1-OG 2.91Å
288	N	98.1	Very high	96.6	Very high	69 Å²	69	39.3 Å²	39.3	37%	0.369	21%	0.208	S	C	.	.	S	Bend	trans	52.4	46.1	178.9	-169	43.4	0	0	0	113.1	W240 G264 N265 S311 S312	W240-N288 WeakPolarHBondContact CH2-ND2 3.27Å; W240-N288 WeakPolarHBondContact CZ3-ND2 3.33Å; G264-N288 CarbonylContact C-O 3.05Å; G264-N288 WeakPolarHBondContact CA-O 3.49Å; G264-N288 PolarHBondContact N-O 2.93Å; N265-N288 PolarHBondContact N-O 3.07Å; N288-S311 PolarHBondContact N-O 2.86Å; N288-S312 WeakPolarHBondContact CA-O 3.47Å
289	N	98.6	Very high	96.7	Very high	6 Å²	6	39.3 Å²	39.3	3%	0.032	21%	0.208	C	C	.	.	S	Bend	trans	-109.7	-166.6	171.4	-87.9	-88.3	0	0	0	110.6	L262 N265 I267 L286 D287 L291 N313	L262-N289 PolarHBondContact O-ND2 3.03Å; N265-N289 WeakPolarHBondContact CA-OD1 3.38Å; N265-N289 WeakPolarHBondContact CB-OD1 3.4Å; N265-N289 PolarHBondContact O-OD1 3.47Å; I267-N289 HydrophobicContact CB-CB 4.5Å; I267-N289 WeakPolarHBondContact CB-OD1 3.49Å; I267-N289 VanDerWaalsContact CG1-OD1 3.32Å; I267-N289 WeakPolarHBondContact CG1-OD1 3.28Å; I267-N289 PolarHBondContact N-OD1 3.39Å; I267-N289 VanDerWaalsContact N-OD1 3.14Å; L286-N289 WeakPolarHBondContact O-CB 3.38Å; L286-N289 PolarHBondContact O-ND2 3.34Å; D287-N289 VanDerWaalsContact C-N 3.3Å; D287-N289 PolarHBondContact O-N 2.96Å; D287-N289 PolarHBondContact O-ND2 3.48Å; N289-L291 HydrophobicContact CB-CG 4.38Å; N289-N313 VanDerWaalsContact CA-OD1 3.32Å; N289-N313 WeakPolarHBondContact CA-OD1 3.45Å; N289-N313 WeakPolarHBondContact CB-OD1 3.38Å; N289-N313 PolarHBondContact N-OD1 2.82Å; N289-N313 PolarHBondContact O-OD1 3.28Å
290	K	97.9	Very high	96.6	Very high	74 Å²	74	41.2 Å²	41.2	32%	0.322	22%	0.215	S	C	.	.			trans	-117	26	-175.7	-59	-177.7	-176.2	-177.5	0	112	E266 I267 R268 N313 L314	E266-K290 HydrophobicContact CB-CD 4.16Å; E266-K290 HydrophobicContact CG-CD 4.49Å; E266-K290 IonicContact OE2-NZ 2.83Å; E266-K290 PolarHBondContact OE2-NZ 2.86Å; I267-K290 CarbonylContact O-C 3.55Å; I267-K290 VanDerWaalsContact O-CA 3.22Å; I267-K290 WeakPolarHBondContact O-CA 3.43Å; I267-K290 WeakPolarHBondContact O-CB 3.15Å; I267-K290 PolarHBondContact O-N 3.35Å; R268-K290 WeakPolarHBondContact CA-O 3.47Å; R268-K290 HydrophobicContact CG-CB 3.97Å; K290-N313 PolarHBondContact N-OD1 3.3Å; K290-L314 HydrophobicContact CB-CD1 3.97Å; K290-L314 HydrophobicContact CG-CD1 4.29Å
291	L	97.5	Very high	96.5	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.213	C	C	.	.			trans	-69.4	134.7	177.7	-56	172.7	0	0	0	109.8	I267 L270 L286 N289 L310 N313 L314 W315	I267-L291 HydrophobicContact CB-CD2 4.46Å; I267-L291 HydrophobicContact CG2-CD2 3.89Å; I267-L291 PolarHBondContact O-N 3.16Å; L270-L291 HydrophobicContact CD1-CD1 4.35Å; L270-L291 HydrophobicContact CD1-CD2 4.4Å; L270-L291 HydrophobicContact CG-CD2 4.11Å; L286-L291 HydrophobicContact CB-CD1 4.29Å; L286-L291 HydrophobicContact CD1-CD1 4.43Å; N289-L291 HydrophobicContact CB-CG 4.38Å; L291-L310 HydrophobicContact CD1-CD2 4.46Å; L291-N313 HydrophobicContact CB-CB 4.35Å; L291-N313 VanDerWaalsContact CB-OD1 3.29Å; L291-N313 WeakPolarHBondContact CB-OD1 3.46Å; L291-N313 WeakPolarHBondContact CG-OD1 3.49Å; L291-N313 PolarHBondContact N-OD1 3.5Å; L291-N313 VanDerWaalsContact N-OD1 3.08Å; L291-L314 CarbonylContact O-C 3.11Å; L291-L314 VanDerWaalsContact O-C 3.24Å; L291-L314 WeakPolarHBondContact O-CA 3.3Å; L291-L314 PolarHBondContact O-N 2.95Å; L291-W315 HydrophobicContact CB-CH2 3.59Å; L291-W315 HydrophobicContact CB-CZ2 4.19Å; L291-W315 HydrophobicContact CB-CZ3 3.84Å; L291-W315 HydrophobicContact CD1-CH2 3.81Å; L291-W315 HydrophobicContact CD1-CZ2 4.24Å; L291-W315 HydrophobicContact CG-CH2 4.35Å
292	S	96.3	Very high	96.4	Very high	46 Å²	46	41.2 Å²	41.2	32%	0.322	21%	0.213	S	C	.	.			trans	-107.9	-30	174.6	59.8	0	0	0	0	113.3	L314 E316	S292-L314 WeakPolarHBondContact CA-O 3.36Å; S292-E316 PolarHBondContact O-N 2.9Å
293	S	95.3	Very high	96	Very high	39 Å²	39	45.2 Å²	45.2	27%	0.273	23%	0.233	S	C	.	.			trans	-158.9	160.7	-179.6	53.1	0	0	0	0	109.5
294	L	95.8	Very high	95.9	Very high	9 Å²	9	45.6 Å²	45.6	5%	0.047	24%	0.24	C	C	.	.			trans	-122.2	137.2	174	-68.8	171.1	0	0	0	110.1	L270 L299 W302 L310 W315 L324	L270-L294 HydrophobicContact CB-CD2 4.38Å; L270-L294 HydrophobicContact CD1-CD2 3.95Å; L270-L294 HydrophobicContact CG-CD2 4.5Å; L294-L299 HydrophobicContact CB-CD2 4.21Å; L294-L299 HydrophobicContact CB-CG 4.35Å; L294-L299 HydrophobicContact CD1-CD2 3.92Å; L294-W302 HydrophobicContact CD1-CH2 3.56Å; L294-W302 HydrophobicContact CD1-CZ3 3.92Å; L294-L310 HydrophobicContact CD1-CD2 4.4Å; L294-W315 HydrophobicContact CD1-CH2 3.84Å; L294-W315 HydrophobicContact CD1-CZ3 4.3Å; L294-W315 HydrophobicContact CG-CH2 3.91Å; L294-W315 HydrophobicContact CG-CZ3 3.98Å; L294-L324 HydrophobicContact CD1-CD1 4.16Å; L294-L324 HydrophobicContact CD1-CD2 4.34Å
295	E	93.5	Very high	95.8	Very high	105 Å²	105	46.4 Å²	46.4	49%	0.491	24%	0.244	S	C	.	.			trans	-73.8	142.5	175.6	-62.2	-176.3	170.5	0	0	110	Q297 V298 L299	E295-Q297 PolarHBondContact O-N 2.86Å; E295-V298 HydrophobicContact CB-CG2 4.37Å; E295-V298 WeakPolarHBondContact O-CB 3Å; E295-V298 PolarHBondContact O-N 2.97Å; E295-L299 PolarHBondContact O-N 2.9Å
296	P	93.9	Very high	95.7	Very high	58 Å²	58	47.8 Å²	47.8	38%	0.377	26%	0.257	S	S	.	.	H	α-helix	trans	-49.1	-43.8	177.7	-27.1	33.2	0	0	0	112.9	V298 L299 D300	P296-V298 PolarHBondContact O-N 3.15Å; P296-V298 VanDerWaalsContact O-N 3.08Å; P296-L299 WeakPolarHBondContact O-CA 3.3Å; P296-L299 WeakPolarHBondContact O-CB 3.04Å; P296-L299 PolarHBondContact O-N 2.8Å; P296-D300 PolarHBondContact O-N 3.43Å
297	Q	94.9	Very high	95.7	Very high	103 Å²	103	48.2 Å²	48.2	48%	0.481	26%	0.259	S	S	.	.	H	α-helix	trans	-61.4	-20.8	-178.5	-61.6	88.6	-24.5	0	0	113.9	P272 E295 M301	P272-Q297 HydrophobicContact CB-CB 4.34Å; P272-Q297 HydrophobicContact CG-CB 3.65Å; E295-Q297 PolarHBondContact O-N 2.86Å; Q297-M301 WeakPolarHBondContact O-CG 3.49Å
298	V	95.4	Very high	95.7	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-80.1	-43.1	172.4	178.2	0	0	0	0	110.3	L270 P272 F275 E295 P296 D300 M301 W302	L270-V298 HydrophobicContact CB-CG1 4.18Å; L270-V298 HydrophobicContact CB-CG2 4.48Å; L270-V298 WeakPolarHBondContact O-CG2 3.46Å; P272-V298 HydrophobicContact CG-CG2 3.96Å; F275-V298 HydrophobicContact CD2-CG1 3.91Å; F275-V298 HydrophobicContact CE2-CG1 4.02Å; E295-V298 HydrophobicContact CB-CG2 4.37Å; E295-V298 WeakPolarHBondContact O-CB 3Å; E295-V298 PolarHBondContact O-N 2.97Å; P296-V298 PolarHBondContact O-N 3.15Å; P296-V298 VanDerWaalsContact O-N 3.08Å; V298-D300 VanDerWaalsContact C-N 3.34Å; V298-M301 PolarHBondContact O-N 3.32Å; V298-W302 HydrophobicContact CG1-CZ2 3.75Å; V298-W302 VanDerWaalsContact O-CD1 3.3Å; V298-W302 PolarHBondContact O-NE1 3.24Å
299	L	95.3	Very high	95.7	Very high	6 Å²	6	44.2 Å²	44.2	3%	0.031	24%	0.238	C	C	.	.	H	α-helix	trans	-66.2	-36.6	178.8	-57.8	172.3	0	0	0	111.7	L294 E295 P296 M301 W302 S323 L324 W327	L294-L299 HydrophobicContact CB-CD2 4.21Å; L294-L299 HydrophobicContact CB-CG 4.35Å; L294-L299 HydrophobicContact CD1-CD2 3.92Å; E295-L299 PolarHBondContact O-N 2.9Å; P296-L299 WeakPolarHBondContact O-CA 3.3Å; P296-L299 WeakPolarHBondContact O-CB 3.04Å; P296-L299 PolarHBondContact O-N 2.8Å; L299-M301 PolarHBondContact O-N 3.15Å; L299-W302 HydrophobicContact CD2-CE3 3.73Å; L299-W302 HydrophobicContact CD2-CH2 4.33Å; L299-W302 HydrophobicContact CD2-CZ3 3.62Å; L299-W302 WeakPolarHBondContact O-CB 3.35Å; L299-W302 PolarHBondContact O-N 3.38Å; L299-S323 WeakPolarHBondContact CD1-O 3.39Å; L299-L324 HydrophobicContact CD1-CB 4.48Å; L299-L324 HydrophobicContact CD2-CD1 4.16Å; L299-W327 HydrophobicContact CB-CB 4.47Å; L299-W327 HydrophobicContact CB-CG 4.13Å; L299-W327 HydrophobicContact CD1-CB 4.09Å; L299-W327 HydrophobicContact CD2-CB 4.42Å; L299-W327 HydrophobicContact CD2-CD2 4.26Å; L299-W327 HydrophobicContact CD2-CG 4.15Å; L299-W327 PolarHBondContact O-NE1 2.89Å
300	D	93.6	Very high	95.7	Very high	95 Å²	95	43.9 Å²	43.9	51%	0.508	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-22.6	176.7	-65.3	-32.4	0	0	0	113.1	P296 V298 Q303	P296-D300 PolarHBondContact O-N 3.43Å; V298-D300 VanDerWaalsContact C-N 3.34Å; D300-Q303 WeakPolarHBondContact O-CG 3.36Å; D300-Q303 PolarHBondContact O-NE2 3.44Å
301	M	93.9	Very high	95.7	Very high	68 Å²	68	40.8 Å²	40.8	34%	0.335	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85	-15.3	175.2	-59.7	-61.3	100.7	0	0	112.9	F275 Q276 Q297 V298 L299 Q303	F275-M301 HydrophobicContact CB-CB 3.63Å; F275-M301 HydrophobicContact CB-CG 4.22Å; Q276-M301 HydrophobicContact CB-SD 4.13Å; Q297-M301 WeakPolarHBondContact O-CG 3.49Å; V298-M301 PolarHBondContact O-N 3.32Å; L299-M301 PolarHBondContact O-N 3.15Å; M301-Q303 PolarHBondContact O-N 2.81Å
302	W	94	Very high	95.7	Very high	11 Å²	11	44.5 Å²	44.5	4%	0.042	25%	0.25	C	S	.	.			trans	-83.5	43	-172.6	-68.6	-2.4	0	0	0	113.4	L270 F275 L284 L286 L294 V298 L299 L305 I308 L310 W327	L270-W302 HydrophobicContact CD1-CZ2 4.12Å; F275-W302 AromaticContact CD1-CD1 3.73Å; F275-W302 AromaticContact CD1-NE1 3.19Å; F275-W302 AromaticContact CD2-NE1 3.82Å; F275-W302 HydrophobicContact CE1-CZ2 4.48Å; F275-W302 AromaticContact CE1-NE1 3.45Å; F275-W302 AromaticContact CG-CD1 3.91Å; F275-W302 AromaticContact CG-NE1 3.39Å; F275-W302 HydrophobicContact CZ-CZ2 4.3Å; F275-W302 AromaticContact CZ-NE1 3.87Å; L284-W302 HydrophobicContact CD2-CD2 4.23Å; L284-W302 HydrophobicContact CD2-CH2 4.21Å; L284-W302 HydrophobicContact CD2-CZ2 3.6Å; L286-W302 HydrophobicContact CD1-CH2 4.06Å; L286-W302 HydrophobicContact CD1-CZ2 4.1Å; L294-W302 HydrophobicContact CD1-CH2 3.56Å; L294-W302 HydrophobicContact CD1-CZ3 3.92Å; V298-W302 HydrophobicContact CG1-CZ2 3.75Å; V298-W302 VanDerWaalsContact O-CD1 3.3Å; V298-W302 PolarHBondContact O-NE1 3.24Å; L299-W302 HydrophobicContact CD2-CE3 3.73Å; L299-W302 HydrophobicContact CD2-CH2 4.33Å; L299-W302 HydrophobicContact CD2-CZ3 3.62Å; L299-W302 WeakPolarHBondContact O-CB 3.35Å; L299-W302 PolarHBondContact O-N 3.38Å; W302-L305 HydrophobicContact CB-CD1 3.77Å; W302-L305 HydrophobicContact CB-CG 4.21Å; W302-L305 HydrophobicContact CD2-CD1 4Å; W302-L305 HydrophobicContact CE3-CD1 4.18Å; W302-L305 HydrophobicContact CG-CD1 3.85Å; W302-I308 HydrophobicContact CE3-CD1 4.32Å; W302-I308 HydrophobicContact CH2-CD1 4.29Å; W302-I308 HydrophobicContact CZ3-CD1 3.94Å; W302-L310 HydrophobicContact CH2-CD2 4.37Å; W302-L310 HydrophobicContact CZ3-CD1 4.49Å; W302-W327 HydrophobicContact CB-CZ2 3.86Å; W302-W327 AromaticContact CE3-CH2 3.91Å; W302-W327 HydrophobicContact CE3-CH2 3.91Å; W302-W327 AromaticContact CE3-CZ2 3.76Å; W302-W327 HydrophobicContact CE3-CZ2 3.76Å; W302-W327 HydrophobicContact CE3-CZ3 4.36Å
303	Q	90.1	Very high	95.8	Very high	166 Å²	166	42.7 Å²	42.7	78%	0.776	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.7	-27.8	-168.7	-57.5	-178.7	10.2	0	0	113.9	D300 M301	D300-Q303 WeakPolarHBondContact O-CG 3.36Å; D300-Q303 PolarHBondContact O-NE2 3.44Å; M301-Q303 PolarHBondContact O-N 2.81Å
304	S	95.4	Very high	95.9	Very high	55 Å²	55	44 Å²	44	39%	0.385	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.5	-0.7	-174	-62.4	0	0	0	0	114.5	P279 L281 S306	P279-S304 WeakPolarHBondContact O-CB 3.49Å; P279-S304 PolarHBondContact O-OG 3.37Å; L281-S304 CarbonylContact O-C 3.53Å; L281-S304 VanDerWaalsContact O-CB 3.26Å; L281-S304 WeakPolarHBondContact O-CB 3.5Å; S304-S306 PolarHBondContact O-N 2.9Å
305	L	97.3	Very high	96	Very high	17 Å²	17	43.6 Å²	43.6	9%	0.089	24%	0.238	C	C	.	.			trans	-69.5	129.8	-174.8	-69.3	-174.4	0	0	0	112.4	L281 L284 W302 I308 W327 F331	L281-L305 HydrophobicContact CB-CD2 4.42Å; L281-L305 HydrophobicContact CD2-CD2 4.14Å; L281-L305 HydrophobicContact CG-CD2 4Å; L281-L305 PolarHBondContact O-N 3.04Å; L284-L305 HydrophobicContact CB-CD1 4.05Å; L284-L305 HydrophobicContact CB-CD2 3.7Å; L284-L305 HydrophobicContact CD2-CD1 4.13Å; W302-L305 HydrophobicContact CB-CD1 3.77Å; W302-L305 HydrophobicContact CB-CG 4.21Å; W302-L305 HydrophobicContact CD2-CD1 4Å; W302-L305 HydrophobicContact CE3-CD1 4.18Å; W302-L305 HydrophobicContact CG-CD1 3.85Å; L305-I308 HydrophobicContact CD1-CD1 3.97Å; L305-W327 HydrophobicContact CD1-CH2 4.34Å; L305-W327 HydrophobicContact CD1-CZ2 4.35Å; L305-F331 HydrophobicContact CB-CE2 3.88Å; L305-F331 HydrophobicContact CB-CZ 4.07Å; L305-F331 VanDerWaalsContact O-CE2 3.28Å; L305-F331 WeakPolarHBondContact O-CE2 3.27Å
306	S	97.3	Very high	96.2	Very high	59 Å²	59	40.5 Å²	40.5	41%	0.413	22%	0.224	S	C	.	.	S	Bend	trans	-105.9	-24.4	167.8	68.6	0	0	0	0	112.6	K282 S304 G333 R334	K282-S306 PolarHBondContact O-N 2.68Å; K282-S306 PolarHBondContact O-OG 3.44Å; S304-S306 PolarHBondContact O-N 2.9Å; S306-G333 CarbonylContact O-C 3.08Å; S306-G333 WeakPolarHBondContact O-CA 3.37Å; S306-R334 PolarHBondContact O-N 3.15Å
307	T	98.3	Very high	96.3	Very high	8 Å²	8	37.8 Å²	37.8	5%	0.049	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	127.5	176.7	-52.3	0	0	0	0	110.1	K282 I283 L284 R334	K282-T307 PolarHBondContact O-N 2.98Å; I283-T307 WeakPolarHBondContact CA-O 3.42Å; I283-T307 HydrophobicContact CG2-CG2 4.39Å; L284-T307 PolarHBondContact N-O 2.97Å; L284-T307 VanDerWaalsContact N-O 3.07Å; T307-R334 WeakPolarHBondContact CA-O 3.49Å; T307-R334 HydrophobicContact CG2-CG 4.25Å
308	I	98.1	Very high	96.3	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	141.2	177.3	-175	58.6	0	0	0	109.3	L284 W302 L305 L310 W327 F331 R334 W335	L284-I308 HydrophobicContact CB-CD1 4.12Å; L284-I308 HydrophobicContact CD2-CD1 4.05Å; L284-I308 HydrophobicContact CG-CD1 4.1Å; L284-I308 CarbonylContact O-C 3.57Å; L284-I308 WeakPolarHBondContact O-CA 3.43Å; W302-I308 HydrophobicContact CE3-CD1 4.32Å; W302-I308 HydrophobicContact CH2-CD1 4.29Å; W302-I308 HydrophobicContact CZ3-CD1 3.94Å; L305-I308 HydrophobicContact CD1-CD1 3.97Å; I308-L310 HydrophobicContact CD1-CD1 4.21Å; I308-L310 HydrophobicContact CD1-CD2 4.35Å; I308-L310 HydrophobicContact CD1-CG 4.05Å; I308-L310 HydrophobicContact CG1-CD1 3.68Å; I308-L310 HydrophobicContact CG1-CG 3.8Å; I308-W327 HydrophobicContact CB-CH2 4.18Å; I308-W327 HydrophobicContact CB-CZ3 4.49Å; I308-W327 HydrophobicContact CG1-CH2 4.07Å; I308-W327 HydrophobicContact CG1-CZ3 4.17Å; I308-W327 HydrophobicContact CG2-CH2 4.2Å; I308-W327 HydrophobicContact CG2-CZ3 4.16Å; I308-F331 HydrophobicContact CB-CE1 4.2Å; I308-F331 HydrophobicContact CB-CZ 4.19Å; I308-F331 HydrophobicContact CG2-CD1 3.99Å; I308-F331 HydrophobicContact CG2-CE1 3.42Å; I308-F331 VanDerWaalsContact CG2-CE1 3.42Å; I308-F331 HydrophobicContact CG2-CZ 3.91Å; I308-R334 PolarHBondContact N-O 3.46Å; I308-W335 HydrophobicContact CG2-CB 4.16Å; I308-W335 HydrophobicContact CG2-CE3 3.92Å; I308-W335 VanDerWaalsContact O-CA 3.27Å; I308-W335 WeakPolarHBondContact O-CA 3.45Å; I308-W335 WeakPolarHBondContact O-CB 3.25Å
309	G	98.2	Very high	96.1	Very high	3 Å²	3	42.5 Å²	42.5	3%	0.031	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	120.8	174.7	0	0	0	0	0	110.4	L284 L286 D287	L284-G309 PolarHBondContact O-N 2.86Å; L286-G309 CarbonylContact C-O 3.17Å; L286-G309 WeakPolarHBondContact CA-O 3.46Å; L286-G309 WeakPolarHBondContact CB-O 3.23Å; L286-G309 PolarHBondContact N-O 2.87Å; D287-G309 VanDerWaalsContact CG-C 3.47Å; D287-G309 PolarHBondContact N-O 3.02Å; D287-G309 VanDerWaalsContact OD1-C 3.32Å; D287-G309 VanDerWaalsContact OD2-C 3.27Å; D287-G309 WeakPolarHBondContact OD2-CA 3.17Å
310	L	98.1	Very high	95.9	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	25%	0.254	C	S	.	.			trans	-142	4.1	-172.6	-70.9	169.8	0	0	0	113.6	L286 D287 L291 L294 W302 I308 N313 W315 L324 I339	L286-L310 HydrophobicContact CB-CD2 4.1Å; L286-L310 HydrophobicContact CD1-CD2 4.08Å; D287-L310 PolarHBondContact OD1-N 2.78Å; L291-L310 HydrophobicContact CD1-CD2 4.46Å; L294-L310 HydrophobicContact CD1-CD2 4.4Å; W302-L310 HydrophobicContact CH2-CD2 4.37Å; W302-L310 HydrophobicContact CZ3-CD1 4.49Å; I308-L310 HydrophobicContact CD1-CD1 4.21Å; I308-L310 HydrophobicContact CD1-CD2 4.35Å; I308-L310 HydrophobicContact CD1-CG 4.05Å; I308-L310 HydrophobicContact CG1-CD1 3.68Å; I308-L310 HydrophobicContact CG1-CG 3.8Å; L310-N313 PolarHBondContact O-ND2 3Å; L310-W315 HydrophobicContact CB-CZ2 3.99Å; L310-W315 HydrophobicContact CD2-CH2 4.12Å; L310-W315 HydrophobicContact CD2-CZ2 3.76Å; L310-W315 HydrophobicContact CG-CZ2 4.32Å; L310-W315 PolarHBondContact O-NE1 3.03Å; L310-L324 HydrophobicContact CD1-CD1 3.97Å; L310-I339 HydrophobicContact CB-CD1 4.05Å; L310-I339 HydrophobicContact CB-CG1 4.28Å; L310-I339 HydrophobicContact CB-CG2 4.02Å; L310-I339 HydrophobicContact CD1-CD1 4.34Å
311	S	97.8	Very high	96	Very high	9 Å²	9	45 Å²	45	6%	0.063	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.2	164.4	-178.7	69.1	0	0	0	0	112.4	D287 N288 N313 H337 S338	D287-S311 CarbonylContact C-O 3.51Å; D287-S311 VanDerWaalsContact CA-O 3.28Å; D287-S311 WeakPolarHBondContact CA-O 3.42Å; D287-S311 WeakPolarHBondContact OD1-CB 3.41Å; D287-S311 PolarHBondContact OD1-N 2.64Å; D287-S311 PolarHBondContact OD1-OG 2.91Å; N288-S311 PolarHBondContact N-O 2.86Å; S311-N313 PolarHBondContact O-N 2.61Å; S311-N313 PolarHBondContact O-ND2 2.88Å; S311-N313 VanDerWaalsContact O-ND2 3.15Å; S311-H337 WeakPolarHBondContact OG-CB 3.18Å; S311-S338 VanDerWaalsContact CB-O 3.28Å; S311-S338 WeakPolarHBondContact CB-O 3.44Å
312	S	97.1	Very high	96.1	Very high	78 Å²	78	42.9 Å²	42.9	55%	0.545	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.5	27.5	176.9	-54.1	0	0	0	0	115.5	N288	N288-S312 WeakPolarHBondContact CA-O 3.47Å
313	N	98.1	Very high	96	Very high	7 Å²	7	44.3 Å²	44.3	4%	0.037	23%	0.234	C	C	.	.	S	Bend	trans	-92.3	177.2	170.4	-86.9	-86.8	0	0	0	111.1	L286 N289 K290 L291 L310 S311 W315	L286-N313 PolarHBondContact O-ND2 2.83Å; N289-N313 VanDerWaalsContact CA-OD1 3.32Å; N289-N313 WeakPolarHBondContact CA-OD1 3.45Å; N289-N313 WeakPolarHBondContact CB-OD1 3.38Å; N289-N313 PolarHBondContact N-OD1 2.82Å; N289-N313 PolarHBondContact O-OD1 3.28Å; K290-N313 PolarHBondContact N-OD1 3.3Å; L291-N313 HydrophobicContact CB-CB 4.35Å; L291-N313 VanDerWaalsContact CB-OD1 3.29Å; L291-N313 WeakPolarHBondContact CB-OD1 3.46Å; L291-N313 WeakPolarHBondContact CG-OD1 3.49Å; L291-N313 PolarHBondContact N-OD1 3.5Å; L291-N313 VanDerWaalsContact N-OD1 3.08Å; L310-N313 PolarHBondContact O-ND2 3Å; S311-N313 PolarHBondContact O-N 2.61Å; S311-N313 PolarHBondContact O-ND2 2.88Å; S311-N313 VanDerWaalsContact O-ND2 3.15Å; N313-W315 VanDerWaalsContact C-N 3.32Å; N313-W315 HydrophobicContact CB-CD2 4.17Å; N313-W315 HydrophobicContact CB-CG 4.36Å; N313-W315 HydrophobicContact CB-CZ2 3.82Å; N313-W315 PolarHBondContact O-N 3.37Å
314	L	97.5	Very high	96.3	Very high	68 Å²	68	36.5 Å²	36.5	36%	0.356	20%	0.197	S	C	.	.			trans	-95.6	39.7	-175	-57.8	176.9	0	0	0	112.2	K290 L291 S292 E316 H342	K290-L314 HydrophobicContact CB-CD1 3.97Å; K290-L314 HydrophobicContact CG-CD1 4.29Å; L291-L314 CarbonylContact O-C 3.11Å; L291-L314 VanDerWaalsContact O-C 3.24Å; L291-L314 WeakPolarHBondContact O-CA 3.3Å; L291-L314 PolarHBondContact O-N 2.95Å; S292-L314 WeakPolarHBondContact CA-O 3.36Å; L314-E316 PolarHBondContact O-N 2.88Å; L314-H342 VanDerWaalsContact C-CB 3.48Å
315	W	97.9	Very high	96.4	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	18%	0.179	C	C	.	.			trans	-53.3	122.9	-170.6	-63.8	123.4	0	0	0	113.7	L291 L294 L310 N313 C317 I321 L324 H342 S343 I352	L291-W315 HydrophobicContact CB-CH2 3.59Å; L291-W315 HydrophobicContact CB-CZ2 4.19Å; L291-W315 HydrophobicContact CB-CZ3 3.84Å; L291-W315 HydrophobicContact CD1-CH2 3.81Å; L291-W315 HydrophobicContact CD1-CZ2 4.24Å; L291-W315 HydrophobicContact CG-CH2 4.35Å; L294-W315 HydrophobicContact CD1-CH2 3.84Å; L294-W315 HydrophobicContact CD1-CZ3 4.3Å; L294-W315 HydrophobicContact CG-CH2 3.91Å; L294-W315 HydrophobicContact CG-CZ3 3.98Å; L310-W315 HydrophobicContact CB-CZ2 3.99Å; L310-W315 HydrophobicContact CD2-CH2 4.12Å; L310-W315 HydrophobicContact CD2-CZ2 3.76Å; L310-W315 HydrophobicContact CG-CZ2 4.32Å; L310-W315 PolarHBondContact O-NE1 3.03Å; N313-W315 VanDerWaalsContact C-N 3.32Å; N313-W315 HydrophobicContact CB-CD2 4.17Å; N313-W315 HydrophobicContact CB-CG 4.36Å; N313-W315 HydrophobicContact CB-CZ2 3.82Å; N313-W315 PolarHBondContact O-N 3.37Å; W315-C317 PolarHBondContact O-N 3.28Å; W315-I321 HydrophobicContact CB-CD1 4.17Å; W315-I321 HydrophobicContact CD2-CD1 4.38Å; W315-I321 HydrophobicContact CE3-CD1 3.93Å; W315-L324 HydrophobicContact CD2-CD2 4.21Å; W315-L324 HydrophobicContact CE3-CD2 3.95Å; W315-L324 HydrophobicContact CH2-CD2 3.98Å; W315-L324 HydrophobicContact CZ2-CD2 4.19Å; W315-L324 HydrophobicContact CZ3-CD2 3.84Å; W315-H342 PolarHBondContact O-N 3.44Å; W315-S343 PolarHBondContact O-N 3.03Å; W315-S343 VanDerWaalsContact O-N 3.1Å; W315-I352 HydrophobicContact CB-CD1 4.18Å; W315-I352 HydrophobicContact CD2-CD1 4.29Å; W315-I352 HydrophobicContact CG-CD1 3.86Å
316	E	97.2	Very high	96.3	Very high	40 Å²	40	36.8 Å²	36.8	19%	0.187	20%	0.198	C	C	.	.	B	Isolated β-bridge	trans	-91.8	91.3	177.6	-166.3	-149.8	130.3	0	0	109.1	S292 L314 T318 R320	S292-E316 PolarHBondContact O-N 2.9Å; L314-E316 PolarHBondContact O-N 2.88Å; E316-T318 HydrophobicContact CG-CG2 4.05Å; E316-T318 PolarHBondContact O-N 2.88Å; E316-T318 WeakPolarHBondContact OE1-CB 3.13Å; E316-T318 VanDerWaalsContact OE1-CG2 3.23Å; E316-T318 WeakPolarHBondContact OE1-CG2 3.44Å; E316-T318 PolarHBondContact OE1-OG1 2.9Å; E316-R320 IonicContact OE1-NH1 2.76Å; E316-R320 WeakPolarHBondContact OE2-CD 3.34Å; E316-R320 IonicContact OE2-CZ 3.34Å; E316-R320 IonicContact OE2-NE 4Å; E316-R320 IonicContact OE2-NH1 4Å; E316-R320 PolarHBondContact OE2-NH1 3.1Å
317	C	96.4	Very high	96.2	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	19%	0.185	C	C	.	.			trans	-76.7	62.5	179.4	-68.9	0	0	0	0	112.1	W315 C341 S343 P344 A347 L361	W315-C317 PolarHBondContact O-N 3.28Å; C317-C341 HydrophobicContact CB-CB 3.74Å; C317-C341 WeakPolarHBondContact CB-SG 3.29Å; C317-C341 VanDerWaalsContact SG-CA 3.52Å; C317-C341 WeakPolarHBondContact SG-CB 3.18Å; C317-C341 CovalentContact SG-SG 2.02Å; C317-C341 PolarHBondContact SG-SG 3.4Å; C317-S343 PolarHBondContact N-O 2.93Å; C317-P344 WeakPolarHBondContact O-CD 3.37Å; C317-A347 HydrophobicContact CB-CB 4.41Å; C317-L361 HydrophobicContact CB-CD1 4.23Å; C317-L361 VanDerWaalsContact O-CD1 3.31Å; C317-L361 WeakPolarHBondContact O-CD1 3.39Å
318	T	94.5	Very high	96.1	Very high	40 Å²	40	35.8 Å²	35.8	25%	0.245	18%	0.184	C	C	.	.	S	Bend	trans	-108.7	-166	162.7	69.4	0	0	0	0	108.8	E316 R320 I321	E316-T318 HydrophobicContact CG-CG2 4.05Å; E316-T318 PolarHBondContact O-N 2.88Å; E316-T318 WeakPolarHBondContact OE1-CB 3.13Å; E316-T318 VanDerWaalsContact OE1-CG2 3.23Å; E316-T318 WeakPolarHBondContact OE1-CG2 3.44Å; E316-T318 PolarHBondContact OE1-OG1 2.9Å; T318-R320 PolarHBondContact O-N 3.21Å; T318-R320 PolarHBondContact OG1-N 3.22Å; T318-I321 WeakPolarHBondContact O-CG2 3.49Å; T318-I321 PolarHBondContact O-N 3.16Å
319	K	92.2	Very high	96	Very high	162 Å²	162	38.1 Å²	38.1	70%	0.704	20%	0.201	S	C	*	.	G	3₁₀ helix	trans	-56.2	-14.8	173.6	-60.5	-167.9	173.3	-176.4	0	114.1	I321 C322	K319-I321 VanDerWaalsContact C-N 3.33Å; K319-C322 PolarHBondContact O-SG 3.33Å
320	R	91.8	Very high	95.8	Very high	152 Å²	152	41.5 Å²	41.5	57%	0.574	23%	0.228	S	C	*	.	G	3₁₀ helix	trans	-69.6	-25.1	174.4	-71	177.3	168.8	174.4	-5.7	113.9	E316 T318 C322	E316-R320 IonicContact OE1-NH1 2.76Å; E316-R320 WeakPolarHBondContact OE2-CD 3.34Å; E316-R320 IonicContact OE2-CZ 3.34Å; E316-R320 IonicContact OE2-NE 4Å; E316-R320 IonicContact OE2-NH1 4Å; E316-R320 PolarHBondContact OE2-NH1 3.1Å; T318-R320 PolarHBondContact O-N 3.21Å; T318-R320 PolarHBondContact OG1-N 3.22Å; R320-C322 VanDerWaalsContact C-N 3.29Å; R320-C322 PolarHBondContact O-N 3.3Å
321	I	95.4	Very high	95.7	Very high	1 Å²	1	43 Å²	43	1%	0.005	24%	0.235	C	C	.	.	G	3₁₀ helix	trans	-78.6	-13.7	-178	-146.2	68.2	0	0	0	112.9	W315 T318 K319 S323 L324 A325 I352 V356 L361	W315-I321 HydrophobicContact CB-CD1 4.17Å; W315-I321 HydrophobicContact CD2-CD1 4.38Å; W315-I321 HydrophobicContact CE3-CD1 3.93Å; T318-I321 WeakPolarHBondContact O-CG2 3.49Å; T318-I321 PolarHBondContact O-N 3.16Å; K319-I321 VanDerWaalsContact C-N 3.33Å; I321-S323 VanDerWaalsContact C-N 3.31Å; I321-S323 PolarHBondContact O-N 2.97Å; I321-L324 HydrophobicContact CD1-CD2 4.12Å; I321-L324 PolarHBondContact O-N 3.37Å; I321-A325 PolarHBondContact O-N 2.94Å; I321-I352 HydrophobicContact CD1-CD1 4.06Å; I321-I352 HydrophobicContact CG1-CD1 4.01Å; I321-I352 HydrophobicContact CG1-CG1 4.26Å; I321-I352 HydrophobicContact CG1-CG2 3.82Å; I321-I352 HydrophobicContact CG2-CG2 4.45Å; I321-V356 HydrophobicContact CG2-CG2 3.51Å; I321-L361 HydrophobicContact CG2-CD1 4.4Å
322	C	94.6	Very high	95.6	Very high	24 Å²	24	52.6 Å²	52.6	16%	0.162	28%	0.276	C	S	.	.	H	α-helix	trans	-58.4	-36.5	-171.4	-62.5	0	0	0	0	114.4	K319 R320 A325 T326 C362	K319-C322 PolarHBondContact O-SG 3.33Å; R320-C322 VanDerWaalsContact C-N 3.29Å; R320-C322 PolarHBondContact O-N 3.3Å; C322-A325 PolarHBondContact O-N 3.13Å; C322-T326 VanDerWaalsContact O-CB 3.31Å; C322-T326 WeakPolarHBondContact O-CB 3.19Å; C322-T326 PolarHBondContact O-N 2.98Å; C322-T326 PolarHBondContact O-OG1 3.3Å; C322-C362 WeakPolarHBondContact CA-SG 3.31Å; C322-C362 HydrophobicContact CB-CB 3.85Å; C322-C362 WeakPolarHBondContact CB-SG 3.1Å; C322-C362 WeakPolarHBondContact SG-CA 3.33Å; C322-C362 WeakPolarHBondContact SG-CB 3.48Å; C322-C362 CovalentContact SG-SG 2.03Å; C322-C362 PolarHBondContact SG-SG 2.83Å
323	S	93.8	Very high	95.5	Very high	42 Å²	42	50.4 Å²	50.4	29%	0.294	27%	0.265	S	S	.	.	H	α-helix	trans	-61.9	-46.8	175.6	-42.4	0	0	0	0	111.2	L299 I321 W327	L299-S323 WeakPolarHBondContact CD1-O 3.39Å; I321-S323 VanDerWaalsContact C-N 3.31Å; I321-S323 PolarHBondContact O-N 2.97Å; S323-W327 WeakPolarHBondContact O-CB 3.47Å; S323-W327 PolarHBondContact O-N 3.36Å
324	L	96.4	Very high	95.4	Very high	1 Å²	1	57.5 Å²	57.5	1%	0.005	29%	0.291	C	S	.	.	H	α-helix	trans	-68.2	-43	177.9	176	57.4	0	0	0	111.5	L294 L299 L310 W315 I321 T326 W327 L328 I352	L294-L324 HydrophobicContact CD1-CD1 4.16Å; L294-L324 HydrophobicContact CD1-CD2 4.34Å; L299-L324 HydrophobicContact CD1-CB 4.48Å; L299-L324 HydrophobicContact CD2-CD1 4.16Å; L310-L324 HydrophobicContact CD1-CD1 3.97Å; W315-L324 HydrophobicContact CD2-CD2 4.21Å; W315-L324 HydrophobicContact CE3-CD2 3.95Å; W315-L324 HydrophobicContact CH2-CD2 3.98Å; W315-L324 HydrophobicContact CZ2-CD2 4.19Å; W315-L324 HydrophobicContact CZ3-CD2 3.84Å; I321-L324 HydrophobicContact CD1-CD2 4.12Å; I321-L324 PolarHBondContact O-N 3.37Å; L324-T326 VanDerWaalsContact C-N 3.32Å; L324-T326 PolarHBondContact O-N 2.92Å; L324-W327 HydrophobicContact CD1-CE3 4.38Å; L324-W327 PolarHBondContact O-N 3.13Å; L324-L328 HydrophobicContact CD1-CD1 3.93Å; L324-L328 HydrophobicContact CD1-CD2 4.42Å; L324-L328 HydrophobicContact CD1-CG 3.85Å; L324-L328 HydrophobicContact CG-CD1 3.84Å; L324-L328 HydrophobicContact CG-CG 4.25Å; L324-L328 WeakPolarHBondContact O-CB 3.49Å; L324-L328 VanDerWaalsContact O-CG 3.27Å; L324-L328 WeakPolarHBondContact O-CG 3.42Å; L324-L328 PolarHBondContact O-N 3.09Å; L324-I352 HydrophobicContact CD2-CD1 4.03Å
325	A	96.3	Very high	95.3	Very high	0 Å²	0	58 Å²	58	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-62.4	-38.5	177.5	0	0	0	0	0	112.5	I321 C322 S329 I352 L353 V356 F365	I321-A325 PolarHBondContact O-N 2.94Å; C322-A325 PolarHBondContact O-N 3.13Å; A325-S329 PolarHBondContact O-N 3.49Å; A325-S329 PolarHBondContact O-OG 3.34Å; A325-I352 HydrophobicContact CB-CG2 3.9Å; A325-L353 HydrophobicContact CB-CD2 4.3Å; A325-L353 WeakPolarHBondContact O-CD2 3.37Å; A325-V356 HydrophobicContact CB-CB 4.41Å; A325-V356 HydrophobicContact CB-CG1 4.42Å; A325-V356 HydrophobicContact CB-CG2 3.81Å; A325-F365 HydrophobicContact CB-CE2 4.18Å; A325-F365 HydrophobicContact CB-CZ 4.48Å
326	T	94.8	Very high	95.1	Very high	78 Å²	78	64.4 Å²	64.4	48%	0.479	32%	0.319	S	S	.	.	H	α-helix	trans	-69.5	-37.9	175.5	-52.8	0	0	0	0	111.7	C322 L324 S329 A330	C322-T326 VanDerWaalsContact O-CB 3.31Å; C322-T326 WeakPolarHBondContact O-CB 3.19Å; C322-T326 PolarHBondContact O-N 2.98Å; C322-T326 PolarHBondContact O-OG1 3.3Å; L324-T326 VanDerWaalsContact C-N 3.32Å; L324-T326 PolarHBondContact O-N 2.92Å; T326-S329 PolarHBondContact O-OG 3.12Å; T326-A330 PolarHBondContact O-N 3.07Å
327	W	95.9	Very high	95	Very high	40 Å²	40	67.9 Å²	67.9	15%	0.152	34%	0.335	C	S	.	.	H	α-helix	trans	-66.6	-45.3	173.4	-175.1	92.3	0	0	0	111.5	L299 W302 L305 I308 S323 L324 S329 A330 F331	L299-W327 HydrophobicContact CB-CB 4.47Å; L299-W327 HydrophobicContact CB-CG 4.13Å; L299-W327 HydrophobicContact CD1-CB 4.09Å; L299-W327 HydrophobicContact CD2-CB 4.42Å; L299-W327 HydrophobicContact CD2-CD2 4.26Å; L299-W327 HydrophobicContact CD2-CG 4.15Å; L299-W327 PolarHBondContact O-NE1 2.89Å; W302-W327 HydrophobicContact CB-CZ2 3.86Å; W302-W327 AromaticContact CE3-CH2 3.91Å; W302-W327 HydrophobicContact CE3-CH2 3.91Å; W302-W327 AromaticContact CE3-CZ2 3.76Å; W302-W327 HydrophobicContact CE3-CZ2 3.76Å; W302-W327 HydrophobicContact CE3-CZ3 4.36Å; L305-W327 HydrophobicContact CD1-CH2 4.34Å; L305-W327 HydrophobicContact CD1-CZ2 4.35Å; I308-W327 HydrophobicContact CB-CH2 4.18Å; I308-W327 HydrophobicContact CB-CZ3 4.49Å; I308-W327 HydrophobicContact CG1-CH2 4.07Å; I308-W327 HydrophobicContact CG1-CZ3 4.17Å; I308-W327 HydrophobicContact CG2-CH2 4.2Å; I308-W327 HydrophobicContact CG2-CZ3 4.16Å; S323-W327 WeakPolarHBondContact O-CB 3.47Å; S323-W327 PolarHBondContact O-N 3.36Å; L324-W327 HydrophobicContact CD1-CE3 4.38Å; L324-W327 PolarHBondContact O-N 3.13Å; W327-S329 PolarHBondContact O-N 2.9Å; W327-A330 CarbonylContact O-C 3.28Å; W327-A330 PolarHBondContact O-N 3.06Å; W327-F331 HydrophobicContact CE3-CB 4.35Å; W327-F331 HydrophobicContact CH2-CB 4.46Å; W327-F331 HydrophobicContact CH2-CD1 4.32Å; W327-F331 AromaticContact CH2-CD2 3.33Å; W327-F331 HydrophobicContact CH2-CD2 3.33Å; W327-F331 HydrophobicContact CH2-CE1 4.39Å; W327-F331 AromaticContact CH2-CE2 3.47Å; W327-F331 HydrophobicContact CH2-CE2 3.47Å; W327-F331 VanDerWaalsContact CH2-CE2 3.47Å; W327-F331 AromaticContact CH2-CG 3.8Å; W327-F331 HydrophobicContact CH2-CG 3.8Å; W327-F331 HydrophobicContact CH2-CZ 4Å; W327-F331 AromaticContact CZ2-CD2 3.48Å; W327-F331 HydrophobicContact CZ2-CD2 3.48Å; W327-F331 VanDerWaalsContact CZ2-CD2 3.48Å; W327-F331 AromaticContact CZ2-CE2 3.69Å; W327-F331 HydrophobicContact CZ2-CE2 3.69Å; W327-F331 HydrophobicContact CZ2-CG 4.29Å; W327-F331 HydrophobicContact CZ3-CB 4.22Å; W327-F331 HydrophobicContact CZ3-CD1 4.39Å; W327-F331 AromaticContact CZ3-CD2 3.94Å; W327-F331 HydrophobicContact CZ3-CD2 3.94Å; W327-F331 HydrophobicContact CZ3-CE2 4.39Å; W327-F331 AromaticContact CZ3-CG 3.93Å; W327-F331 HydrophobicContact CZ3-CG 3.93Å; W327-F331 WeakPolarHBondContact O-CB 3.24Å; W327-F331 PolarHBondContact O-N 3.02Å
328	L	96.2	Very high	95	Very high	6 Å²	6	70.7 Å²	70.7	3%	0.031	35%	0.354	C	S	.	.	H	α-helix	trans	-62.3	-39.3	178.1	-73.8	171	0	0	0	112.7	L324 A330 F331 W335 I339 I352 L353	L324-L328 HydrophobicContact CD1-CD1 3.93Å; L324-L328 HydrophobicContact CD1-CD2 4.42Å; L324-L328 HydrophobicContact CD1-CG 3.85Å; L324-L328 HydrophobicContact CG-CD1 3.84Å; L324-L328 HydrophobicContact CG-CG 4.25Å; L324-L328 WeakPolarHBondContact O-CB 3.49Å; L324-L328 VanDerWaalsContact O-CG 3.27Å; L324-L328 WeakPolarHBondContact O-CG 3.42Å; L324-L328 PolarHBondContact O-N 3.09Å; L328-A330 VanDerWaalsContact C-N 3.28Å; L328-A330 PolarHBondContact O-N 2.8Å; L328-F331 PolarHBondContact O-N 3.31Å; L328-W335 HydrophobicContact CB-CH2 4.25Å; L328-W335 HydrophobicContact CB-CZ3 4.42Å; L328-W335 HydrophobicContact CD2-CE3 3.84Å; L328-W335 HydrophobicContact CD2-CH2 3.98Å; L328-W335 HydrophobicContact CD2-CZ3 3.51Å; L328-I339 HydrophobicContact CD1-CD1 4.07Å; L328-I339 HydrophobicContact CD2-CD1 3.66Å; L328-I352 HydrophobicContact CD1-CG2 4.42Å; L328-L353 HydrophobicContact CB-CD2 4.07Å
329	S	94.9	Very high	95.1	Very high	50 Å²	50	69 Å²	69	35%	0.35	34%	0.344	S	S	.	.	H	α-helix	trans	-72.6	-19.8	177.3	66	0	0	0	0	113.9	A325 T326 W327	A325-S329 PolarHBondContact O-N 3.49Å; A325-S329 PolarHBondContact O-OG 3.34Å; T326-S329 PolarHBondContact O-OG 3.12Å; W327-S329 PolarHBondContact O-N 2.9Å
330	A	95.1	Very high	95.3	Very high	73 Å²	73	63.4 Å²	63.4	60%	0.603	32%	0.323	S	S	*	.	H	α-helix	trans	-95	-12.8	173.5	0	0	0	0	0	113.8	T326 W327 L328 K332	T326-A330 PolarHBondContact O-N 3.07Å; W327-A330 CarbonylContact O-C 3.28Å; W327-A330 PolarHBondContact O-N 3.06Å; L328-A330 VanDerWaalsContact C-N 3.28Å; L328-A330 PolarHBondContact O-N 2.8Å; A330-K332 PolarHBondContact O-N 3.42Å
331	F	96.3	Very high	95.6	Very high	33 Å²	33	56.3 Å²	56.3	15%	0.145	30%	0.297	C	S	.	.			trans	-72.1	123	-173.3	-173.4	-114.1	0	0	0	111.9	L305 I308 W327 L328 G333 W335	L305-F331 HydrophobicContact CB-CE2 3.88Å; L305-F331 HydrophobicContact CB-CZ 4.07Å; L305-F331 VanDerWaalsContact O-CE2 3.28Å; L305-F331 WeakPolarHBondContact O-CE2 3.27Å; I308-F331 HydrophobicContact CB-CE1 4.2Å; I308-F331 HydrophobicContact CB-CZ 4.19Å; I308-F331 HydrophobicContact CG2-CD1 3.99Å; I308-F331 HydrophobicContact CG2-CE1 3.42Å; I308-F331 VanDerWaalsContact CG2-CE1 3.42Å; I308-F331 HydrophobicContact CG2-CZ 3.91Å; W327-F331 HydrophobicContact CE3-CB 4.35Å; W327-F331 HydrophobicContact CH2-CB 4.46Å; W327-F331 HydrophobicContact CH2-CD1 4.32Å; W327-F331 AromaticContact CH2-CD2 3.33Å; W327-F331 HydrophobicContact CH2-CD2 3.33Å; W327-F331 HydrophobicContact CH2-CE1 4.39Å; W327-F331 AromaticContact CH2-CE2 3.47Å; W327-F331 HydrophobicContact CH2-CE2 3.47Å; W327-F331 VanDerWaalsContact CH2-CE2 3.47Å; W327-F331 AromaticContact CH2-CG 3.8Å; W327-F331 HydrophobicContact CH2-CG 3.8Å; W327-F331 HydrophobicContact CH2-CZ 4Å; W327-F331 AromaticContact CZ2-CD2 3.48Å; W327-F331 HydrophobicContact CZ2-CD2 3.48Å; W327-F331 VanDerWaalsContact CZ2-CD2 3.48Å; W327-F331 AromaticContact CZ2-CE2 3.69Å; W327-F331 HydrophobicContact CZ2-CE2 3.69Å; W327-F331 HydrophobicContact CZ2-CG 4.29Å; W327-F331 HydrophobicContact CZ3-CB 4.22Å; W327-F331 HydrophobicContact CZ3-CD1 4.39Å; W327-F331 AromaticContact CZ3-CD2 3.94Å; W327-F331 HydrophobicContact CZ3-CD2 3.94Å; W327-F331 HydrophobicContact CZ3-CE2 4.39Å; W327-F331 AromaticContact CZ3-CG 3.93Å; W327-F331 HydrophobicContact CZ3-CG 3.93Å; W327-F331 WeakPolarHBondContact O-CB 3.24Å; W327-F331 PolarHBondContact O-N 3.02Å; L328-F331 PolarHBondContact O-N 3.31Å; F331-G333 VanDerWaalsContact CE1-C 3.44Å; F331-W335 HydrophobicContact CB-CZ3 4.35Å; F331-W335 AromaticContact CD1-CE3 3.97Å; F331-W335 HydrophobicContact CD1-CE3 3.97Å; F331-W335 AromaticContact CD1-CZ3 3.81Å; F331-W335 HydrophobicContact CD1-CZ3 3.81Å; F331-W335 HydrophobicContact CE1-CE3 4.45Å
332	K	94.8	Very high	95.8	Very high	210 Å²	210	60.2 Å²	60.2	91%	0.913	32%	0.315	S	S	*	.			trans	-93.9	0.9	-177.9	-61	-179.3	-177.9	175.8	0	114.1	A330	A330-K332 PolarHBondContact O-N 3.42Å
333	G	95.4	Very high	95.8	Very high	32 Å²	32	61 Å²	61	33%	0.33	32%	0.32	S	S	.	.	S	Bend	trans	-86.6	-151.1	175.5	0	0	0	0	0	112.1	S306 F331	S306-G333 CarbonylContact O-C 3.08Å; S306-G333 WeakPolarHBondContact O-CA 3.37Å; F331-G333 VanDerWaalsContact CE1-C 3.44Å
334	R	96	Very high	95.9	Very high	155 Å²	155	60.7 Å²	60.7	59%	0.585	32%	0.317	S	S	*	.	B	Isolated β-bridge	trans	-135.8	155.9	178.4	69	-169.9	-171.7	-170	9.1	113.2	S306 T307 I308	S306-R334 PolarHBondContact O-N 3.15Å; T307-R334 WeakPolarHBondContact CA-O 3.49Å; T307-R334 HydrophobicContact CG2-CG 4.25Å; I308-R334 PolarHBondContact N-O 3.46Å
335	W	96.4	Very high	95.9	Very high	78 Å²	78	69 Å²	69	30%	0.295	36%	0.356	S	S	.	.			trans	-127	144.5	163.2	50.9	83.3	0	0	0	109	I308 L328 F331 I339	I308-W335 HydrophobicContact CG2-CB 4.16Å; I308-W335 HydrophobicContact CG2-CE3 3.92Å; I308-W335 VanDerWaalsContact O-CA 3.27Å; I308-W335 WeakPolarHBondContact O-CA 3.45Å; I308-W335 WeakPolarHBondContact O-CB 3.25Å; L328-W335 HydrophobicContact CB-CH2 4.25Å; L328-W335 HydrophobicContact CB-CZ3 4.42Å; L328-W335 HydrophobicContact CD2-CE3 3.84Å; L328-W335 HydrophobicContact CD2-CH2 3.98Å; L328-W335 HydrophobicContact CD2-CZ3 3.51Å; F331-W335 HydrophobicContact CB-CZ3 4.35Å; F331-W335 AromaticContact CD1-CE3 3.97Å; F331-W335 HydrophobicContact CD1-CE3 3.97Å; F331-W335 AromaticContact CD1-CZ3 3.81Å; F331-W335 HydrophobicContact CD1-CZ3 3.81Å; F331-W335 HydrophobicContact CE1-CE3 4.45Å; W335-I339 HydrophobicContact CB-CD1 4.44Å; W335-I339 HydrophobicContact CD2-CD1 3.96Å; W335-I339 HydrophobicContact CE3-CD1 4.37Å; W335-I339 HydrophobicContact CG-CD1 3.99Å; W335-I339 HydrophobicContact CG-CG1 4.41Å
336	E	92.1	Very high	95.7	Very high	135 Å²	135	75.3 Å²	75.3	63%	0.631	38%	0.381	S	S	*	.	S	Bend	trans	-91	-17.8	-172.1	-64.9	-177.5	176.3	0	0	113.6
337	H	95.4	Very high	95.7	Very high	113 Å²	113	71.6 Å²	71.6	52%	0.523	36%	0.358	S	S	.	.	S	Bend	trans	-133.9	147.7	-175.4	-59.7	98.5	0	0	0	110.1	S311	S311-H337 WeakPolarHBondContact OG-CB 3.18Å
338	S	95.9	Very high	95.7	Very high	59 Å²	59	75 Å²	75	41%	0.413	38%	0.376	S	S	.	.			trans	-64.2	140.6	-178.2	50.6	0	0	0	0	112.4	S311 E351	S311-S338 VanDerWaalsContact CB-O 3.28Å; S311-S338 WeakPolarHBondContact CB-O 3.44Å; S338-E351 WeakPolarHBondContact CB-OE1 3.41Å
339	I	97.4	Very high	95.6	Very high	5 Å²	5	77.1 Å²	77.1	3%	0.026	40%	0.399	C	S	.	.			trans	-102.8	89.5	-177	-46.2	171.9	0	0	0	107.6	L310 L328 W335 I352	L310-I339 HydrophobicContact CB-CD1 4.05Å; L310-I339 HydrophobicContact CB-CG1 4.28Å; L310-I339 HydrophobicContact CB-CG2 4.02Å; L310-I339 HydrophobicContact CD1-CD1 4.34Å; L328-I339 HydrophobicContact CD1-CD1 4.07Å; L328-I339 HydrophobicContact CD2-CD1 3.66Å; W335-I339 HydrophobicContact CB-CD1 4.44Å; W335-I339 HydrophobicContact CD2-CD1 3.96Å; W335-I339 HydrophobicContact CE3-CD1 4.37Å; W335-I339 HydrophobicContact CG-CD1 3.99Å; W335-I339 HydrophobicContact CG-CG1 4.41Å; I339-I352 HydrophobicContact CB-CD1 4.46Å; I339-I352 HydrophobicContact CG2-CD1 3.58Å; I339-I352 HydrophobicContact CG2-CG1 4.42Å; I339-I352 WeakPolarHBondContact O-CG1 3.31Å; I339-I352 PolarHBondContact O-N 2.96Å
340	V	97.5	Very high	95.7	Very high	44 Å²	44	79.4 Å²	79.4	27%	0.267	40%	0.404	S	S	.	.	B	Isolated β-bridge	trans	-95.3	148.7	-173.1	-63.8	0	0	0	0	113.6	G349 E350 E351	V340-G349 WeakPolarHBondContact CG1-O 3.41Å; V340-E350 CarbonylContact C-O 3.57Å; V340-E350 VanDerWaalsContact CA-O 3.23Å; V340-E350 WeakPolarHBondContact CA-O 3.18Å; V340-E350 WeakPolarHBondContact CB-O 3.38Å; V340-E351 HydrophobicContact CG1-CG 4.22Å
341	C	97.9	Very high	95.8	Very high	3 Å²	3	79.6 Å²	79.6	2%	0.02	39%	0.392	C	S	.	.			trans	-66	133.6	171.4	-67.5	0	0	0	0	111.6	C317 A347 G349 E350 A355	C317-C341 HydrophobicContact CB-CB 3.74Å; C317-C341 WeakPolarHBondContact CB-SG 3.29Å; C317-C341 VanDerWaalsContact SG-CA 3.52Å; C317-C341 WeakPolarHBondContact SG-CB 3.18Å; C317-C341 CovalentContact SG-SG 2.02Å; C317-C341 PolarHBondContact SG-SG 3.4Å; C341-A347 HydrophobicContact CB-CB 4.35Å; C341-A347 WeakPolarHBondContact CB-O 3.4Å; C341-G349 PolarHBondContact O-N 2.88Å; C341-E350 PolarHBondContact N-O 2.88Å; C341-A355 VanDerWaalsContact SG-CB 3.53Å
342	H	97.7	Very high	95.8	Very high	84 Å²	84	78.1 Å²	78.1	39%	0.389	39%	0.386	S	S	.	.			trans	-96.4	-35.4	174.8	-178.3	76.2	0	0	0	112.4	L314 W315 Q348	L314-H342 VanDerWaalsContact C-CB 3.48Å; W315-H342 PolarHBondContact O-N 3.44Å; H342-Q348 WeakPolarHBondContact O-CG 3.46Å
343	S	96.4	Very high	95.8	Very high	40 Å²	40	70.3 Å²	70.3	28%	0.28	35%	0.354	S	S	.	.	B	Isolated β-bridge	trans	-146.6	161	177.3	64.9	0	0	0	0	109.8	W315 C317	W315-S343 PolarHBondContact O-N 3.03Å; W315-S343 VanDerWaalsContact O-N 3.1Å; C317-S343 PolarHBondContact N-O 2.93Å
344	P	96.2	Very high	95.8	Very high	35 Å²	35	73.6 Å²	73.6	23%	0.227	36%	0.364	C	S	.	.	S	Bend	cis	-72.2	170.9	-7	32.9	-36.8	0	0	0	113	C317 Y346 A347 Q348	C317-P344 WeakPolarHBondContact O-CD 3.37Å; P344-Y346 HydrophobicContact CB-CD1 4.11Å; P344-Y346 HydrophobicContact CB-CE1 3.93Å; P344-Y346 HydrophobicContact CG-CD1 3.71Å; P344-Y346 HydrophobicContact CG-CD2 4.38Å; P344-Y346 HydrophobicContact CG-CE1 3.22Å; P344-Y346 HydrophobicContact CG-CE2 3.95Å; P344-Y346 HydrophobicContact CG-CG 4.27Å; P344-Y346 PolarHBondContact O-N 3.36Å; P344-Y346 VanDerWaalsContact O-N 3.12Å; P344-A347 PolarHBondContact O-N 3.49Å; P344-Q348 PolarHBondContact O-N 3.2Å
345	E	94.5	Very high	95.8	Very high	175 Å²	175	66.3 Å²	66.3	82%	0.818	34%	0.337	S	S	*	.	G	3₁₀ helix	trans	-51.9	-36.7	-174.4	-63.2	-178.7	166.5	0	0	114	A347 Q348	E345-A347 PolarHBondContact O-N 3.23Å; E345-Q348 PolarHBondContact O-N 2.03Å
346	Y	92.9	Very high	95.7	Very high	133 Å²	133	62.6 Å²	62.6	52%	0.522	32%	0.323	S	S	.	.	G	3₁₀ helix	trans	-67.9	-18.3	-179.1	67.2	-108.7	0	0	0	114.4	P344 F359	P344-Y346 HydrophobicContact CB-CD1 4.11Å; P344-Y346 HydrophobicContact CB-CE1 3.93Å; P344-Y346 HydrophobicContact CG-CD1 3.71Å; P344-Y346 HydrophobicContact CG-CD2 4.38Å; P344-Y346 HydrophobicContact CG-CE1 3.22Å; P344-Y346 HydrophobicContact CG-CE2 3.95Å; P344-Y346 HydrophobicContact CG-CG 4.27Å; P344-Y346 PolarHBondContact O-N 3.36Å; P344-Y346 VanDerWaalsContact O-N 3.12Å; Y346-F359 AromaticContact CD2-CD1 3.89Å; Y346-F359 HydrophobicContact CD2-CD1 3.89Å; Y346-F359 HydrophobicContact CD2-CD2 4.1Å; Y346-F359 AromaticContact CD2-CE1 3.84Å; Y346-F359 HydrophobicContact CD2-CE1 3.84Å; Y346-F359 HydrophobicContact CD2-CE2 4.07Å; Y346-F359 HydrophobicContact CD2-CG 4.04Å; Y346-F359 AromaticContact CD2-CZ 3.94Å; Y346-F359 HydrophobicContact CD2-CZ 3.94Å; Y346-F359 HydrophobicContact CE2-CB 4.25Å; Y346-F359 HydrophobicContact CE2-CD1 4.05Å; Y346-F359 AromaticContact CE2-CD2 4Å; Y346-F359 HydrophobicContact CE2-CD2 4Å; Y346-F359 HydrophobicContact CE2-CE1 4.44Å; Y346-F359 HydrophobicContact CE2-CE2 4.41Å; Y346-F359 AromaticContact CE2-CG 3.82Å; Y346-F359 HydrophobicContact CE2-CG 3.82Å; Y346-F359 WeakPolarHBondContact O-CZ 3.29Å
347	A	94.1	Very high	95.7	Very high	1 Å²	1	63.3 Å²	63.3	1%	0.008	32%	0.321	C	S	.	.	G	3₁₀ helix	trans	-114.1	2.5	178.5	0	0	0	0	0	112.3	C317 C341 P344 E345 G349 E350 A355 F359	C317-A347 HydrophobicContact CB-CB 4.41Å; C341-A347 HydrophobicContact CB-CB 4.35Å; C341-A347 WeakPolarHBondContact CB-O 3.4Å; P344-A347 PolarHBondContact O-N 3.49Å; E345-A347 PolarHBondContact O-N 3.23Å; A347-G349 PolarHBondContact O-N 2.96Å; A347-E350 WeakPolarHBondContact O-CB 3.24Å; A347-E350 PolarHBondContact O-N 2.78Å; A347-A355 HydrophobicContact CB-CB 4.4Å; A347-F359 HydrophobicContact CB-CD2 3.98Å; A347-F359 HydrophobicContact CB-CE2 3.61Å; A347-F359 HydrophobicContact CB-CZ 4.44Å
348	Q	95.6	Very high	95.5	Very high	112 Å²	112	60.6 Å²	60.6	52%	0.523	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.2	117.9	-170.7	-179.3	173.8	11.6	0	0	111.7	H342 P344 E345	H342-Q348 WeakPolarHBondContact O-CG 3.46Å; P344-Q348 PolarHBondContact O-N 3.2Å; E345-Q348 PolarHBondContact O-N 2.03Å
349	G	94.8	Very high	95.3	Very high	49 Å²	49	61.9 Å²	61.9	51%	0.505	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	97.5	-13.5	-178.3	0	0	0	0	0	115.1	V340 C341 A347	V340-G349 WeakPolarHBondContact CG1-O 3.41Å; C341-G349 PolarHBondContact O-N 2.88Å; A347-G349 PolarHBondContact O-N 2.96Å
350	E	96.6	Very high	95	Very high	99 Å²	99	69.8 Å²	69.8	46%	0.463	36%	0.359	S	S	.	.	S	Bend	trans	-70.4	151.9	171.1	-61	-61	155.5	0	0	110.9	V340 C341 A347 A355	V340-E350 CarbonylContact C-O 3.57Å; V340-E350 VanDerWaalsContact CA-O 3.23Å; V340-E350 WeakPolarHBondContact CA-O 3.18Å; V340-E350 WeakPolarHBondContact CB-O 3.38Å; C341-E350 PolarHBondContact N-O 2.88Å; A347-E350 WeakPolarHBondContact O-CB 3.24Å; A347-E350 PolarHBondContact O-N 2.78Å; E350-A355 HydrophobicContact CB-CB 4.1Å
351	E	97.1	Very high	94.6	Very high	76 Å²	76	68.6 Å²	68.6	36%	0.355	35%	0.35	S	S	.	.	B	Isolated β-bridge	trans	-70.7	145.3	171.6	-64.8	-151.8	-170.8	0	0	111.2	S338 V340 L353 D354 A355	S338-E351 WeakPolarHBondContact CB-OE1 3.41Å; V340-E351 HydrophobicContact CG1-CG 4.22Å; E351-L353 VanDerWaalsContact C-N 3.25Å; E351-L353 PolarHBondContact O-N 2.8Å; E351-L353 VanDerWaalsContact O-N 3.17Å; E351-D354 PolarHBondContact O-N 3.27Å; E351-A355 WeakPolarHBondContact O-CB 3.14Å; E351-A355 PolarHBondContact O-N 2.61Å
352	I	96.4	Very high	94.3	Very high	2 Å²	2	69.1 Å²	69.1	1%	0.01	35%	0.354	C	S	.	.	H	α-helix	trans	-54.7	-40.1	-174.7	-74.6	175.7	0	0	0	112.6	W315 I321 L324 A325 L328 I339 V356	W315-I352 HydrophobicContact CB-CD1 4.18Å; W315-I352 HydrophobicContact CD2-CD1 4.29Å; W315-I352 HydrophobicContact CG-CD1 3.86Å; I321-I352 HydrophobicContact CD1-CD1 4.06Å; I321-I352 HydrophobicContact CG1-CD1 4.01Å; I321-I352 HydrophobicContact CG1-CG1 4.26Å; I321-I352 HydrophobicContact CG1-CG2 3.82Å; I321-I352 HydrophobicContact CG2-CG2 4.45Å; L324-I352 HydrophobicContact CD2-CD1 4.03Å; A325-I352 HydrophobicContact CB-CG2 3.9Å; L328-I352 HydrophobicContact CD1-CG2 4.42Å; I339-I352 HydrophobicContact CB-CD1 4.46Å; I339-I352 HydrophobicContact CG2-CD1 3.58Å; I339-I352 HydrophobicContact CG2-CG1 4.42Å; I339-I352 WeakPolarHBondContact O-CG1 3.31Å; I339-I352 PolarHBondContact O-N 2.96Å; I352-V356 WeakPolarHBondContact O-CB 3.27Å; I352-V356 VanDerWaalsContact O-CG2 3.24Å; I352-V356 WeakPolarHBondContact O-CG2 3.45Å; I352-V356 PolarHBondContact O-N 2.84Å
353	L	95.6	Very high	93.5	Very high	47 Å²	47	73.8 Å²	73.8	25%	0.246	38%	0.376	C	S	.	.	H	α-helix	trans	-69.6	-43.6	-177.9	-59.7	179.3	0	0	0	111.5	A325 L328 E351 V356 Y357 F365	A325-L353 HydrophobicContact CB-CD2 4.3Å; A325-L353 WeakPolarHBondContact O-CD2 3.37Å; L328-L353 HydrophobicContact CB-CD2 4.07Å; E351-L353 VanDerWaalsContact C-N 3.25Å; E351-L353 PolarHBondContact O-N 2.8Å; E351-L353 VanDerWaalsContact O-N 3.17Å; L353-V356 PolarHBondContact O-N 2.8Å; L353-Y357 PolarHBondContact O-N 2.93Å; L353-Y357 VanDerWaalsContact O-N 3.09Å; L353-F365 HydrophobicContact CD2-CZ 4.04Å
354	D	95.4	Very high	92.1	Very high	101 Å²	101	79.6 Å²	79.6	54%	0.54	40%	0.404	S	S	.	.	H	α-helix	trans	-69.4	-40.1	178.8	-66.8	-28.1	0	0	0	111.5	E351 Y357 G358	E351-D354 PolarHBondContact O-N 3.27Å; D354-Y357 PolarHBondContact O-N 3.45Å; D354-G358 PolarHBondContact O-N 3.01Å
355	A	94.9	Very high	90.5	Very high	1 Å²	1	79.6 Å²	79.6	1%	0.008	40%	0.4	C	S	.	.	H	α-helix	trans	-63.2	-41.7	173.8	0	0	0	0	0	112.3	C341 A347 E350 E351 Y357 F359	C341-A355 VanDerWaalsContact SG-CB 3.53Å; A347-A355 HydrophobicContact CB-CB 4.4Å; E350-A355 HydrophobicContact CB-CB 4.1Å; E351-A355 WeakPolarHBondContact O-CB 3.14Å; E351-A355 PolarHBondContact O-N 2.61Å; A355-Y357 VanDerWaalsContact C-N 3.35Å; A355-Y357 PolarHBondContact O-N 2.81Å; A355-F359 HydrophobicContact CB-CD2 4.07Å; A355-F359 HydrophobicContact CB-CE2 4.25Å; A355-F359 WeakPolarHBondContact O-CB 3.05Å; A355-F359 VanDerWaalsContact O-CD2 3.27Å; A355-F359 WeakPolarHBondContact O-CD2 3.03Å; A355-F359 PolarHBondContact O-N 2.91Å
356	V	94.8	Very high	88.7	Confident	1 Å²	1	76.4 Å²	76.4	1%	0.006	40%	0.398	C	S	.	.	H	α-helix	trans	-63.3	-40.8	176.9	161.3	0	0	0	0	111.8	I321 A325 I352 L353 Q360 L361 C362 F365	I321-V356 HydrophobicContact CG2-CG2 3.51Å; A325-V356 HydrophobicContact CB-CB 4.41Å; A325-V356 HydrophobicContact CB-CG1 4.42Å; A325-V356 HydrophobicContact CB-CG2 3.81Å; I352-V356 WeakPolarHBondContact O-CB 3.27Å; I352-V356 VanDerWaalsContact O-CG2 3.24Å; I352-V356 WeakPolarHBondContact O-CG2 3.45Å; I352-V356 PolarHBondContact O-N 2.84Å; L353-V356 PolarHBondContact O-N 2.8Å; V356-Q360 WeakPolarHBondContact O-CA 3.45Å; V356-Q360 PolarHBondContact O-N 3.35Å; V356-L361 HydrophobicContact CG2-CB 4.32Å; V356-L361 HydrophobicContact CG2-CD1 4.06Å; V356-L361 PolarHBondContact O-N 2.85Å; V356-L361 VanDerWaalsContact O-N 3.08Å; V356-C362 HydrophobicContact CG1-CB 3.79Å; V356-C362 VanDerWaalsContact CG1-SG 3.52Å; V356-F365 HydrophobicContact CG1-CB 4.11Å; V356-F365 HydrophobicContact CG1-CD1 3.66Å; V356-F365 HydrophobicContact CG1-CD2 4.04Å; V356-F365 HydrophobicContact CG1-CE1 4.04Å; V356-F365 HydrophobicContact CG1-CE2 4.39Å; V356-F365 HydrophobicContact CG1-CG 3.65Å; V356-F365 HydrophobicContact CG1-CZ 4.39Å
357	Y	91.8	Very high	86.6	Confident	149 Å²	149	72.6 Å²	72.6	58%	0.584	39%	0.394	S	S	*	.	H	α-helix	trans	-72.1	-53.5	177.1	-178.3	-102.8	0	0	0	112	L353 D354 A355 F359 Q360 A367	L353-Y357 PolarHBondContact O-N 2.93Å; L353-Y357 VanDerWaalsContact O-N 3.09Å; D354-Y357 PolarHBondContact O-N 3.45Å; A355-Y357 VanDerWaalsContact C-N 3.35Å; A355-Y357 PolarHBondContact O-N 2.81Å; Y357-F359 PolarHBondContact O-N 2.73Å; Y357-Q360 PolarHBondContact O-N 3.13Å; Y357-A367 HydrophobicContact CD2-CB 4.12Å; Y357-A367 HydrophobicContact CE2-CB 3.92Å
358	G	91.6	Very high	84.4	Confident	56 Å²	56	76.2 Å²	76.2	58%	0.577	42%	0.417	S	S	*	.	H	α-helix	trans	-65.6	-39	-174.5	0	0	0	0	0	114.3	D354	D354-G358 PolarHBondContact O-N 3.01Å
359	F	91.9	Very high	81.6	Confident	87 Å²	87	77.1 Å²	77.1	38%	0.382	43%	0.43	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.2	6.6	176	-54.3	-64.6	0	0	0	113.5	Y346 A347 A355 Y357 L361	Y346-F359 AromaticContact CD2-CD1 3.89Å; Y346-F359 HydrophobicContact CD2-CD1 3.89Å; Y346-F359 HydrophobicContact CD2-CD2 4.1Å; Y346-F359 AromaticContact CD2-CE1 3.84Å; Y346-F359 HydrophobicContact CD2-CE1 3.84Å; Y346-F359 HydrophobicContact CD2-CE2 4.07Å; Y346-F359 HydrophobicContact CD2-CG 4.04Å; Y346-F359 AromaticContact CD2-CZ 3.94Å; Y346-F359 HydrophobicContact CD2-CZ 3.94Å; Y346-F359 HydrophobicContact CE2-CB 4.25Å; Y346-F359 HydrophobicContact CE2-CD1 4.05Å; Y346-F359 AromaticContact CE2-CD2 4Å; Y346-F359 HydrophobicContact CE2-CD2 4Å; Y346-F359 HydrophobicContact CE2-CE1 4.44Å; Y346-F359 HydrophobicContact CE2-CE2 4.41Å; Y346-F359 AromaticContact CE2-CG 3.82Å; Y346-F359 HydrophobicContact CE2-CG 3.82Å; Y346-F359 WeakPolarHBondContact O-CZ 3.29Å; A347-F359 HydrophobicContact CB-CD2 3.98Å; A347-F359 HydrophobicContact CB-CE2 3.61Å; A347-F359 HydrophobicContact CB-CZ 4.44Å; A355-F359 HydrophobicContact CB-CD2 4.07Å; A355-F359 HydrophobicContact CB-CE2 4.25Å; A355-F359 WeakPolarHBondContact O-CB 3.05Å; A355-F359 VanDerWaalsContact O-CD2 3.27Å; A355-F359 WeakPolarHBondContact O-CD2 3.03Å; A355-F359 PolarHBondContact O-N 2.91Å; Y357-F359 PolarHBondContact O-N 2.73Å; F359-L361 HydrophobicContact CB-CD2 3.78Å; F359-L361 HydrophobicContact CB-CG 3.98Å; F359-L361 PolarHBondContact O-N 2.95Å
360	Q	90.4	Very high	78.9	Confident	171 Å²	171	81.3 Å²	81.3	80%	0.799	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	50	39.5	178.9	-58.4	-175.3	-6.4	0	0	113.5	V356 Y357 C362	V356-Q360 WeakPolarHBondContact O-CA 3.45Å; V356-Q360 PolarHBondContact O-N 3.35Å; Y357-Q360 PolarHBondContact O-N 3.13Å; Q360-C362 PolarHBondContact O-N 3.48Å
361	L	90.6	Very high	75.8	Confident	18 Å²	18	84.3 Å²	84.3	9%	0.094	45%	0.453	C	S	.	.			trans	-64.2	-30.6	-171.1	-60	-179.9	0	0	0	112.7	C317 I321 V356 F359	C317-L361 HydrophobicContact CB-CD1 4.23Å; C317-L361 VanDerWaalsContact O-CD1 3.31Å; C317-L361 WeakPolarHBondContact O-CD1 3.39Å; I321-L361 HydrophobicContact CG2-CD1 4.4Å; V356-L361 HydrophobicContact CG2-CB 4.32Å; V356-L361 HydrophobicContact CG2-CD1 4.06Å; V356-L361 PolarHBondContact O-N 2.85Å; V356-L361 VanDerWaalsContact O-N 3.08Å; F359-L361 HydrophobicContact CB-CD2 3.78Å; F359-L361 HydrophobicContact CB-CG 3.98Å; F359-L361 PolarHBondContact O-N 2.95Å
362	C	90.5	Very high	72.6	Confident	15 Å²	15	86 Å²	86	10%	0.101	47%	0.469	C	S	.	.	S	Bend	trans	-121.7	125.9	-168.9	-53.9	0	0	0	0	111	C322 V356 Q360 F365	C322-C362 WeakPolarHBondContact CA-SG 3.31Å; C322-C362 HydrophobicContact CB-CB 3.85Å; C322-C362 WeakPolarHBondContact CB-SG 3.1Å; C322-C362 WeakPolarHBondContact SG-CA 3.33Å; C322-C362 WeakPolarHBondContact SG-CB 3.48Å; C322-C362 CovalentContact SG-SG 2.03Å; C322-C362 PolarHBondContact SG-SG 2.83Å; V356-C362 HydrophobicContact CG1-CB 3.79Å; V356-C362 VanDerWaalsContact CG1-SG 3.52Å; Q360-C362 PolarHBondContact O-N 3.48Å; C362-F365 HydrophobicContact CB-CB 4.05Å
363	Q	81.6	Confident	69.5	Low	181 Å²	181	92.7 Å²	92.7	85%	0.846	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	141	176.3	-69.5	178.5	-27.7	0	0	110.3	F365	Q363-F365 PolarHBondContact O-N 3.48Å
364	N	66.3	Low	66.4	Low	162 Å²	162	94.7 Å²	94.7	87%	0.866	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.9	19.4	-179.5	-54.5	-15.4	0	0	0	115.7	S366	N364-S366 VanDerWaalsContact C-N 3.27Å; N364-S366 PolarHBondContact O-N 3.41Å
365	F	63.4	Low	63.1	Low	35 Å²	35	96 Å²	96	15%	0.154	53%	0.533	C	S	.	.			trans	-76.3	77.9	172.7	-160.7	-93.2	0	0	0	111.1	A325 L353 V356 C362 Q363	A325-F365 HydrophobicContact CB-CE2 4.18Å; A325-F365 HydrophobicContact CB-CZ 4.48Å; L353-F365 HydrophobicContact CD2-CZ 4.04Å; V356-F365 HydrophobicContact CG1-CB 4.11Å; V356-F365 HydrophobicContact CG1-CD1 3.66Å; V356-F365 HydrophobicContact CG1-CD2 4.04Å; V356-F365 HydrophobicContact CG1-CE1 4.04Å; V356-F365 HydrophobicContact CG1-CE2 4.39Å; V356-F365 HydrophobicContact CG1-CG 3.65Å; V356-F365 HydrophobicContact CG1-CZ 4.39Å; C362-F365 HydrophobicContact CB-CB 4.05Å; Q363-F365 PolarHBondContact O-N 3.48Å
366	S	57.4	Low	59.9	Low	109 Å²	109	101.8 Å²	101.8	76%	0.762	57%	0.568	S	S	*	*	P	Polyproline II helix	trans	-69.4	126.7	172.2	-57.9	0	0	0	0	110.1	N364	N364-S366 VanDerWaalsContact C-N 3.27Å; N364-S366 PolarHBondContact O-N 3.41Å
367	A	48.2	Very low	56.8	Low	53 Å²	53	108 Å²	108	44%	0.438	61%	0.606	S	S	.	*	P	Polyproline II helix	trans	-61.1	130.7	-179.8	0	0	0	0	0	111.3	Y357 V369	Y357-A367 HydrophobicContact CD2-CB 4.12Å; Y357-A367 HydrophobicContact CE2-CB 3.92Å; A367-V369 PolarHBondContact O-N 3.31Å
368	P	46.6	Very low	53.7	Low	76 Å²	76	108.6 Å²	108.6	49%	0.494	62%	0.62	S	S	.	*	P	Polyproline II helix	trans	-64.6	129.4	166.4	28	-32.4	0	0	0	108.6	I370	P368-I370 VanDerWaalsContact C-N 3.33Å; P368-I370 PolarHBondContact O-N 2.98Å
369	V	38.6	Very low	50.7	Low	131 Å²	131	111.6 Å²	111.6	79%	0.794	63%	0.627	S	S	*	*			trans	-72.9	89.9	178.9	-178.8	0	0	0	0	109.1	A367 Q371	A367-V369 PolarHBondContact O-N 3.31Å; V369-Q371 PolarHBondContact O-N 2.89Å
370	I	37.1	Very low	47.7	Very low	137 Å²	137	113.8 Å²	113.8	70%	0.703	65%	0.648	S	S	*	*			trans	-67.9	102.3	169.4	-59.1	178.5	0	0	0	107.4	P368 T372	P368-I370 VanDerWaalsContact C-N 3.33Å; P368-I370 PolarHBondContact O-N 2.98Å; I370-T372 VanDerWaalsContact C-N 3.3Å; I370-T372 HydrophobicContact CG2-CG2 4.33Å; I370-T372 PolarHBondContact O-N 3.13Å
371	Q	31.8	Very low	44.8	Very low	163 Å²	163	112.3 Å²	112.3	76%	0.762	65%	0.651	S	S	*	*			trans	-70.1	90.7	167.1	-72.8	-171.6	-12.4	0	0	109	V369 I373	V369-Q371 PolarHBondContact O-N 2.89Å; Q371-I373 PolarHBondContact O-N 3.25Å
372	T	29.1	Very low	41.8	Very low	111 Å²	111	116.3 Å²	116.3	68%	0.681	69%	0.686	S	S	*	*			trans	-64.5	102.2	162.6	37	0	0	0	0	108.5	I370 S374	I370-T372 VanDerWaalsContact C-N 3.3Å; I370-T372 HydrophobicContact CG2-CG2 4.33Å; I370-T372 PolarHBondContact O-N 3.13Å; T372-S374 PolarHBondContact O-N 3Å
373	I	32.3	Very low	38.8	Very low	143 Å²	143	120.4 Å²	120.4	73%	0.733	72%	0.721	S	S	*	*			trans	-72.8	77.9	172.6	-55.5	-179.7	0	0	0	108.1	Q371 T375	Q371-I373 PolarHBondContact O-N 3.25Å; I373-T375 HydrophobicContact CG2-CG2 4.03Å; I373-T375 PolarHBondContact O-N 3.23Å
374	S	29.2	Very low	36.2	Very low	88 Å²	88	120.5 Å²	120.5	62%	0.615	72%	0.721	S	S	*	*			trans	-73.5	88.2	172.7	-63.1	0	0	0	0	109.1	T372 T376	T372-S374 PolarHBondContact O-N 3Å; S374-T376 PolarHBondContact O-N 3.14Å
375	T	27.9	Very low	34.4	Very low	128 Å²	128	119.8 Å²	119.8	79%	0.785	72%	0.716	S	S	*	*			trans	-72.3	73.5	171.5	54.5	0	0	0	0	110.8	I373	I373-T375 HydrophobicContact CG2-CG2 4.03Å; I373-T375 PolarHBondContact O-N 3.23Å
376	T	27.6	Very low	32.7	Very low	124 Å²	124	123.7 Å²	123.7	76%	0.761	74%	0.743	S	S	*	*			trans	-106.7	94.3	164.7	51.3	0	0	0	0	108.6	S374 D378	S374-T376 PolarHBondContact O-N 3.14Å; T376-D378 PolarHBondContact O-N 3.2Å
377	T	29.3	Very low	31.3	Very low	130 Å²	130	123.8 Å²	123.8	80%	0.798	74%	0.744	S	S	*	*			trans	-64.5	122.3	161.2	47.4	0	0	0	0	109
378	D	26.6	Very low	30.4	Very low	162 Å²	162	125.8 Å²	125.8	87%	0.866	76%	0.755	S	S	*	*			trans	-155.9	155.2	136.2	-102.3	-31	0	0	0	109.9	T376	T376-D378 PolarHBondContact O-N 3.2Å
379	T	27.9	Very low	29.5	Very low	120 Å²	120	129.2 Å²	129.2	74%	0.736	77%	0.768	S	S	*	*			trans	-127.6	162.3	-171.7	52.9	0	0	0	0	111.2
380	T	28.6	Very low	29.1	Very low	132 Å²	132	132.4 Å²	132.4	81%	0.81	77%	0.771	S	S	*	*			trans	71.3	146.4	-179.2	76	0	0	0	0	114.4
381	T	30.5	Very low	28.6	Very low	141 Å²	141	129 Å²	129	87%	0.865	77%	0.771	S	S	*	*			cis	-141.2	168.3	5.9	-21	0	0	0	0	110.8
382	A	26.9	Very low	28.4	Very low	101 Å²	101	128.9 Å²	128.9	84%	0.835	77%	0.773	S	S	*	*			trans	-86.9	159.1	-171.3	0	0	0	0	0	115.5
383	A	28.6	Very low	28.1	Very low	102 Å²	102	132.1 Å²	132.1	84%	0.843	78%	0.783	S	S	*	*			trans	-152.7	149.3	151.9	0	0	0	0	0	109.8
384	E	26.7	Very low	27.9	Very low	182 Å²	182	133.7 Å²	133.7	85%	0.85	79%	0.787	S	S	*	*			trans	-101.7	170	-176.2	-57.9	168.5	108.7	0	0	112.2
385	I	29.1	Very low	28.5	Very low	148 Å²	148	134.2 Å²	134.2	76%	0.759	79%	0.788	S	S	*	*				160.9	124.7	123.5	-85.3	162.1	0	0	0	113.9
386	T	27.8	Very low	28.4	Very low	117 Å²	117	133.6 Å²	133.6	72%	0.718	79%	0.785	S	S	*	*			trans	50	116.9	160.6	55.7	0	0	0	0	120.9
387	S	26.6	Very low	28.7	Very low	110 Å²	110	133.1 Å²	133.1	77%	0.769	78%	0.784	S	S	*	*				84.2	149	81.3	94.5	0	0	0	0	114.8
388	S	30.1	Very low	28.7	Very low	96 Å²	96	132 Å²	132	67%	0.671	78%	0.777	S	S	*	*			cis	-163	150.9	19.6	59.7	0	0	0	0	116.4
389	L	27.8	Very low	29	Very low	147 Å²	147	131.9 Å²	131.9	77%	0.77	77%	0.771	S	S	*	*			trans	78	155	146.6	-100	79.6	0	0	0	123.9
390	F	30.3	Very low	28.9	Very low	198 Å²	198	131.1 Å²	131.1	87%	0.868	76%	0.763	S	S	*	*			trans	72	127.6	-176.9	-58	-79.6	0	0	0	116
391	G	25.3	Very low	28.9	Very low	67 Å²	67	134.9 Å²	134.9	69%	0.691	76%	0.764	S	S	*	*			cis	98.4	135.9	4	0	0	0	0	0	113
392	I	27.8	Very low	28.8	Very low	159 Å²	159	132.5 Å²	132.5	82%	0.815	76%	0.758	S	S	*	*			cis	-156.5	150.1	5.9	-103.4	170.3	0	0	0	109.7
393	M	22.9	Very low	28.9	Very low	179 Å²	179	136.4 Å²	136.4	88%	0.882	76%	0.759	S	S	*	*			trans	46	147	157.8	-69.3	173.6	69.2	0	0	124.7
394	Q	28.8	Very low	28.9	Very low	176 Å²	176	138 Å²	138	82%	0.822	75%	0.753	S	S	*	*			trans	-102.2	-173.9	167.8	-121.5	177.7	3.7	0	0	109.3
395	P	42.1	Very low	28.9	Very low	99 Å²	99	138.6 Å²	138.6	64%	0.643	75%	0.754	S	S	*	*			cis	-140.2	-152.3	-11.9	39.4	-17.1	0	0	0	114.2
396	T	26	Very low	28.8	Very low	116 Å²	116	135 Å²	135	71%	0.712	75%	0.753	S	S	*	*			trans	76.8	140.7	161.9	32.1	0	0	0	0	119.7
397	P	33.7	Very low	28.7	Very low	113 Å²	113	135.2 Å²	135.2	73%	0.734	76%	0.759	S	S	*	*				-109.6	146.4	84.4	-3.2	24.1	0	0	0	113.4
398	T	29.2	Very low	28.7	Very low	108 Å²	108	138.5 Å²	138.5	66%	0.663	76%	0.76	S	S	*	*				58.5	138.8	79	75.7	0	0	0	0	114.8
399	Q	31.7	Very low	28.6	Very low	159 Å²	159	139.9 Å²	139.9	74%	0.743	76%	0.764	S	S	*	*			cis	-170.7	168.9	1.1	-118	175.3	-70.8	0	0	108.3
400	D	25.5	Very low	28.5	Very low	103 Å²	103	138 Å²	138	55%	0.551	76%	0.759	S	S	*	*			cis	-167.3	-176.4	-5.1	-148.9	-22.4	0	0	0	111.1
401	Y	30.2	Very low	28.3	Very low	212 Å²	212	135.8 Å²	135.8	83%	0.831	76%	0.756	S	S	*	*			trans	78	139.9	162.1	-65.2	-68.5	0	0	0	123
402	A	27.9	Very low	28.5	Very low	91 Å²	91	138 Å²	138	75%	0.752	76%	0.756	S	S	*	*			trans	-105.8	-167.5	170.8	0	0	0	0	0	109.9
403	E	29.8	Very low	28.5	Very low	182 Å²	182	136.1 Å²	136.1	85%	0.85	75%	0.752	S	S	*	*			cis	-146.1	140.5	21.9	-68.4	-177.2	141.5	0	0	108.7
404	D	26.9	Very low	28.6	Very low	136 Å²	136	133.1 Å²	133.1	73%	0.727	74%	0.744	S	S	*	*				89.5	154.4	91.8	-161.3	25.1	0	0	0	116.1
405	F	28.4	Very low	28.5	Very low	195 Å²	195	131 Å²	131	86%	0.855	74%	0.743	S	S	*	*			trans	60.5	157.1	-178.8	-82.3	-87.2	0	0	0	119.3
406	G	26.2	Very low	27.7	Very low	72 Å²	72	132.7 Å²	132.7	74%	0.742	75%	0.752	S	S	*	*			trans	-161.6	159.9	177.2	0	0	0	0	0	113.8
407	S	26.4	Very low	27.8	Very low	122 Å²	122	132.9 Å²	132.9	85%	0.853	75%	0.753	S	S	*	*			trans	-164.9	144.6	170.2	179.9	0	0	0	0	113.2
408	F	26.4	Very low	27.5	Very low	178 Å²	178	133.2 Å²	133.2	78%	0.781	75%	0.753	S	S	*	*			trans	-27.5	138.9	166.2	-99.7	-109.4	0	0	0	119.6	T410	F408-T410 HydrophobicContact CD1-CG2 4.41Å
409	T	27.2	Very low	27.3	Very low	125 Å²	125	136.3 Å²	136.3	77%	0.767	76%	0.76	S	S	*	*				174.1	106.3	119.3	27.8	0	0	0	0	110.3
410	T	26.6	Very low	27.1	Very low	107 Å²	107	134.7 Å²	134.7	66%	0.656	76%	0.761	S	S	*	*				66.1	120	89.1	60.2	0	0	0	0	118.2	F408	F408-T410 HydrophobicContact CD1-CG2 4.41Å
411	L	26.3	Very low	27.7	Very low	152 Å²	152	134.9 Å²	134.9	80%	0.796	77%	0.768	S	S	*	*			trans	169.1	105.4	132.3	-90	160.6	0	0	0	109.8
412	T	28	Very low	27.7	Very low	114 Å²	114	129.4 Å²	129.4	70%	0.699	76%	0.761	S	S	*	*				69.3	145.2	104	57.2	0	0	0	0	116.2
413	T	27.5	Very low	27.8	Very low	119 Å²	119	131.5 Å²	131.5	73%	0.73	76%	0.764	S	S	*	*			cis	-158.6	172.4	3.8	5.3	0	0	0	0	107.5
414	T	26.1	Very low	27.7	Very low	117 Å²	117	126.4 Å²	126.4	72%	0.718	75%	0.754	S	S	*	*			cis	-138.5	-154.1	11.7	-13.5	0	0	0	0	107.8
415	T	26.8	Very low	27.9	Very low	131 Å²	131	129 Å²	129	80%	0.804	76%	0.761	S	S	*	*			cis	-149.5	177.2	9.9	-27.7	0	0	0	0	109
416	T	25.7	Very low	27.9	Very low	135 Å²	135	123.6 Å²	123.6	83%	0.828	75%	0.753	S	S	*	*			trans	-119.6	167.8	-166.5	-3.7	0	0	0	0	116
417	T	27.8	Very low	28	Very low	120 Å²	120	127.2 Å²	127.2	74%	0.736	76%	0.761	S	S	*	*			trans	-96.7	-168.8	-177	48.6	0	0	0	0	113.7
418	T	26.4	Very low	28.2	Very low	120 Å²	120	127.9 Å²	127.9	74%	0.736	76%	0.76	S	S	*	*			trans	90.4	149.6	175	74.8	0	0	0	0	115.8
419	Q	25.4	Very low	28.4	Very low	173 Å²	173	123 Å²	123	81%	0.808	75%	0.752	S	S	*	*			cis	-151.6	177.5	9	-140.4	156.1	37.6	0	0	114.5
420	T	27.1	Very low	28.6	Very low	125 Å²	125	124.4 Å²	124.4	77%	0.767	75%	0.754	S	S	*	*			trans	-73.9	177.6	176.3	34.7	0	0	0	0	113.4
421	P	39.6	Very low	28.7	Very low	107 Å²	107	125.2 Å²	125.2	70%	0.695	75%	0.754	S	S	*	*			cis	-157.4	178.3	38.8	45.9	-22.8	0	0	0	122
422	S	30.3	Very low	28.8	Very low	97 Å²	97	125.5 Å²	125.5	68%	0.678	75%	0.751	S	S	*	*			trans	37.9	142.2	143.5	64	0	0	0	0	121.6
423	T	29.3	Very low	28.8	Very low	134 Å²	134	128.9 Å²	128.9	82%	0.822	76%	0.759	S	S	*	*			cis	-164.9	-173.5	24.2	-6.6	0	0	0	0	108.1
424	A	28.4	Very low	28.8	Very low	76 Å²	76	128.2 Å²	128.2	63%	0.628	77%	0.765	S	S	*	*			cis	-156.9	166.1	9.2	0	0	0	0	0	114.1
425	E	30.1	Very low	29.1	Very low	189 Å²	189	127.3 Å²	127.3	88%	0.883	77%	0.77	S	S	*	*			trans	24.4	151.6	131.5	-59.9	-175.8	157.1	0	0	123.6
426	A	29	Very low	29.2	Very low	83 Å²	83	127.4 Å²	127.4	69%	0.686	77%	0.77	S	S	*	*			cis	-176.2	149.2	-21.3	0	0	0	0	0	110.6
427	T	28.2	Very low	29.4	Very low	147 Å²	147	127 Å²	127	90%	0.902	77%	0.768	S	S	*	*			trans	-170.9	143.7	136.2	23.8	0	0	0	0	112.9
428	T	29.3	Very low	30	Very low	137 Å²	137	128.3 Å²	128.3	84%	0.84	77%	0.77	S	S	*	*			trans	-82.9	-179.1	175.9	53	0	0	0	0	112
429	A	31.9	Very low	30.4	Very low	74 Å²	74	129.3 Å²	129.3	61%	0.612	77%	0.771	S	S	*	*			cis	-168.1	155.6	17.1	0	0	0	0	0	113.8
430	L	30.1	Very low	30.9	Very low	155 Å²	155	129.5 Å²	129.5	81%	0.812	77%	0.769	S	S	*	*			trans	60.4	-173.9	150.1	-53.9	179.9	0	0	0	116.9
431	L	28.6	Very low	31.7	Very low	124 Å²	124	130.7 Å²	130.7	65%	0.649	77%	0.77	S	S	*	*				-148.6	-178.1	-54.8	-97	168.8	0	0	0	106.6
432	E	28.6	Very low	32	Very low	159 Å²	159	129 Å²	129	74%	0.743	77%	0.766	S	S	*	*			cis	-147.3	-136.7	14.1	-159.7	92.3	-121.2	0	0	110.2
433	E	28.9	Very low	32.6	Very low	184 Å²	184	130.6 Å²	130.6	86%	0.86	76%	0.764	S	S	*	*			trans	-99.6	151.9	-177.8	-59.9	-176.5	124.6	0	0	115.5
434	A	26.9	Very low	33.6	Very low	105 Å²	105	129.5 Å²	129.5	87%	0.868	75%	0.753	S	S	*	*			trans	-167	139.5	135.8	0	0	0	0	0	111.2
435	A	32.6	Very low	34.8	Very low	98 Å²	98	131.5 Å²	131.5	81%	0.81	75%	0.753	S	S	*	*			trans	-127.3	144.7	171.6	0	0	0	0	0	110.5
436	V	29	Very low	35.9	Very low	134 Å²	134	126.5 Å²	126.5	81%	0.812	74%	0.736	S	S	*	*			trans	-175.2	147.8	155.5	129.4	0	0	0	0	112.9
437	T	30.8	Very low	37.3	Very low	127 Å²	127	125.9 Å²	125.9	78%	0.779	72%	0.723	S	S	*	*			trans	57	112.9	168.7	43.9	0	0	0	0	121.2
438	D	39.2	Very low	38.6	Very low	147 Å²	147	124.2 Å²	124.2	79%	0.786	71%	0.707	S	S	*	*			trans	-72.6	117.5	150.4	172.3	31	0	0	0	110.4
439	D	36.3	Very low	40.1	Very low	140 Å²	140	121.6 Å²	121.6	75%	0.749	69%	0.691	S	S	*	*			trans	-160.4	10	168.9	-151.1	10.6	0	0	0	114.7
440	F	35.5	Very low	41.6	Very low	177 Å²	177	123.9 Å²	123.9	78%	0.776	69%	0.688	S	S	*	*			trans	-101.3	-5.8	-166.6	-147.1	-98.7	0	0	0	115.9
441	L	44	Very low	43.3	Very low	150 Å²	150	125 Å²	125	79%	0.785	68%	0.682	S	S	*	*	S	Bend	trans	-88.6	-5.1	-175.8	-70.8	172.9	0	0	0	114.8
442	A	44.7	Very low	45.2	Very low	73 Å²	73	123.7 Å²	123.7	60%	0.603	68%	0.679	S	S	*	*	S	Bend	trans	-87.2	-25.7	-177.2	0	0	0	0	0	114.7
443	M	44.1	Very low	47.2	Very low	129 Å²	129	120.6 Å²	120.6	64%	0.635	67%	0.667	S	S	*	*	H	α-helix	trans	-92.5	-13.5	-162.4	-160	162.4	67.8	0	0	115.6	T446	M443-T446 PolarHBondContact O-OG1 2.91Å; M443-T446 VanDerWaalsContact O-OG1 3.11Å
444	D	49.6	Very low	49.4	Very low	111 Å²	111	116.3 Å²	116.3	59%	0.594	65%	0.649	S	S	*	*	H	α-helix	trans	-85.2	-38.4	-176.7	-146.6	-2.7	0	0	0	112.4	T446 V447 M448	D444-T446 VanDerWaalsContact C-N 3.31Å; D444-T446 PolarHBondContact O-N 3.07Å; D444-V447 PolarHBondContact O-N 2.9Å; D444-M448 PolarHBondContact O-N 3.23Å; D444-M448 VanDerWaalsContact O-N 3.15Å
445	N	52.8	Low	51.7	Low	119 Å²	119	113 Å²	113	64%	0.636	62%	0.624	S	S	*	*	H	α-helix	trans	-63.2	-32.7	179.2	-77.1	-42.2	0	0	0	113.3	T449	N445-T449 WeakPolarHBondContact O-CB 3.34Å; N445-T449 WeakPolarHBondContact O-CG2 3.5Å; N445-T449 PolarHBondContact O-N 2.89Å; N445-T449 VanDerWaalsContact O-N 3.07Å; N445-T449 PolarHBondContact O-OG1 3.13Å
446	T	54.9	Low	54	Low	84 Å²	84	111.4 Å²	111.4	52%	0.515	61%	0.605	S	S	.	*	H	α-helix	trans	-72.4	-36.4	178.5	53.3	0	0	0	0	112.2	M443 D444 T449 H450	M443-T446 PolarHBondContact O-OG1 2.91Å; M443-T446 VanDerWaalsContact O-OG1 3.11Å; D444-T446 VanDerWaalsContact C-N 3.31Å; D444-T446 PolarHBondContact O-N 3.07Å; T446-T449 WeakPolarHBondContact CA-OG1 3.36Å; T446-T449 PolarHBondContact O-OG1 2.63Å; T446-H450 VanDerWaalsContact O-CB 3.28Å; T446-H450 WeakPolarHBondContact O-CB 3.15Å; T446-H450 PolarHBondContact O-N 3.28Å; T446-H450 VanDerWaalsContact O-N 3.07Å
447	V	56.6	Low	56.6	Low	70 Å²	70	109.2 Å²	109.2	42%	0.424	59%	0.587	S	S	.	*	H	α-helix	trans	-69.8	-42.3	176.6	178.1	0	0	0	0	111.2	D444 R451	D444-V447 PolarHBondContact O-N 2.9Å; V447-R451 WeakPolarHBondContact O-CG 3.38Å; V447-R451 PolarHBondContact O-N 3.21Å; V447-R451 VanDerWaalsContact O-N 3.13Å
448	M	57.2	Low	58.9	Low	112 Å²	112	106 Å²	106	55%	0.552	57%	0.573	S	S	*	*	H	α-helix	trans	-66.2	-47.1	177.5	-70.4	-62.3	-175.6	0	0	112.3	D444 H450 R451 V452	D444-M448 PolarHBondContact O-N 3.23Å; D444-M448 VanDerWaalsContact O-N 3.15Å; M448-H450 PolarHBondContact O-N 3.35Å; M448-R451 PolarHBondContact O-N 2.88Å; M448-V452 WeakPolarHBondContact O-CG2 3.31Å; M448-V452 PolarHBondContact O-N 3.39Å; M448-V452 VanDerWaalsContact O-N 3.08Å
449	T	59.6	Low	60.9	Low	82 Å²	82	105.1 Å²	105.1	50%	0.503	57%	0.567	S	S	.	*	H	α-helix	trans	-61.5	-43.1	177	46.8	0	0	0	0	112.1	N445 T446 R451 V452 I453	N445-T449 WeakPolarHBondContact O-CB 3.34Å; N445-T449 WeakPolarHBondContact O-CG2 3.5Å; N445-T449 PolarHBondContact O-N 2.89Å; N445-T449 VanDerWaalsContact O-N 3.07Å; N445-T449 PolarHBondContact O-OG1 3.13Å; T446-T449 WeakPolarHBondContact CA-OG1 3.36Å; T446-T449 PolarHBondContact O-OG1 2.63Å; T449-R451 VanDerWaalsContact C-N 3.33Å; T449-R451 PolarHBondContact O-N 2.76Å; T449-V452 PolarHBondContact O-N 2.96Å; T449-I453 VanDerWaalsContact O-CG1 3.3Å; T449-I453 WeakPolarHBondContact O-CG1 3.37Å; T449-I453 PolarHBondContact O-N 3.24Å
450	H	64.3	Low	63.3	Low	122 Å²	122	102.3 Å²	102.3	57%	0.565	55%	0.552	S	S	*	*	H	α-helix	trans	-61.1	-39	176.8	-168.5	-115.8	0	0	0	112.6	T446 M448 I453 I454	T446-H450 VanDerWaalsContact O-CB 3.28Å; T446-H450 WeakPolarHBondContact O-CB 3.15Å; T446-H450 PolarHBondContact O-N 3.28Å; T446-H450 VanDerWaalsContact O-N 3.07Å; M448-H450 PolarHBondContact O-N 3.35Å; H450-I453 PolarHBondContact O-N 3.45Å; H450-I454 WeakPolarHBondContact O-CG1 3.15Å; H450-I454 PolarHBondContact O-N 3.17Å
451	R	64.2	Low	65.6	Low	177 Å²	177	101 Å²	101	67%	0.668	55%	0.546	S	S	*	.	H	α-helix	trans	-65.5	-40.2	174.9	-76.8	-180	169.3	-168.6	-2.6	113.1	V447 M448 T449 I454 G455	V447-R451 WeakPolarHBondContact O-CG 3.38Å; V447-R451 PolarHBondContact O-N 3.21Å; V447-R451 VanDerWaalsContact O-N 3.13Å; M448-R451 PolarHBondContact O-N 2.88Å; T449-R451 VanDerWaalsContact C-N 3.33Å; T449-R451 PolarHBondContact O-N 2.76Å; R451-I454 PolarHBondContact O-N 3.36Å; R451-G455 PolarHBondContact O-N 3.11Å
452	V	68.6	Low	67.5	Low	98 Å²	98	97 Å²	97	59%	0.594	53%	0.53	S	S	*	.	H	α-helix	trans	-66.1	-38.7	175.4	173.9	0	0	0	0	111.5	M448 T449 G455 T456	M448-V452 WeakPolarHBondContact O-CG2 3.31Å; M448-V452 PolarHBondContact O-N 3.39Å; M448-V452 VanDerWaalsContact O-N 3.08Å; T449-V452 PolarHBondContact O-N 2.96Å; V452-G455 PolarHBondContact O-N 3.15Å; V452-T456 WeakPolarHBondContact O-CG2 3.44Å; V452-T456 PolarHBondContact O-N 3.4Å; V452-T456 PolarHBondContact O-OG1 3.36Å
453	I	72.3	Confident	69.7	Low	94 Å²	94	99.3 Å²	99.3	48%	0.482	53%	0.527	S	S	.	.	H	α-helix	trans	-64.1	-45.6	175.6	-68	163.4	0	0	0	110.7	T449 H450 G455 T456 M457	T449-I453 VanDerWaalsContact O-CG1 3.3Å; T449-I453 WeakPolarHBondContact O-CG1 3.37Å; T449-I453 PolarHBondContact O-N 3.24Å; H450-I453 PolarHBondContact O-N 3.45Å; I453-G455 PolarHBondContact O-N 3.1Å; I453-T456 PolarHBondContact O-N 3.05Å; I453-T456 PolarHBondContact O-OG1 3.28Å; I453-T456 VanDerWaalsContact O-OG1 3.06Å; I453-M457 HydrophobicContact CG2-CG 4.39Å; I453-M457 WeakPolarHBondContact O-CB 3.3Å; I453-M457 VanDerWaalsContact O-CG 3.27Å; I453-M457 WeakPolarHBondContact O-CG 3.28Å; I453-M457 PolarHBondContact O-N 3.02Å
454	I	73.6	Confident	71.8	Confident	94 Å²	94	99.1 Å²	99.1	48%	0.482	52%	0.523	S	S	.	.	H	α-helix	trans	-59.6	-46.1	175.8	-70	166.3	0	0	0	111.3	H450 R451 M457 A458	H450-I454 WeakPolarHBondContact O-CG1 3.15Å; H450-I454 PolarHBondContact O-N 3.17Å; R451-I454 PolarHBondContact O-N 3.36Å; I454-M457 PolarHBondContact O-N 3.41Å; I454-A458 WeakPolarHBondContact O-CB 3.43Å; I454-A458 PolarHBondContact O-N 3.37Å
455	G	75.4	Confident	73.6	Confident	35 Å²	35	100.5 Å²	100.5	36%	0.361	52%	0.524	S	S	.	.	H	α-helix	trans	-63	-42.7	-179.8	0	0	0	0	0	113.6	R451 V452 I453 A458 L459	R451-G455 PolarHBondContact O-N 3.11Å; V452-G455 PolarHBondContact O-N 3.15Å; I453-G455 PolarHBondContact O-N 3.1Å; G455-A458 PolarHBondContact O-N 3.35Å; G455-L459 PolarHBondContact O-N 3.4Å
456	T	80.6	Confident	75.2	Confident	65 Å²	65	99.6 Å²	99.6	40%	0.399	52%	0.518	S	S	.	.	H	α-helix	trans	-69.8	-38.9	177.8	49.1	0	0	0	0	112.4	V452 I453 L459 L460	V452-T456 WeakPolarHBondContact O-CG2 3.44Å; V452-T456 PolarHBondContact O-N 3.4Å; V452-T456 PolarHBondContact O-OG1 3.36Å; I453-T456 PolarHBondContact O-N 3.05Å; I453-T456 PolarHBondContact O-OG1 3.28Å; I453-T456 VanDerWaalsContact O-OG1 3.06Å; T456-L459 PolarHBondContact O-N 3.29Å; T456-L460 WeakPolarHBondContact O-CG 3.18Å; T456-L460 PolarHBondContact O-N 3.4Å; T456-L460 VanDerWaalsContact O-N 3.12Å
457	M	85	Confident	76.7	Confident	88 Å²	88	99.5 Å²	99.5	43%	0.433	51%	0.514	S	S	.	.	H	α-helix	trans	-63	-42.7	172.3	-69.3	-58.9	112.3	0	0	112.1	I453 I454 L459 L460 F461	I453-M457 HydrophobicContact CG2-CG 4.39Å; I453-M457 WeakPolarHBondContact O-CB 3.3Å; I453-M457 VanDerWaalsContact O-CG 3.27Å; I453-M457 WeakPolarHBondContact O-CG 3.28Å; I453-M457 PolarHBondContact O-N 3.02Å; I454-M457 PolarHBondContact O-N 3.41Å; M457-L459 VanDerWaalsContact C-N 3.35Å; M457-L459 PolarHBondContact O-N 3.37Å; M457-L460 HydrophobicContact CE-CD1 3.76Å; M457-L460 PolarHBondContact O-N 3.13Å; M457-L460 HydrophobicContact SD-CD1 4.43Å; M457-F461 WeakPolarHBondContact O-CD2 3.26Å; M457-F461 PolarHBondContact O-N 3.3Å
458	A	78.5	Confident	78	Confident	58 Å²	58	102 Å²	102	48%	0.479	52%	0.519	S	S	.	.	H	α-helix	trans	-61.2	-40.6	178.5	0	0	0	0	0	112.7	I454 G455 F461 S462	I454-A458 WeakPolarHBondContact O-CB 3.43Å; I454-A458 PolarHBondContact O-N 3.37Å; G455-A458 PolarHBondContact O-N 3.35Å; A458-F461 PolarHBondContact O-N 2.96Å; A458-S462 WeakPolarHBondContact O-CB 3.14Å; A458-S462 PolarHBondContact O-N 3.22Å
459	L	81.5	Confident	79	Confident	129 Å²	129	100.1 Å²	100.1	68%	0.675	51%	0.514	S	S	*	.	H	α-helix	trans	-64.1	-42.5	174.3	-73.7	169.6	0	0	0	112.1	G455 T456 M457 S462 F463	G455-L459 PolarHBondContact O-N 3.4Å; T456-L459 PolarHBondContact O-N 3.29Å; M457-L459 VanDerWaalsContact C-N 3.35Å; M457-L459 PolarHBondContact O-N 3.37Å; L459-S462 PolarHBondContact O-N 2.98Å; L459-F463 WeakPolarHBondContact O-CB 3.4Å; L459-F463 PolarHBondContact O-N 3.44Å
460	L	86	Confident	79.9	Confident	81 Å²	81	99.1 Å²	99.1	42%	0.424	51%	0.507	S	S	.	.	H	α-helix	trans	-63.4	-45.2	176	-72.4	168.3	0	0	0	112	T456 M457 S462 F463 F464	T456-L460 WeakPolarHBondContact O-CG 3.18Å; T456-L460 PolarHBondContact O-N 3.4Å; T456-L460 VanDerWaalsContact O-N 3.12Å; M457-L460 HydrophobicContact CE-CD1 3.76Å; M457-L460 PolarHBondContact O-N 3.13Å; M457-L460 HydrophobicContact SD-CD1 4.43Å; L460-S462 VanDerWaalsContact C-N 3.34Å; L460-S462 PolarHBondContact O-N 2.91Å; L460-F463 PolarHBondContact O-N 2.85Å; L460-F464 HydrophobicContact CB-CE2 4.49Å; L460-F464 WeakPolarHBondContact O-CD2 3.29Å; L460-F464 PolarHBondContact O-N 3.34Å
461	F	83.8	Confident	80.8	Confident	151 Å²	151	99.3 Å²	99.3	66%	0.662	50%	0.504	S	S	*	.	H	α-helix	trans	-61.9	-40.3	175.8	-81.2	-65.2	0	0	0	112.4	M457 A458 F464 F465	M457-F461 WeakPolarHBondContact O-CD2 3.26Å; M457-F461 PolarHBondContact O-N 3.3Å; A458-F461 PolarHBondContact O-N 2.96Å; F461-F464 PolarHBondContact O-N 3.42Å; F461-F465 VanDerWaalsContact O-CB 3.29Å; F461-F465 WeakPolarHBondContact O-CB 3.26Å; F461-F465 PolarHBondContact O-N 2.04Å
462	S	84.9	Confident	81.2	Confident	64 Å²	64	94.3 Å²	94.3	45%	0.448	49%	0.49	S	S	.	.	H	α-helix	trans	-60.6	-46.2	173.8	-173.5	0	0	0	0	111.9	A458 L459 L460 F465 I466	A458-S462 WeakPolarHBondContact O-CB 3.14Å; A458-S462 PolarHBondContact O-N 3.22Å; L459-S462 PolarHBondContact O-N 2.98Å; L460-S462 VanDerWaalsContact C-N 3.34Å; L460-S462 PolarHBondContact O-N 2.91Å; S462-F465 PolarHBondContact O-N 2.9Å; S462-I466 WeakPolarHBondContact O-CG1 3.44Å; S462-I466 PolarHBondContact O-N 2.85Å
463	F	91.2	Very high	81	Confident	122 Å²	122	92.9 Å²	92.9	54%	0.535	48%	0.484	S	S	.	.	H	α-helix	trans	-61.6	-47.1	177.2	-178.7	-106	0	0	0	112.6	L459 L460 F465 I466 I467	L459-F463 WeakPolarHBondContact O-CB 3.4Å; L459-F463 PolarHBondContact O-N 3.44Å; L460-F463 PolarHBondContact O-N 2.85Å; F463-F465 VanDerWaalsContact C-N 3.34Å; F463-F465 PolarHBondContact O-N 3.33Å; F463-I466 PolarHBondContact O-N 2.96Å; F463-I467 HydrophobicContact CD1-CD1 3.9Å; F463-I467 HydrophobicContact CE1-CD1 3.41Å; F463-I467 VanDerWaalsContact CE1-CD1 3.41Å; F463-I467 HydrophobicContact CE2-CD1 4.25Å; F463-I467 HydrophobicContact CZ-CD1 3.62Å; F463-I467 WeakPolarHBondContact O-CG1 3.4Å; F463-I467 PolarHBondContact O-N 3.36Å
464	F	87.8	Confident	80.6	Confident	126 Å²	126	98 Å²	98	55%	0.553	50%	0.497	S	S	*	.	H	α-helix	trans	-65.1	-35.9	176	-75.3	-60.8	0	0	0	112.6	L460 F461 I467 F468	L460-F464 HydrophobicContact CB-CE2 4.49Å; L460-F464 WeakPolarHBondContact O-CD2 3.29Å; L460-F464 PolarHBondContact O-N 3.34Å; F461-F464 PolarHBondContact O-N 3.42Å; F464-I467 PolarHBondContact O-N 3.2Å; F464-F468 WeakPolarHBondContact O-CB 3.27Å; F464-F468 PolarHBondContact O-N 3.23Å
465	F	87.2	Confident	80.3	Confident	140 Å²	140	99.8 Å²	99.8	61%	0.614	50%	0.502	S	S	*	.	H	α-helix	trans	-64.5	-43.4	174.7	-172.9	-98.5	0	0	0	111.8	F461 S462 F463 I467 F468 V469	F461-F465 VanDerWaalsContact O-CB 3.29Å; F461-F465 WeakPolarHBondContact O-CB 3.26Å; F461-F465 PolarHBondContact O-N 2.04Å; S462-F465 PolarHBondContact O-N 2.9Å; F463-F465 VanDerWaalsContact C-N 3.34Å; F463-F465 PolarHBondContact O-N 3.33Å; F465-I467 PolarHBondContact O-N 3.02Å; F465-F468 PolarHBondContact O-N 2.93Å; F465-V469 HydrophobicContact CD1-CG2 4.22Å; F465-V469 HydrophobicContact CE1-CG2 3.9Å; F465-V469 HydrophobicContact CZ-CG2 4.17Å; F465-V469 WeakPolarHBondContact O-CG2 3.28Å; F465-V469 PolarHBondContact O-N 3.1Å
466	I	85.8	Confident	79.4	Confident	99 Å²	99	102.7 Å²	102.7	51%	0.508	52%	0.515	S	S	.	.	H	α-helix	trans	-60.7	-45.7	174.3	-68	163.7	0	0	0	110.8	S462 F463 F468 V469 V470	S462-I466 WeakPolarHBondContact O-CG1 3.44Å; S462-I466 PolarHBondContact O-N 2.85Å; F463-I466 PolarHBondContact O-N 2.96Å; I466-F468 VanDerWaalsContact C-N 3.32Å; I466-F468 PolarHBondContact O-N 3.33Å; I466-V469 PolarHBondContact O-N 3.19Å; I466-V470 WeakPolarHBondContact O-CG2 3.48Å; I466-V470 PolarHBondContact O-N 3.21Å
467	I	86.8	Confident	78.2	Confident	83 Å²	83	103.6 Å²	103.6	43%	0.426	52%	0.523	S	S	.	.	H	α-helix	trans	-60.8	-41	175.4	-71.8	175.5	0	0	0	111.3	F463 F464 F465 V470 Y471	F463-I467 HydrophobicContact CD1-CD1 3.9Å; F463-I467 HydrophobicContact CE1-CD1 3.41Å; F463-I467 VanDerWaalsContact CE1-CD1 3.41Å; F463-I467 HydrophobicContact CE2-CD1 4.25Å; F463-I467 HydrophobicContact CZ-CD1 3.62Å; F463-I467 WeakPolarHBondContact O-CG1 3.4Å; F463-I467 PolarHBondContact O-N 3.36Å; F464-I467 PolarHBondContact O-N 3.2Å; F465-I467 PolarHBondContact O-N 3.02Å; I467-V470 PolarHBondContact O-N 2.84Å; I467-Y471 VanDerWaalsContact O-CB 3.31Å; I467-Y471 WeakPolarHBondContact O-CB 3.43Å; I467-Y471 PolarHBondContact O-N 3.27Å
468	F	84.8	Confident	76.4	Confident	121 Å²	121	103.9 Å²	103.9	53%	0.531	53%	0.532	S	S	.	.	H	α-helix	trans	-64.9	-41.4	178.3	-172.9	-110	0	0	0	112.2	F464 F465 I466 Y471 I472	F464-F468 WeakPolarHBondContact O-CB 3.27Å; F464-F468 PolarHBondContact O-N 3.23Å; F465-F468 PolarHBondContact O-N 2.93Å; I466-F468 VanDerWaalsContact C-N 3.32Å; I466-F468 PolarHBondContact O-N 3.33Å; F468-Y471 PolarHBondContact O-N 3.11Å; F468-I472 HydrophobicContact CD1-CD1 3.95Å; F468-I472 HydrophobicContact CE1-CD1 3.4Å; F468-I472 HydrophobicContact CE1-CG1 4.44Å; F468-I472 HydrophobicContact CE2-CD1 4.14Å; F468-I472 HydrophobicContact CZ-CD1 3.52Å; F468-I472 HydrophobicContact CZ-CG1 4.4Å; F468-I472 WeakPolarHBondContact O-CB 3.34Å; F468-I472 PolarHBondContact O-N 3.36Å
469	V	78.2	Confident	74.8	Confident	73 Å²	73	106.1 Å²	106.1	44%	0.442	54%	0.541	S	S	.	.	H	α-helix	trans	-65.4	-40.5	173.6	171.9	0	0	0	0	111.5	F465 I466 Y471 S473	F465-V469 HydrophobicContact CD1-CG2 4.22Å; F465-V469 HydrophobicContact CE1-CG2 3.9Å; F465-V469 HydrophobicContact CZ-CG2 4.17Å; F465-V469 WeakPolarHBondContact O-CG2 3.28Å; F465-V469 PolarHBondContact O-N 3.1Å; I466-V469 PolarHBondContact O-N 3.19Å; V469-Y471 VanDerWaalsContact C-N 3.34Å; V469-S473 WeakPolarHBondContact O-CB 3.35Å; V469-S473 PolarHBondContact O-N 2.88Å; V469-S473 PolarHBondContact O-OG 2.93Å
470	V	77.3	Confident	73	Confident	62 Å²	62	104.4 Å²	104.4	38%	0.376	54%	0.536	S	S	.	.	H	α-helix	trans	-66.6	-35	174.1	170.7	0	0	0	0	111.8	I466 I467 S473 R474	I466-V470 WeakPolarHBondContact O-CG2 3.48Å; I466-V470 PolarHBondContact O-N 3.21Å; I467-V470 PolarHBondContact O-N 2.84Å; V470-S473 WeakPolarHBondContact CA-OG 3.49Å; V470-S473 PolarHBondContact O-OG 2.91Å; V470-R474 WeakPolarHBondContact O-CB 3.48Å; V470-R474 VanDerWaalsContact O-CG 3.32Å; V470-R474 WeakPolarHBondContact O-CG 3.45Å; V470-R474 PolarHBondContact O-N 3.38Å; V470-R474 VanDerWaalsContact O-N 3.16Å
471	Y	84.4	Confident	71.2	Confident	126 Å²	126	106.8 Å²	106.8	49%	0.494	55%	0.549	S	S	.	.	H	α-helix	trans	-69.8	-47.9	175.5	-179.7	-96.3	0	0	0	111.7	I467 F468 V469 R474 K475	I467-Y471 VanDerWaalsContact O-CB 3.31Å; I467-Y471 WeakPolarHBondContact O-CB 3.43Å; I467-Y471 PolarHBondContact O-N 3.27Å; F468-Y471 PolarHBondContact O-N 3.11Å; V469-Y471 VanDerWaalsContact C-N 3.34Å; Y471-R474 PolarHBondContact O-N 3.41Å; Y471-K475 HydrophobicContact CD1-CD 4.42Å; Y471-K475 HydrophobicContact CE1-CD 3.58Å; Y471-K475 VanDerWaalsContact O-CB 3.27Å; Y471-K475 WeakPolarHBondContact O-CB 3.45Å; Y471-K475 PolarHBondContact O-N 3Å; Y471-K475 PolarHBondContact OH-NZ 3.38Å
472	I	71.8	Confident	69.5	Low	71 Å²	71	110 Å²	110	36%	0.364	56%	0.557	S	S	.	*	H	α-helix	trans	-63.7	-46.6	177.5	-76.2	-176.2	0	0	0	111.2	F468 R474 K475 C476	F468-I472 HydrophobicContact CD1-CD1 3.95Å; F468-I472 HydrophobicContact CE1-CD1 3.4Å; F468-I472 HydrophobicContact CE1-CG1 4.44Å; F468-I472 HydrophobicContact CE2-CD1 4.14Å; F468-I472 HydrophobicContact CZ-CD1 3.52Å; F468-I472 HydrophobicContact CZ-CG1 4.4Å; F468-I472 WeakPolarHBondContact O-CB 3.34Å; F468-I472 PolarHBondContact O-N 3.36Å; I472-R474 VanDerWaalsContact C-N 3.27Å; I472-R474 PolarHBondContact O-N 2.95Å; I472-K475 PolarHBondContact O-N 2.98Å; I472-C476 WeakPolarHBondContact O-CB 3.39Å; I472-C476 PolarHBondContact O-N 3.08Å
473	S	64.8	Low	67.6	Low	68 Å²	68	116.9 Å²	116.9	48%	0.476	57%	0.573	S	S	.	*	H	α-helix	trans	-61.6	-34.3	177.2	53.7	0	0	0	0	112.8	V469 V470	V469-S473 WeakPolarHBondContact O-CB 3.35Å; V469-S473 PolarHBondContact O-N 2.88Å; V469-S473 PolarHBondContact O-OG 2.93Å; V470-S473 WeakPolarHBondContact CA-OG 3.49Å; V470-S473 PolarHBondContact O-OG 2.91Å
474	R	63.9	Low	65.6	Low	201 Å²	201	116.9 Å²	116.9	76%	0.758	58%	0.577	S	S	*	*	H	α-helix	trans	-71.9	-30.2	171	-78.3	176.8	162	156.6	-3.3	114.1	V470 Y471 I472	V470-R474 WeakPolarHBondContact O-CB 3.48Å; V470-R474 VanDerWaalsContact O-CG 3.32Å; V470-R474 WeakPolarHBondContact O-CG 3.45Å; V470-R474 PolarHBondContact O-N 3.38Å; V470-R474 VanDerWaalsContact O-N 3.16Å; Y471-R474 PolarHBondContact O-N 3.41Å; I472-R474 VanDerWaalsContact C-N 3.27Å; I472-R474 PolarHBondContact O-N 2.95Å
475	K	66.4	Low	63.6	Low	132 Å²	132	120.7 Å²	120.7	57%	0.574	59%	0.588	S	S	*	*	H	α-helix	trans	-90.5	-30.6	-175.5	-164.5	171.4	-174.4	178	0	113.7	Y471 I472 P478	Y471-K475 HydrophobicContact CD1-CD 4.42Å; Y471-K475 HydrophobicContact CE1-CD 3.58Å; Y471-K475 VanDerWaalsContact O-CB 3.27Å; Y471-K475 WeakPolarHBondContact O-CB 3.45Å; Y471-K475 PolarHBondContact O-N 3Å; Y471-K475 PolarHBondContact OH-NZ 3.38Å; I472-K475 PolarHBondContact O-N 2.98Å; K475-P478 WeakPolarHBondContact O-CD 3.46Å
476	C	56.5	Low	61.5	Low	96 Å²	96	120.1 Å²	120.1	65%	0.649	59%	0.587	S	S	*	*	H	α-helix	trans	-89.6	-9	-179.9	-68	0	0	0	0	114.2	I472 P478	I472-C476 WeakPolarHBondContact O-CB 3.39Å; I472-C476 PolarHBondContact O-N 3.08Å; C476-P478 VanDerWaalsContact C-CD 3.5Å
477	C	56.1	Low	59.5	Low	84 Å²	84	119.2 Å²	119.2	57%	0.568	59%	0.588	S	S	*	*			trans	-127.4	55.1	177.4	-77.6	0	0	0	0	117
478	P	46.2	Very low	57.7	Low	95 Å²	95	118.1 Å²	118.1	62%	0.617	59%	0.588	S	S	*	*			trans	-98.6	106.9	160	34.5	-25.2	0	0	0	109.9	K475 C476	K475-P478 WeakPolarHBondContact O-CD 3.46Å; C476-P478 VanDerWaalsContact C-CD 3.5Å
479	P	45.6	Very low	55.9	Low	104 Å²	104	114.7 Å²	114.7	68%	0.675	58%	0.582	S	S	*	*	S	Bend		-149.3	14	56.5	39.1	-18	0	0	0	116.6	L481 R482	P479-L481 PolarHBondContact O-N 2.88Å; P479-R482 PolarHBondContact O-N 3.32Å
480	T	44.3	Very low	54.6	Low	93 Å²	93	115.3 Å²	115.3	57%	0.571	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.7	-38.6	-164.3	47	0	0	0	0	114.9	R482 R483	T480-R482 PolarHBondContact O-N 2.97Å; T480-R483 PolarHBondContact O-N 3.16Å; T480-R483 VanDerWaalsContact O-N 3.1Å
481	L	48.6	Very low	53.3	Low	131 Å²	131	118.8 Å²	118.8	69%	0.686	59%	0.594	S	S	*	*	H	α-helix	trans	-61	-17.3	-177.3	-83.8	164	0	0	0	114.9	P479	P479-L481 PolarHBondContact O-N 2.88Å
482	R	47.9	Very low	51.6	Low	219 Å²	219	117.6 Å²	117.6	83%	0.826	60%	0.596	S	S	*	*	H	α-helix	trans	-78.9	-26.8	175.8	-71.3	-172.6	178.6	-178	0.4	113.6	P479 T480	P479-R482 PolarHBondContact O-N 3.32Å; T480-R482 PolarHBondContact O-N 2.97Å
483	R	45.1	Very low	50.6	Low	209 Å²	209	123.8 Å²	123.8	79%	0.789	62%	0.615	S	S	*	*	H	α-helix	trans	-74.3	-41.8	179.6	-90.6	-173.1	170.1	-176.4	-2.5	112.7	T480 R485 H486 C487	T480-R483 PolarHBondContact O-N 3.16Å; T480-R483 VanDerWaalsContact O-N 3.1Å; R483-R485 PolarHBondContact O-N 3.17Å; R483-H486 PolarHBondContact O-N 3.43Å; R483-C487 PolarHBondContact O-N 3.09Å; R483-C487 VanDerWaalsContact O-N 3.16Å
484	I	47.7	Very low	49.8	Very low	121 Å²	121	129.8 Å²	129.8	62%	0.621	63%	0.627	S	S	*	*	H	α-helix	trans	-59.8	-45.1	-175.3	-61.3	175.7	0	0	0	111.6	H486 C487 S488	I484-H486 PolarHBondContact O-N 3.38Å; I484-C487 PolarHBondContact O-N 3.48Å; I484-S488 PolarHBondContact O-N 3.01Å
485	R	45.8	Very low	49.2	Very low	207 Å²	207	126.2 Å²	126.2	78%	0.781	62%	0.619	S	S	*	*	H	α-helix	trans	-64.5	-24.4	176.8	-69	-173.7	176.2	-172.8	-1.6	113.8	R483 S488	R483-R485 PolarHBondContact O-N 3.17Å; R485-S488 PolarHBondContact O-OG 3.09Å
486	H	44.5	Very low	48.4	Very low	127 Å²	127	126.2 Å²	126.2	59%	0.588	62%	0.623	S	S	*	*	H	α-helix	trans	-86.6	-26.3	-179.3	-148.1	-54.9	0	0	0	112.8	R483 I484 I490	R483-H486 PolarHBondContact O-N 3.43Å; I484-H486 PolarHBondContact O-N 3.38Å; H486-I490 WeakPolarHBondContact O-CD1 3.35Å; H486-I490 WeakPolarHBondContact O-CG1 3.36Å; H486-I490 PolarHBondContact O-N 3.05Å
487	C	43.7	Very low	47.9	Very low	81 Å²	81	131.5 Å²	131.5	55%	0.547	63%	0.629	S	S	.	*	H	α-helix	trans	-71.7	-48.3	173.9	-69.1	0	0	0	0	112	R483 I484 A489 I490 Q491	R483-C487 PolarHBondContact O-N 3.09Å; R483-C487 VanDerWaalsContact O-N 3.16Å; I484-C487 PolarHBondContact O-N 3.48Å; C487-A489 VanDerWaalsContact C-N 3.35Å; C487-A489 PolarHBondContact O-N 3.27Å; C487-I490 PolarHBondContact O-N 3.04Å; C487-Q491 PolarHBondContact O-N 3.39Å
488	S	47.5	Very low	47.4	Very low	60 Å²	60	132.7 Å²	132.7	42%	0.42	63%	0.634	S	S	.	*	H	α-helix	trans	-61.9	-40.4	-179.9	57.5	0	0	0	0	112.7	I484 R485 I490 Q491 N492	I484-S488 PolarHBondContact O-N 3.01Å; R485-S488 PolarHBondContact O-OG 3.09Å; S488-I490 VanDerWaalsContact C-N 3.31Å; S488-I490 PolarHBondContact O-N 3.42Å; S488-Q491 PolarHBondContact O-N 3.1Å; S488-N492 PolarHBondContact O-N 3.3Å; S488-N492 PolarHBondContact O-OD1 3.28Å
489	A	47.4	Very low	47.5	Very low	49 Å²	49	136 Å²	136	41%	0.405	64%	0.641	S	S	.	*	H	α-helix	trans	-61.8	-35.3	176.1	0	0	0	0	0	113.4	C487 R493	C487-A489 VanDerWaalsContact C-N 3.35Å; C487-A489 PolarHBondContact O-N 3.27Å; A489-R493 WeakPolarHBondContact O-CB 3.43Å; A489-R493 WeakPolarHBondContact O-CG 3.4Å; A489-R493 PolarHBondContact O-N 3.4Å
490	I	51.3	Low	47.3	Very low	86 Å²	86	139.2 Å²	139.2	44%	0.441	65%	0.647	S	S	.	*	H	α-helix	trans	-74.5	-37.7	176	-70.1	171.4	0	0	0	110.9	H486 C487 S488 R493 R494	H486-I490 WeakPolarHBondContact O-CD1 3.35Å; H486-I490 WeakPolarHBondContact O-CG1 3.36Å; H486-I490 PolarHBondContact O-N 3.05Å; C487-I490 PolarHBondContact O-N 3.04Å; S488-I490 VanDerWaalsContact C-N 3.31Å; S488-I490 PolarHBondContact O-N 3.42Å; I490-R493 PolarHBondContact O-N 3.06Å; I490-R494 PolarHBondContact O-N 2.89Å; I490-R494 VanDerWaalsContact O-N 3.09Å
491	Q	50.4	Low	47.1	Very low	134 Å²	134	145.5 Å²	145.5	63%	0.626	66%	0.661	S	S	*	*	H	α-helix	trans	-66.3	-48	179.9	-161.7	161.5	-4.1	0	0	111.3	C487 S488 R493 R494 Q495	C487-Q491 PolarHBondContact O-N 3.39Å; S488-Q491 PolarHBondContact O-N 3.1Å; Q491-R493 VanDerWaalsContact C-N 3.33Å; Q491-R493 PolarHBondContact O-N 3.45Å; Q491-R494 PolarHBondContact O-N 3.1Å; Q491-R494 VanDerWaalsContact O-N 3.09Å; Q491-Q495 PolarHBondContact O-N 3.33Å
492	N	49.3	Very low	46.6	Very low	102 Å²	102	148 Å²	148	55%	0.545	67%	0.669	S	S	.	*	H	α-helix	trans	-62.2	-38.3	175.7	-68.6	13.1	0	0	0	112.2	S488 R494 Q495 M496	S488-N492 PolarHBondContact O-N 3.3Å; S488-N492 PolarHBondContact O-OD1 3.28Å; N492-R494 VanDerWaalsContact C-N 3.29Å; N492-R494 PolarHBondContact O-N 3.31Å; N492-Q495 PolarHBondContact O-N 2.87Å; N492-M496 PolarHBondContact O-N 3.11Å; N492-M496 VanDerWaalsContact O-N 3.1Å
493	R	49.6	Very low	46.4	Very low	201 Å²	201	143.3 Å²	143.3	76%	0.758	67%	0.667	S	S	*	*	H	α-helix	trans	-67.9	-23.3	175.1	-81.3	-176.3	171.3	-168.7	-1.7	114	A489 I490 Q491 R497	A489-R493 WeakPolarHBondContact O-CB 3.43Å; A489-R493 WeakPolarHBondContact O-CG 3.4Å; A489-R493 PolarHBondContact O-N 3.4Å; I490-R493 PolarHBondContact O-N 3.06Å; Q491-R493 VanDerWaalsContact C-N 3.33Å; Q491-R493 PolarHBondContact O-N 3.45Å; R493-R497 WeakPolarHBondContact O-CG 3.4Å
494	R	47.3	Very low	45.9	Very low	193 Å²	193	142.3 Å²	142.3	73%	0.728	67%	0.673	S	S	*	*	H	α-helix	trans	-77.2	-45.7	169.5	-77.2	-176.1	171.1	-171.4	-3.5	111	I490 Q491 N492 M496 R497 T498	I490-R494 PolarHBondContact O-N 2.89Å; I490-R494 VanDerWaalsContact O-N 3.09Å; Q491-R494 PolarHBondContact O-N 3.1Å; Q491-R494 VanDerWaalsContact O-N 3.09Å; N492-R494 VanDerWaalsContact C-N 3.29Å; N492-R494 PolarHBondContact O-N 3.31Å; R494-M496 PolarHBondContact O-N 2.95Å; R494-R497 PolarHBondContact O-N 3.13Å; R494-T498 PolarHBondContact O-N 2.85Å; R494-T498 PolarHBondContact O-OG1 3.22Å
495	Q	51.6	Low	45.1	Very low	126 Å²	126	140.9 Å²	140.9	59%	0.589	68%	0.679	S	S	*	*	H	α-helix	trans	-61.4	-42.8	-176.2	-150.2	166.5	6.4	0	0	112.7	Q491 N492 R497 T498	Q491-Q495 PolarHBondContact O-N 3.33Å; N492-Q495 PolarHBondContact O-N 2.87Å; Q495-R497 VanDerWaalsContact C-N 3.31Å; Q495-R497 PolarHBondContact O-N 3.06Å; Q495-T498 PolarHBondContact O-N 3.35Å; Q495-T498 PolarHBondContact O-OG1 3.38Å
496	M	50.4	Low	44.3	Very low	133 Å²	133	138.1 Å²	138.1	66%	0.655	68%	0.68	S	S	*	*	H	α-helix	trans	-62.1	-33.1	173	-76.2	-70	-178.7	0	0	113.6	N492 R494 Q499	N492-M496 PolarHBondContact O-N 3.11Å; N492-M496 VanDerWaalsContact O-N 3.1Å; R494-M496 PolarHBondContact O-N 2.95Å; M496-Q499 PolarHBondContact O-N 2.93Å
497	R	45	Very low	43.7	Very low	207 Å²	207	140.2 Å²	140.2	78%	0.781	70%	0.695	S	S	*	*	H	α-helix	trans	-74.8	-23.5	179.4	-80.8	-176.4	169	-167.5	-3.5	113.5	R493 R494 Q495	R493-R497 WeakPolarHBondContact O-CG 3.4Å; R494-R497 PolarHBondContact O-N 3.13Å; Q495-R497 VanDerWaalsContact C-N 3.31Å; Q495-R497 PolarHBondContact O-N 3.06Å
498	T	46.4	Very low	43.1	Very low	109 Å²	109	140.4 Å²	140.4	67%	0.669	70%	0.702	S	S	*	*	H	α-helix	trans	-79.1	-23.5	173.2	25.9	0	0	0	0	113.7	R494 Q495	R494-T498 PolarHBondContact O-N 2.85Å; R494-T498 PolarHBondContact O-OG1 3.22Å; Q495-T498 PolarHBondContact O-N 3.35Å; Q495-T498 PolarHBondContact O-OG1 3.38Å
499	Q	48	Very low	42.2	Very low	163 Å²	163	143.5 Å²	143.5	76%	0.762	72%	0.719	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.8	-9	177.8	-90.1	-179.5	-34.2	0	0	114.8	M496	M496-Q499 PolarHBondContact O-N 2.93Å
500	Q	42.7	Very low	41.4	Very low	173 Å²	173	150.2 Å²	150.2	81%	0.808	74%	0.742	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.7	21.3	179	-73.1	-171	-35.2	0	0	114.1
501	R	39.5	Very low	40.3	Very low	224 Å²	224	152.1 Å²	152.1	85%	0.845	76%	0.757	S	S	*	*			trans	-136.2	60.5	176.8	-86.7	-165.1	167.7	-162.2	-4.6	114.3
502	Q	37.3	Very low	39.6	Very low	184 Å²	184	151.5 Å²	151.5	86%	0.86	77%	0.765	S	S	*	*			trans	-157.7	125.4	152.4	-100.4	155.1	-4.1	0	0	104.2
503	P	43.7	Very low	38.5	Very low	120 Å²	120	156.4 Å²	156.4	78%	0.779	78%	0.777	S	S	*	*	S	Bend		-126.1	-165.7	52.2	42.4	-31.5	0	0	0	114.8
504	M	35.3	Very low	37.4	Very low	188 Å²	188	154 Å²	154	93%	0.926	78%	0.779	S	S	*	*			trans	72.3	92.1	177.5	-62.9	-151.2	-95.5	0	0	117.1
505	A	31	Very low	36.4	Very low	91 Å²	91	152.3 Å²	152.3	75%	0.752	78%	0.78	S	S	*	*			trans	-153.4	111	144.3	0	0	0	0	0	108.6
506	D	28.6	Very low	35.1	Very low	150 Å²	150	156.6 Å²	156.6	80%	0.802	79%	0.792	S	S	*	*			trans	22.2	137.4	146.7	-43.1	-40.1	0	0	0	120.3
507	L	32.3	Very low	34	Very low	171 Å²	171	158.3 Å²	158.3	90%	0.895	80%	0.799	S	S	*	*			cis	66.9	63.1	39.6	-163.2	72	0	0	0	114.9
508	A	30.1	Very low	33.9	Very low	85 Å²	85	152.9 Å²	152.9	70%	0.702	79%	0.79	S	S	*	*			trans	-158.9	164.6	156.9	0	0	0	0	0	113.6
509	T	29.6	Very low	33.1	Very low	124 Å²	124	152.7 Å²	152.7	76%	0.761	79%	0.793	S	S	*	*			trans	61.2	87.9	158.3	52.9	0	0	0	0	120.7
510	Q	29.6	Very low	32.3	Very low	190 Å²	190	152.6 Å²	152.6	89%	0.888	79%	0.792	S	S	*	*				60.1	142.6	116.7	-70.5	177.7	-23.1	0	0	122.8
511	V	28.5	Very low	31.8	Very low	126 Å²	126	152 Å²	152	76%	0.764	79%	0.79	S	S	*	*			trans	-103.7	153.1	178.5	-178.6	0	0	0	0	109.7
512	P	35.8	Very low	31.5	Very low	122 Å²	122	150.3 Å²	150.3	79%	0.792	79%	0.791	S	S	*	*				-135	146.3	122.6	34.5	-23	0	0	0	114.8
513	Y	26.4	Very low	31.1	Very low	204 Å²	204	144.9 Å²	144.9	80%	0.8	78%	0.784	S	S	*	*			trans	-33.7	145.2	173.9	-71.5	-101.6	0	0	0	118.3
514	N	26.7	Very low	30.6	Very low	150 Å²	150	143.8 Å²	143.8	80%	0.802	79%	0.785	S	S	*	*				-159.8	164	99.2	-100.9	3.5	0	0	0	113.7
515	E	25.1	Very low	30.3	Very low	159 Å²	159	142.5 Å²	142.5	74%	0.743	78%	0.781	S	S	*	*			trans	-67.4	170.6	-174.1	-59	154.3	125.9	0	0	112.8
516	Y	24.6	Very low	30.2	Very low	216 Å²	216	143.7 Å²	143.7	85%	0.847	78%	0.779	S	S	*	*			cis	-153.2	163	28.7	-159.4	-97.6	0	0	0	112.3
517	E	27.9	Very low	30.4	Very low	169 Å²	169	143.5 Å²	143.5	79%	0.79	78%	0.777	S	S	*	*			trans	-89.1	-170.1	-176.3	-115.6	-170.4	143.8	0	0	112.9
518	P	43.7	Very low	30.3	Very low	93 Å²	93	143.2 Å²	143.2	60%	0.604	77%	0.774	S	S	*	*			cis	-132	-179.7	-27.3	35.8	-18.9	0	0	0	113
519	S	28.1	Very low	30.2	Very low	104 Å²	104	146.9 Å²	146.9	73%	0.727	78%	0.782	S	S	*	*				161.4	115.4	112.3	48.9	0	0	0	0	114.2
520	H	32	Very low	30.1	Very low	162 Å²	162	144.5 Å²	144.5	75%	0.75	78%	0.782	S	S	*	*			trans	37.8	130.5	153.2	-61.3	-59.4	0	0	0	121.1
521	E	32.1	Very low	30.1	Very low	161 Å²	161	147.5 Å²	147.5	75%	0.752	79%	0.787	S	S	*	*			cis	60	145.4	48.8	-56.9	177.8	148.3	0	0	112.6
522	E	32.5	Very low	30.1	Very low	188 Å²	188	144.9 Å²	144.9	88%	0.879	79%	0.785	S	S	*	*			cis	-144.7	173.8	-9	-121.8	-179.3	160.1	0	0	105.1
523	G	29.7	Very low	29.7	Very low	69 Å²	69	148.1 Å²	148.1	71%	0.711	79%	0.79	S	S	*	*			cis	-179.8	175	6.2	0	0	0	0	0	107.7
524	A	33.4	Very low	29.6	Very low	97 Å²	97	144.4 Å²	144.4	80%	0.802	79%	0.793	S	S	*	*			trans	-100.8	160.1	-179.1	0	0	0	0	0	112.7
525	L	28.9	Very low	29.7	Very low	162 Å²	162	146.4 Å²	146.4	85%	0.848	79%	0.794	S	S	*	*			trans	176.9	118.9	147.8	-89.8	151.9	0	0	0	106.5
526	V	28.9	Very low	29.7	Very low	115 Å²	115	145 Å²	145	70%	0.697	80%	0.8	S	S	*	*				83	104.7	68.1	171.5	0	0	0	0	114.1
527	I	32.1	Very low	29.8	Very low	147 Å²	147	143.8 Å²	143.8	75%	0.754	80%	0.802	S	S	*	*			trans	45	122.9	143.2	-51.5	172.2	0	0	0	119.6
528	I	30.5	Very low	29.8	Very low	164 Å²	164	145 Å²	145	84%	0.841	81%	0.808	S	S	*	*			trans	-151.1	147.7	139.1	-102.2	151.3	0	0	0	109.2
529	N	27.7	Very low	29.1	Very low	162 Å²	162	149 Å²	149	87%	0.866	82%	0.823	S	S	*	*			trans	-83.2	144.2	175.5	-78.5	-35	0	0	0	111.8
530	G	28.1	Very low	29.3	Very low	75 Å²	75	149.4 Å²	149.4	77%	0.773	82%	0.824	S	S	*	*			trans	-165.8	129.9	170	0	0	0	0	0	113.2
531	Y	29.4	Very low	29.1	Very low	253 Å²	253	150 Å²	150	99%	0.992	82%	0.82	S	S	*	*			trans	-78.4	134.9	174.4	-78	-101.1	0	0	0	110.7
532	G	27.8	Very low	29	Very low	70 Å²	70	150.2 Å²	150.2	72%	0.722	82%	0.819	S	S	*	*			trans	-154.5	132	174.4	0	0	0	0	0	112.3
533	Q	27.1	Very low	29.1	Very low	190 Å²	190	147.8 Å²	147.8	89%	0.888	81%	0.808	S	S	*	*			trans	-89.3	112.1	179.1	-67.3	-179.4	-6.9	0	0	111.1	K535	Q533-K535 PolarHBondContact O-N 2.78Å
534	C	25.6	Very low	29	Very low	127 Å²	127	150.9 Å²	150.9	86%	0.858	82%	0.817	S	S	*	*			trans	-89.2	102.5	170.2	-67.1	0	0	0	0	111
535	K	27.8	Very low	28.8	Very low	191 Å²	191	155.3 Å²	155.3	83%	0.83	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-77.4	123.2	161.2	-75.4	-179.9	176.6	175.8	0	109	Q533 Q537	Q533-K535 PolarHBondContact O-N 2.78Å; K535-Q537 PolarHBondContact O-N 3.1Å
536	C	25	Very low	29.3	Very low	130 Å²	130	158 Å²	158	88%	0.878	84%	0.844	S	S	*	*	P	Polyproline II helix	trans	-74.2	124.2	168	-61.2	0	0	0	0	110
537	Q	28	Very low	29.3	Very low	190 Å²	190	160.2 Å²	160.2	89%	0.888	85%	0.851	S	S	*	*	P	Polyproline II helix	trans	-103.8	142.6	157	-79.6	-177.1	-61.5	0	0	109.1	K535	K535-Q537 PolarHBondContact O-N 3.1Å
538	Q	27.5	Very low	29.1	Very low	196 Å²	196	160.9 Å²	160.9	92%	0.916	86%	0.857	S	S	*	*	P	Polyproline II helix	trans	-79.4	141	176.6	-64	169.5	-78.7	0	0	110.1
539	L	28.2	Very low	29.1	Very low	175 Å²	175	160.7 Å²	160.7	92%	0.916	86%	0.857	S	S	*	*			trans	-115.1	125.8	163.2	-79.8	168.8	0	0	0	108.7
540	P	32.9	Very low	29.2	Very low	113 Å²	113	160.6 Å²	160.6	73%	0.734	86%	0.857	S	S	*	*			trans	-98.2	170.9	173.4	38	-33.9	0	0	0	112.7
541	Y	28.3	Very low	29.2	Very low	174 Å²	174	166 Å²	166	68%	0.682	86%	0.862	S	S	*	*			trans	83.6	111.8	147.5	-149.6	-63.6	0	0	0	119.2
542	K	30.1	Very low	29.2	Very low	166 Å²	166	160.2 Å²	160.2	72%	0.722	85%	0.853	S	S	*	*				171	135.2	112	-161.7	111.4	-153.6	148.1	0	111.4
543	E	34	Very low	29.3	Very low	138 Å²	138	166.6 Å²	166.6	65%	0.645	86%	0.863	S	S	*	*			trans	-76.1	160.7	161.3	-45.2	94.7	141.3	0	0	112
544	C	27.2	Very low	29.5	Very low	134 Å²	134	164.8 Å²	164.8	91%	0.905	86%	0.861	S	S	*	*			trans	-143.2	131	146.4	-86.5	0	0	0	0	108.6
545	E	30.8	Very low	29.8	Very low	189 Å²	189	168 Å²	168	88%	0.883	86%	0.861	S	S	*	*			trans	-89.6	138.2	164.3	-59.9	171.7	120.6	0	0	109.5
546	V	38.1	Very low	30	Very low	220 Å²	220	165.9 Å²	165.9	100%	1.333	86%	0.864	S	S	*	*				-151.2	0	125.4	-177	0	0	0	0	107.2

Retrieved 546 of 546 residues in 401.9 ms (Link to these results)

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