A0A096MWQ6_PAPAN Loading...

Hyaluronidase-3

Facilitates sperm penetration into the layer of cumulus cells surrounding the egg by digesting hyaluronic acid. Involved in induction of the acrosome reaction in the sperm. Involved in follicular atresia, the breakdown of immature ovarian follicles that are not selected to ovulate. Induces ovarian granulosa cell apoptosis, possibly via apoptotic signaling pathway involving CASP8 and CASP3 activation, and poly(ADP-ribose) polymerase (PARP) cleavage. Has no hyaluronidase activity in embryonic fibroblasts in vitro. Has no hyaluronidase activity in granulosa cells in vitro.

AlphaFold DB , UniProt , Accession A0A096MWQ6, Species PAPAN (Papio anubis, Olive baboon), Gene HYAL3, Length 417 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	33.5	Very low	33.3	Very low	233 Å²	233	147.9 Å²	147.9	100%	1.148	85%	0.845	S	S	*	*				0	119.6	0	-73.9	163.4	70	0	0	106.8
2	T	33.6	Very low	33	Very low	136 Å²	136	141.4 Å²	141.4	83%	0.834	83%	0.834	S	S	*	*			cis	-162.9	130.6	3.4	10	0	0	0	0	104.6
3	M	32.2	Very low	33.1	Very low	169 Å²	169	140.1 Å²	140.1	83%	0.833	83%	0.828	S	S	*	*			trans	-67.5	143.2	173.2	-70.3	164.5	70.7	0	0	110.4
4	Q	31.4	Very low	32.9	Very low	200 Å²	200	136.1 Å²	136.1	94%	0.935	82%	0.819	S	S	*	*			trans	-132.8	117.5	158.6	-97.1	-179.7	-33.7	0	0	110.3
5	L	34.5	Very low	32.8	Very low	158 Å²	158	137 Å²	137	83%	0.827	82%	0.817	S	S	*	*			trans	-74.6	149.9	176.6	-76.5	104.9	0	0	0	111.2
6	G	33.5	Very low	32.6	Very low	68 Å²	68	136 Å²	136	70%	0.701	82%	0.817	S	S	*	*			trans	-73.7	174.2	177.2	0	0	0	0	0	114.7	A8	G6-A8 PolarHBondContact O-N 3.4Å
7	P	34.7	Very low	32.6	Very low	137 Å²	137	136.9 Å²	136.9	89%	0.89	82%	0.815	S	S	*	*			trans	-86.3	109.5	178.8	32.8	-28.2	0	0	0	110.1
8	A	33.8	Very low	32.5	Very low	88 Å²	88	133.7 Å²	133.7	73%	0.727	82%	0.815	S	S	*	*			trans	-73.8	122.9	163	0	0	0	0	0	109.2	G6 V10	G6-A8 PolarHBondContact O-N 3.4Å; A8-V10 PolarHBondContact O-N 3.19Å
9	L	31.5	Very low	32.5	Very low	163 Å²	163	132.3 Å²	132.3	85%	0.853	81%	0.811	S	S	*	*			trans	-75	99.7	172.2	-143.4	97.9	0	0	0	108.2	L11	L9-L11 HydrophobicContact CD2-CD1 4.34Å; L9-L11 PolarHBondContact O-N 3.41Å
10	V	34.1	Very low	32.5	Very low	127 Å²	127	129.6 Å²	129.6	77%	0.77	81%	0.81	S	S	*	*			trans	-84.3	104.7	173.6	-179.9	0	0	0	0	108.1	A8 G12	A8-V10 PolarHBondContact O-N 3.19Å; V10-G12 PolarHBondContact O-N 3.12Å; V10-G12 VanDerWaalsContact O-N 3.12Å
11	L	33.7	Very low	32.4	Very low	148 Å²	148	129.6 Å²	129.6	78%	0.775	80%	0.8	S	S	*	*			trans	-68.5	102.3	162.5	-107.3	93.4	0	0	0	107.9	L9 V13	L9-L11 HydrophobicContact CD2-CD1 4.34Å; L9-L11 PolarHBondContact O-N 3.41Å; L11-V13 PolarHBondContact O-N 3.19Å; L11-V13 VanDerWaalsContact O-N 3.16Å
12	G	29.3	Very low	32.3	Very low	70 Å²	70	124.1 Å²	124.1	72%	0.722	78%	0.782	S	S	*	*			trans	-68.2	105.7	167.8	0	0	0	0	0	110	V10 A14	V10-G12 PolarHBondContact O-N 3.12Å; V10-G12 VanDerWaalsContact O-N 3.12Å; G12-A14 PolarHBondContact O-N 3.16Å
13	V	34.7	Very low	32.2	Very low	124 Å²	124	124 Å²	124	75%	0.752	78%	0.776	S	S	*	*			trans	-70.8	105.2	162.6	177.1	0	0	0	0	106.6	L11 L15	L11-V13 PolarHBondContact O-N 3.19Å; L11-V13 VanDerWaalsContact O-N 3.16Å; V13-L15 VanDerWaalsContact C-N 3.33Å; V13-L15 PolarHBondContact O-N 2.95Å
14	A	30.3	Very low	32.5	Very low	85 Å²	85	120.3 Å²	120.3	70%	0.702	76%	0.764	S	S	*	*			trans	-68	95.5	167.7	0	0	0	0	0	108.1	G12 C16	G12-A14 PolarHBondContact O-N 3.16Å; A14-C16 PolarHBondContact O-N 2.97Å
15	L	30.8	Very low	33	Very low	149 Å²	149	119.3 Å²	119.3	78%	0.78	76%	0.76	S	S	*	*			trans	-65.3	92.5	159.3	-88	147	0	0	0	106.8	V13 L17	V13-L15 VanDerWaalsContact C-N 3.33Å; V13-L15 PolarHBondContact O-N 2.95Å; L15-L17 PolarHBondContact O-N 3.41Å
16	C	29.4	Very low	33.4	Very low	121 Å²	121	115 Å²	115	82%	0.818	74%	0.74	S	S	*	*			trans	-63.9	88.9	161.6	-68.3	0	0	0	0	107.4	A14 G18	A14-C16 PolarHBondContact O-N 2.97Å; C16-G18 VanDerWaalsContact C-N 3.27Å; C16-G18 PolarHBondContact O-N 2.96Å
17	L	32.5	Very low	34.6	Very low	151 Å²	151	114 Å²	114	79%	0.791	72%	0.721	S	S	*	*			trans	-60	98.6	157	-77.7	159.8	0	0	0	106	L15 C19	L15-L17 PolarHBondContact O-N 3.41Å; L17-C19 PolarHBondContact O-N 2.74Å
18	G	32.1	Very low	36.1	Very low	79 Å²	79	115.4 Å²	115.4	81%	0.814	72%	0.715	S	S	*	*			trans	-67.5	78.4	174.5	0	0	0	0	0	110.3	C16	C16-G18 VanDerWaalsContact C-N 3.27Å; C16-G18 PolarHBondContact O-N 2.96Å
19	C	32.8	Very low	38.4	Very low	108 Å²	108	115.3 Å²	115.3	73%	0.73	70%	0.7	S	S	*	*			trans	-104.9	117.5	167.3	-84	0	0	0	0	108.5	L17	L17-C19 PolarHBondContact O-N 2.74Å
20	G	32	Very low	41.4	Very low	77 Å²	77	107.9 Å²	107.9	79%	0.794	66%	0.661	S	S	*	*			trans	105.5	49.1	171.4	0	0	0	0	0	116.1
21	Q	30.3	Very low	44.4	Very low	131 Å²	131	102.1 Å²	102.1	61%	0.612	63%	0.626	S	S	*	*			trans	-87.4	134	156.8	-70.5	-150.9	-70.2	0	0	109.7	H194	Q21-H194 PolarHBondContact NE2-CE1 3.19Å; Q21-H194 PolarHBondContact NE2-NE2 3.33Å
22	P	30.7	Very low	47.4	Very low	118 Å²	118	96.3 Å²	96.3	77%	0.766	60%	0.598	S	S	*	*			trans	-56.5	142.5	172.3	-0.8	6.2	0	0	0	109.8
23	L	30.9	Very low	50.6	Low	133 Å²	133	93 Å²	93	70%	0.696	56%	0.564	S	S	*	*			trans	-37.6	133.8	175.1	-73	151.6	0	0	0	110.7	Q25	L23-Q25 PolarHBondContact O-N 3.42Å
24	P	39.7	Very low	53.6	Low	91 Å²	91	87.6 Å²	87.6	59%	0.591	53%	0.53	S	S	*	.			trans	-57	122.2	175.7	13.5	-13.5	0	0	0	107.2	V26 C399	P24-V26 PolarHBondContact O-N 2.91Å; P24-C399 HydrophobicContact CG-CB 4.19Å
25	Q	40.8	Very low	56.9	Low	180 Å²	180	83.9 Å²	83.9	84%	0.841	50%	0.498	S	S	*	.			trans	-41.7	131.7	178	-66.4	178.7	-34.2	0	0	108.7	L23 P27	L23-Q25 PolarHBondContact O-N 3.42Å; Q25-P27 WeakPolarHBondContact O-CD 3.03Å
26	V	43.5	Very low	60	Low	67 Å²	67	76.9 Å²	76.9	41%	0.406	46%	0.461	S	S	.	.			trans	-43.4	121.5	169.4	174.3	0	0	0	0	106.5	P24 E28 G363 Y398	P24-V26 PolarHBondContact O-N 2.91Å; V26-E28 PolarHBondContact O-N 3.25Å; V26-G363 WeakPolarHBondContact CG1-O 3.5Å; V26-Y398 HydrophobicContact CG1-CD2 4.06Å; V26-Y398 HydrophobicContact CG1-CE2 3.99Å
27	P	58.3	Low	63.2	Low	47 Å²	47	71.2 Å²	71.2	31%	0.305	42%	0.423	S	S	.	.			trans	-52.4	121.3	178.8	-26.7	33.9	0	0	0	108.5	Q25 H29 Y398	Q25-P27 WeakPolarHBondContact O-CD 3.03Å; P27-H29 PolarHBondContact O-N 3.31Å; P27-Y398 HydrophobicContact CB-CE1 4.31Å; P27-Y398 HydrophobicContact CG-CD1 3.87Å; P27-Y398 HydrophobicContact CG-CD2 4.41Å; P27-Y398 HydrophobicContact CG-CE1 3.67Å; P27-Y398 HydrophobicContact CG-CE2 4.26Å; P27-Y398 HydrophobicContact CG-CG 4.25Å
28	E	66.1	Low	66.1	Low	166 Å²	166	65 Å²	65	78%	0.776	39%	0.392	S	S	*	.	S	Bend	trans	-54.6	-24.3	178.5	-69.8	-173.4	159	0	0	111.2	V26	V26-E28 PolarHBondContact O-N 3.25Å
29	H	82.9	Confident	69.1	Low	86 Å²	86	61.2 Å²	61.2	40%	0.398	35%	0.353	S	S	.	.			trans	-132.4	128.7	177.6	-55.4	-51.2	0	0	0	112.5	P27 F31	P27-H29 PolarHBondContact O-N 3.31Å; H29-F31 VanDerWaalsContact C-N 3.28Å; H29-F31 PolarHBondContact O-N 3.48Å
30	P	93.6	Very high	72.1	Confident	7 Å²	7	57.4 Å²	57.4	5%	0.045	33%	0.329	C	S	.	.	S	Bend	trans	-70	-24.7	174.4	28.2	-31.3	0	0	0	112.4	A353 M354 R366 Y398	P30-A353 VanDerWaalsContact CG-C 3.47Å; P30-A353 HydrophobicContact CG-CB 4.04Å; P30-A353 WeakPolarHBondContact CG-O 3.25Å; P30-M354 WeakPolarHBondContact CD-SD 3.43Å; P30-M354 HydrophobicContact CG-CG 4.29Å; P30-M354 HydrophobicContact CG-SD 3.93Å; P30-R366 HydrophobicContact CB-CG 3.91Å; P30-R366 WeakPolarHBondContact O-CD 3.4Å; P30-R366 PolarHBondContact O-NE 3.13Å; P30-Y398 WeakPolarHBondContact CA-OH 3.31Å; P30-Y398 WeakPolarHBondContact CB-OH 3.31Å
31	F	97.6	Very high	75.1	Confident	6 Å²	6	56.6 Å²	56.6	3%	0.026	31%	0.305	C	S	.	.	S	Bend	trans	-140.5	115.7	175.6	-173.6	-104.2	0	0	0	109.8	H29 V33 I305 A309 A313 V316 V349 T350 A353	H29-F31 VanDerWaalsContact C-N 3.28Å; H29-F31 PolarHBondContact O-N 3.48Å; F31-V33 HydrophobicContact CD1-CG2 4.33Å; F31-V33 HydrophobicContact CE1-CG2 3.97Å; F31-I305 HydrophobicContact CE1-CG2 3.7Å; F31-I305 HydrophobicContact CZ-CG2 3.82Å; F31-A309 HydrophobicContact CD1-CB 4.11Å; F31-A309 HydrophobicContact CD2-CB 3.81Å; F31-A309 HydrophobicContact CE1-CB 4.06Å; F31-A309 HydrophobicContact CE2-CB 3.77Å; F31-A309 HydrophobicContact CG-CB 3.98Å; F31-A309 HydrophobicContact CZ-CB 3.88Å; F31-A313 HydrophobicContact CE2-CB 4.44Å; F31-V316 HydrophobicContact CE1-CG2 4.48Å; F31-V316 HydrophobicContact CE2-CG1 4.33Å; F31-V316 HydrophobicContact CZ-CG1 3.81Å; F31-V316 HydrophobicContact CZ-CG2 4.2Å; F31-V349 HydrophobicContact CD1-CG1 4.36Å; F31-V349 HydrophobicContact CE1-CG1 4.14Å; F31-V349 HydrophobicContact CE1-CG2 4.43Å; F31-T350 HydrophobicContact CD1-CG2 4.2Å; F31-A353 HydrophobicContact CB-CB 3.8Å
32	S	96.5	Very high	78.3	Confident	27 Å²	27	50.4 Å²	50.4	19%	0.189	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	141.8	-177.2	-64.6	0	0	0	0	112.1	A314 G315 V316	S32-A314 PolarHBondContact N-O 3.1Å; S32-G315 CarbonylContact O-C 3.43Å; S32-G315 WeakPolarHBondContact O-CA 3.39Å; S32-V316 PolarHBondContact O-N 3.48Å
33	V	98.1	Very high	81.4	Confident	1 Å²	1	49.4 Å²	49.4	1%	0.006	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	109	174.6	-178.8	0	0	0	0	108.5	F31 I57 I58 V316 L318 V346 T350	F31-V33 HydrophobicContact CD1-CG2 4.33Å; F31-V33 HydrophobicContact CE1-CG2 3.97Å; V33-I57 HydrophobicContact CG1-CG1 4.27Å; V33-I57 HydrophobicContact CG1-CG2 4.4Å; V33-I58 PolarHBondContact O-N 3.41Å; V33-V316 HydrophobicContact CB-CG2 4.29Å; V33-V316 HydrophobicContact CG1-CG2 4.01Å; V33-V316 HydrophobicContact CG2-CG2 3.96Å; V33-L318 HydrophobicContact CG1-CD1 3.46Å; V33-L318 VanDerWaalsContact CG1-CD1 3.46Å; V33-L318 HydrophobicContact CG1-CD2 4.33Å; V33-L318 HydrophobicContact CG1-CG 3.78Å; V33-V346 HydrophobicContact CB-CG1 4.1Å; V33-V346 HydrophobicContact CG1-CG1 4.33Å; V33-V346 HydrophobicContact CG1-CG2 4.06Å; V33-V346 HydrophobicContact CG2-CG1 3.87Å; V33-V346 HydrophobicContact CG2-CG2 4.31Å; V33-T350 HydrophobicContact CG2-CG2 4.04Å
34	L	97.8	Very high	84.5	Confident	9 Å²	9	47.1 Å²	47.1	5%	0.047	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	140.5	-176.8	-62.4	100.1	0	0	0	111.7	I58 M70 P123 L282 V316 V317 L318	L34-I58 CarbonylContact C-O 3.53Å; L34-I58 WeakPolarHBondContact CA-O 3.4Å; L34-M70 HydrophobicContact CD2-CB 4.17Å; L34-M70 HydrophobicContact CD2-SD 4.47Å; L34-P123 HydrophobicContact CD2-CG 3.76Å; L34-L282 HydrophobicContact CD1-CD2 3.51Å; L34-V316 PolarHBondContact N-O 2.84Å; L34-V317 HydrophobicContact CB-CG2 4.39Å; L34-V317 HydrophobicContact CD1-CG2 4.37Å; L34-L318 WeakPolarHBondContact O-CB 3.33Å; L34-L318 PolarHBondContact O-N 2.95Å
35	W	97.8	Very high	87.2	Confident	7 Å²	7	51 Å²	51	3%	0.027	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	112.9	176.8	-167.9	-107	0	0	0	111.4	V37 S39 L50 L52 I57 I58 A59 L287 L318 L334 L338 L342	W35-V37 HydrophobicContact CD2-CB 4.1Å; W35-V37 HydrophobicContact CD2-CG2 3.88Å; W35-V37 VanDerWaalsContact CE2-CB 3.47Å; W35-V37 HydrophobicContact CE3-CG2 3.96Å; W35-V37 HydrophobicContact CH2-CB 4.15Å; W35-V37 HydrophobicContact CH2-CG2 3.71Å; W35-V37 HydrophobicContact CZ2-CB 3.51Å; W35-V37 HydrophobicContact CZ2-CG1 3.96Å; W35-V37 HydrophobicContact CZ2-CG2 3.6Å; W35-V37 HydrophobicContact CZ3-CG2 3.88Å; W35-V37 PolarHBondContact NE1-O 3.34Å; W35-S39 PolarHBondContact NE1-OG 2.95Å; W35-L50 HydrophobicContact CZ2-CD1 4.21Å; W35-L52 HydrophobicContact CB-CD1 4.41Å; W35-L52 HydrophobicContact CD2-CD1 3.93Å; W35-L52 HydrophobicContact CD2-CD2 3.82Å; W35-L52 HydrophobicContact CE3-CD2 3.86Å; W35-L52 HydrophobicContact CG-CD1 3.75Å; W35-L52 HydrophobicContact CG-CD2 4.41Å; W35-L52 HydrophobicContact CH2-CD2 4.09Å; W35-L52 HydrophobicContact CZ2-CD2 4.05Å; W35-L52 HydrophobicContact CZ3-CD2 4Å; W35-I57 HydrophobicContact CB-CG2 3.8Å; W35-I57 HydrophobicContact CD2-CG2 4.45Å; W35-I57 HydrophobicContact CE3-CG2 3.97Å; W35-I57 HydrophobicContact CG-CG2 4.46Å; W35-I58 PolarHBondContact N-O 3.3Å; W35-A59 HydrophobicContact CB-CB 3.74Å; W35-A59 HydrophobicContact CG-CB 4.22Å; W35-L287 HydrophobicContact CH2-CD1 3.66Å; W35-L287 HydrophobicContact CZ3-CD1 3.77Å; W35-L318 HydrophobicContact CE3-CB 4.11Å; W35-L318 HydrophobicContact CE3-CD1 3.85Å; W35-L318 HydrophobicContact CZ3-CB 4.47Å; W35-L318 HydrophobicContact CZ3-CD1 4.05Å; W35-L334 HydrophobicContact CH2-CD1 4.08Å; W35-L334 HydrophobicContact CH2-CD2 4.49Å; W35-L334 HydrophobicContact CZ2-CD2 4.19Å; W35-L338 HydrophobicContact CH2-CD1 4.14Å; W35-L338 HydrophobicContact CH2-CD2 3.88Å; W35-L338 HydrophobicContact CH2-CG 4.39Å; W35-L338 HydrophobicContact CZ3-CD2 3.82Å; W35-L342 HydrophobicContact CZ3-CD2 4.33Å
36	N	96.8	Very high	89.9	Confident	2 Å²	2	45.3 Å²	45.3	1%	0.011	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	42.6	172.7	-168.8	-134.2	0	0	0	110.8	F65 V317 L318	N36-F65 WeakPolarHBondContact ND2-CE2 3.45Å; N36-V317 HydrophobicContact CB-CG1 3.48Å; N36-V317 VanDerWaalsContact CB-CG1 3.48Å; N36-L318 CarbonylContact C-O 3.47Å; N36-L318 VanDerWaalsContact C-O 3.27Å; N36-L318 VanDerWaalsContact CA-O 3.3Å; N36-L318 WeakPolarHBondContact CA-O 3.5Å; N36-L318 PolarHBondContact N-O 2.9Å
37	V	96.3	Very high	92.5	Very high	3 Å²	3	44.3 Å²	44.3	2%	0.018	24%	0.239	C	C	.	.			trans	-99.8	135.3	171.2	-174.7	0	0	0	0	108.1	W35 S39 L287 L324	W35-V37 HydrophobicContact CD2-CB 4.1Å; W35-V37 HydrophobicContact CD2-CG2 3.88Å; W35-V37 VanDerWaalsContact CE2-CB 3.47Å; W35-V37 HydrophobicContact CE3-CG2 3.96Å; W35-V37 HydrophobicContact CH2-CB 4.15Å; W35-V37 HydrophobicContact CH2-CG2 3.71Å; W35-V37 HydrophobicContact CZ2-CB 3.51Å; W35-V37 HydrophobicContact CZ2-CG1 3.96Å; W35-V37 HydrophobicContact CZ2-CG2 3.6Å; W35-V37 HydrophobicContact CZ3-CG2 3.88Å; W35-V37 PolarHBondContact NE1-O 3.34Å; V37-S39 PolarHBondContact O-N 3.44Å; V37-L287 HydrophobicContact CG2-CD1 3.67Å; V37-L287 HydrophobicContact CG2-CG 4.36Å; V37-L324 HydrophobicContact CG1-CB 4.45Å; V37-L324 HydrophobicContact CG1-CD1 3.99Å
38	P	94.3	Very high	94.4	Very high	19 Å²	19	42.1 Å²	42.1	12%	0.123	22%	0.224	C	C	.	.			trans	-76.9	55.8	-178.6	34.5	-38.6	0	0	0	112.2	A40 F65 G320 L322 S325	P38-A40 PolarHBondContact O-N 3.15Å; P38-F65 HydrophobicContact CB-CD2 3.84Å; P38-F65 HydrophobicContact CB-CE2 4.16Å; P38-G320 WeakPolarHBondContact CD-O 3.46Å; P38-L322 HydrophobicContact CB-CD2 3.68Å; P38-L322 HydrophobicContact CB-CG 4.32Å; P38-L322 HydrophobicContact CG-CD2 3.78Å; P38-L322 HydrophobicContact CG-CG 3.98Å; P38-S325 PolarHBondContact O-OG 3.44Å
39	S	95.4	Very high	95.9	Very high	0 Å²	0	40 Å²	40	0%	0	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.9	4.3	-170.5	60.3	0	0	0	0	115.2	W35 V37 H41 C42 Q63	W35-S39 PolarHBondContact NE1-OG 2.95Å; V37-S39 PolarHBondContact O-N 3.44Å; S39-H41 PolarHBondContact O-N 3.38Å; S39-H41 VanDerWaalsContact O-N 3.08Å; S39-C42 WeakPolarHBondContact O-CB 3.29Å; S39-C42 PolarHBondContact O-N 3.09Å; S39-Q63 PolarHBondContact O-OE1 2.98Å; S39-Q63 PolarHBondContact OG-OE1 3.36Å
40	A	94.5	Very high	96.6	Very high	29 Å²	29	36.5 Å²	36.5	24%	0.24	20%	0.198	C	C	.	.	H	α-helix	trans	-55.9	-29.3	-178.7	0	0	0	0	0	113.5	P38 C42 A44 Q63	P38-A40 PolarHBondContact O-N 3.15Å; A40-C42 VanDerWaalsContact C-N 3.25Å; A40-C42 PolarHBondContact O-N 3.24Å; A40-A44 VanDerWaalsContact O-CB 3.24Å; A40-A44 WeakPolarHBondContact O-CB 3.29Å; A40-A44 PolarHBondContact O-N 3.31Å; A40-Q63 HydrophobicContact CB-CB 4.46Å
41	H	95	Very high	96.7	Very high	60 Å²	60	38.1 Å²	38.1	28%	0.278	21%	0.209	S	C	.	.	H	α-helix	trans	-61.7	-30.2	175.6	-67.9	163.5	0	0	0	113.3	S39 K43 A44 R45 F46	S39-H41 PolarHBondContact O-N 3.38Å; S39-H41 VanDerWaalsContact O-N 3.08Å; H41-K43 PolarHBondContact O-N 2.97Å; H41-A44 PolarHBondContact O-N 3.19Å; H41-R45 HydrophobicContact CB-CG 4.41Å; H41-R45 WeakPolarHBondContact O-CA 3.35Å; H41-R45 WeakPolarHBondContact O-CB 3.27Å; H41-R45 PolarHBondContact O-N 2.96Å; H41-F46 HydrophobicContact CB-CE2 4.48Å; H41-F46 PolarHBondContact O-N 3.23Å
42	C	97.4	Very high	96.7	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-57.8	-50.4	-178.6	-65.2	0	0	0	0	111.9	S39 A40 F46 G47 V48 C331	S39-C42 WeakPolarHBondContact O-CB 3.29Å; S39-C42 PolarHBondContact O-N 3.09Å; A40-C42 VanDerWaalsContact C-N 3.25Å; A40-C42 PolarHBondContact O-N 3.24Å; C42-F46 CarbonylContact O-C 3.57Å; C42-F46 WeakPolarHBondContact O-CA 3.37Å; C42-F46 WeakPolarHBondContact O-CB 3.48Å; C42-F46 PolarHBondContact O-N 3.44Å; C42-G47 PolarHBondContact O-N 3.19Å; C42-V48 CarbonylContact C-O 3.58Å; C42-V48 HydrophobicContact CB-CB 4.27Å; C42-V48 PolarHBondContact O-N 2.84Å; C42-C331 WeakPolarHBondContact CA-SG 3.49Å; C42-C331 HydrophobicContact CB-CB 3.65Å; C42-C331 WeakPolarHBondContact CB-SG 3.18Å; C42-C331 WeakPolarHBondContact SG-CB 3.21Å; C42-C331 CovalentContact SG-SG 2.04Å; C42-C331 PolarHBondContact SG-SG 2.86Å
43	K	96.3	Very high	96.6	Very high	97 Å²	97	44 Å²	44	42%	0.422	24%	0.239	S	C	.	.	H	α-helix	trans	-74.3	-49.7	174.4	-177.2	-177.4	171.6	-170.2	0	111.5	H41 R45 G47 V48 D62	H41-K43 PolarHBondContact O-N 2.97Å; K43-R45 PolarHBondContact O-N 3.15Å; K43-G47 PolarHBondContact O-N 2.95Å; K43-V48 WeakPolarHBondContact CA-O 3.34Å; K43-V48 PolarHBondContact N-O 3.34Å; K43-D62 IonicContact NZ-OD1 3.66Å; K43-D62 PolarHBondContact NZ-OD1 3.27Å
44	A	95.9	Very high	96.5	Very high	85 Å²	85	47.9 Å²	47.9	70%	0.702	27%	0.27	S	S	*	.	H	α-helix	trans	-70.3	-28.4	-168	0	0	0	0	0	114.3	A40 H41	A40-A44 VanDerWaalsContact O-CB 3.24Å; A40-A44 WeakPolarHBondContact O-CB 3.29Å; A40-A44 PolarHBondContact O-N 3.31Å; H41-A44 PolarHBondContact O-N 3.19Å
45	R	96.7	Very high	96.4	Very high	174 Å²	174	48.3 Å²	48.3	66%	0.657	27%	0.273	S	S	*	.	H	α-helix	trans	-111	-35.1	-178.2	-62.1	-174.6	173.7	-164.4	-2.2	113.3	H41 K43	H41-R45 HydrophobicContact CB-CG 4.41Å; H41-R45 WeakPolarHBondContact O-CA 3.35Å; H41-R45 WeakPolarHBondContact O-CB 3.27Å; H41-R45 PolarHBondContact O-N 2.96Å; K43-R45 PolarHBondContact O-N 3.15Å
46	F	97.9	Very high	96.2	Very high	59 Å²	59	50 Å²	50	26%	0.259	29%	0.292	S	S	.	.	H	α-helix	trans	-116.2	-2.4	-169.4	-50.4	-61.6	0	0	0	113.8	H41 C42 V48 S327 E328	H41-F46 HydrophobicContact CB-CE2 4.48Å; H41-F46 PolarHBondContact O-N 3.23Å; C42-F46 CarbonylContact O-C 3.57Å; C42-F46 WeakPolarHBondContact O-CA 3.37Å; C42-F46 WeakPolarHBondContact O-CB 3.48Å; C42-F46 PolarHBondContact O-N 3.44Å; F46-V48 HydrophobicContact CB-CG2 4.12Å; F46-V48 PolarHBondContact O-N 3.43Å; F46-V48 VanDerWaalsContact O-N 3.16Å; F46-S327 VanDerWaalsContact CE2-C 3.48Å; F46-E328 HydrophobicContact CB-CB 4Å; F46-E328 HydrophobicContact CB-CG 4.18Å; F46-E328 HydrophobicContact CD1-CB 3.87Å; F46-E328 HydrophobicContact CG-CB 3.99Å
47	G	97.3	Very high	96.2	Very high	47 Å²	47	50 Å²	50	49%	0.485	29%	0.292	S	S	.	.			trans	67.2	9.9	-178.5	0	0	0	0	0	114.9	C42 K43 H49	C42-G47 PolarHBondContact O-N 3.19Å; K43-G47 PolarHBondContact O-N 2.95Å; G47-H49 PolarHBondContact O-CD2 2.9Å
48	V	98.1	Very high	96.2	Very high	1 Å²	1	52.3 Å²	52.3	1%	0.006	30%	0.304	C	S	.	.	P	Polyproline II helix	trans	-84.9	118.3	179.8	-176.2	0	0	0	0	109.8	C42 K43 F46 L50 E328 C331 W332 H335	C42-V48 CarbonylContact C-O 3.58Å; C42-V48 HydrophobicContact CB-CB 4.27Å; C42-V48 PolarHBondContact O-N 2.84Å; K43-V48 WeakPolarHBondContact CA-O 3.34Å; K43-V48 PolarHBondContact N-O 3.34Å; F46-V48 HydrophobicContact CB-CG2 4.12Å; F46-V48 PolarHBondContact O-N 3.43Å; F46-V48 VanDerWaalsContact O-N 3.16Å; V48-L50 HydrophobicContact CG1-CD2 4.47Å; V48-E328 HydrophobicContact CG2-CG 4.27Å; V48-C331 HydrophobicContact CB-CB 3.95Å; V48-C331 HydrophobicContact CG1-CB 4.07Å; V48-C331 HydrophobicContact CG2-CB 4.04Å; V48-W332 HydrophobicContact CG1-CD2 3.97Å; V48-W332 HydrophobicContact CG1-CE3 4.04Å; V48-W332 HydrophobicContact CG1-CG 4.47Å; V48-W332 HydrophobicContact CG1-CH2 4.41Å; V48-W332 HydrophobicContact CG1-CZ2 4.35Å; V48-W332 HydrophobicContact CG1-CZ3 4.25Å; V48-W332 HydrophobicContact CG2-CD2 4.16Å; V48-W332 HydrophobicContact CG2-CG 4.32Å; V48-W332 HydrophobicContact CG2-CZ2 4.09Å; V48-H335 HydrophobicContact CG1-CB 4.28Å
49	H	96.9	Very high	96.3	Very high	120 Å²	120	52.3 Å²	52.3	56%	0.556	31%	0.306	S	S	*	.	P	Polyproline II helix	trans	-95.3	119.5	-177.8	-72.6	-96.5	0	0	0	111.4	G47 H335	G47-H49 PolarHBondContact O-CD2 2.9Å; H49-H335 PolarHBondContact O-CD2 3.25Å; H49-H335 VanDerWaalsContact O-CD2 3.29Å
50	L	97.8	Very high	96.2	Very high	13 Å²	13	52.8 Å²	52.8	7%	0.068	31%	0.308	C	S	.	.	P	Polyproline II helix	trans	-89	123.6	174.8	-51.3	-179.5	0	0	0	110.7	W35 V48 L52 L334 H335 L338	W35-L50 HydrophobicContact CZ2-CD1 4.21Å; V48-L50 HydrophobicContact CG1-CD2 4.47Å; L50-L52 HydrophobicContact CB-CD2 4.41Å; L50-L52 HydrophobicContact CB-CG 4.11Å; L50-L52 PolarHBondContact O-N 3.21Å; L50-L334 HydrophobicContact CD1-CD2 3.68Å; L50-L334 HydrophobicContact CD1-CG 4.24Å; L50-L334 HydrophobicContact CD2-CG 4.4Å; L50-H335 HydrophobicContact CD2-CB 3.88Å; L50-L338 HydrophobicContact CB-CD1 3.87Å; L50-L338 HydrophobicContact CD1-CD1 4.18Å; L50-L338 HydrophobicContact CD2-CD1 4.09Å; L50-L338 HydrophobicContact CG-CD1 4.26Å
51	P	97	Very high	96	Very high	42 Å²	42	60 Å²	60	27%	0.273	33%	0.329	S	S	.	.			trans	-80.2	41.5	-172.1	33	-36.8	0	0	0	114.1	N53 A54 L55 V339	P51-N53 PolarHBondContact O-N 3.34Å; P51-A54 HydrophobicContact CB-CB 4.48Å; P51-A54 PolarHBondContact O-N 2.69Å; P51-A54 VanDerWaalsContact O-N 3.14Å; P51-L55 HydrophobicContact CG-CD1 4.08Å; P51-L55 HydrophobicContact CG-CG 4.49Å; P51-L55 WeakPolarHBondContact O-CG 3.34Å; P51-L55 PolarHBondContact O-N 3.13Å; P51-V339 HydrophobicContact CG-CG2 3.87Å
52	L	97.1	Very high	95.6	Very high	6 Å²	6	60.9 Å²	60.9	3%	0.031	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.7	-46.3	-170.3	-59.5	175	0	0	0	113.9	W35 L50 A54 L55 G56 I57 A59 Q63 L338	W35-L52 HydrophobicContact CB-CD1 4.41Å; W35-L52 HydrophobicContact CD2-CD1 3.93Å; W35-L52 HydrophobicContact CD2-CD2 3.82Å; W35-L52 HydrophobicContact CE3-CD2 3.86Å; W35-L52 HydrophobicContact CG-CD1 3.75Å; W35-L52 HydrophobicContact CG-CD2 4.41Å; W35-L52 HydrophobicContact CH2-CD2 4.09Å; W35-L52 HydrophobicContact CZ2-CD2 4.05Å; W35-L52 HydrophobicContact CZ3-CD2 4Å; L50-L52 HydrophobicContact CB-CD2 4.41Å; L50-L52 HydrophobicContact CB-CG 4.11Å; L50-L52 PolarHBondContact O-N 3.21Å; L52-A54 PolarHBondContact O-N 3.37Å; L52-L55 CarbonylContact O-C 3.57Å; L52-L55 PolarHBondContact O-N 2.99Å; L52-L55 VanDerWaalsContact O-N 3.17Å; L52-G56 PolarHBondContact O-N 2.83Å; L52-I57 HydrophobicContact CB-CB 4.25Å; L52-I57 HydrophobicContact CD2-CB 4.45Å; L52-I57 HydrophobicContact CD2-CD1 4.17Å; L52-I57 HydrophobicContact CD2-CG2 4.31Å; L52-I57 WeakPolarHBondContact O-CB 3.5Å; L52-I57 PolarHBondContact O-N 3.35Å; L52-A59 HydrophobicContact CB-CB 4.4Å; L52-A59 HydrophobicContact CD1-CB 3.65Å; L52-Q63 HydrophobicContact CD1-CG 4Å; L52-L338 HydrophobicContact CD2-CD1 3.73Å; L52-L338 HydrophobicContact CD2-CD2 4.08Å
53	N	93.9	Very high	95.1	Very high	151 Å²	151	62 Å²	62	81%	0.807	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-40.1	-178.7	-172.4	56.9	0	0	0	112.5	P51 L55 G56	P51-N53 PolarHBondContact O-N 3.34Å; N53-L55 PolarHBondContact O-N 3.18Å; N53-G56 PolarHBondContact O-N 3.01Å; N53-G56 VanDerWaalsContact O-N 3.12Å
54	A	95.7	Very high	94.5	Very high	81 Å²	81	62.9 Å²	62.9	67%	0.669	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-25.5	177.2	0	0	0	0	0	112.1	P51 L52	P51-A54 HydrophobicContact CB-CB 4.48Å; P51-A54 PolarHBondContact O-N 2.69Å; P51-A54 VanDerWaalsContact O-N 3.14Å; L52-A54 PolarHBondContact O-N 3.37Å
55	L	96.4	Very high	93.8	Very high	19 Å²	19	60.6 Å²	60.6	10%	0.099	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.8	4.1	177.7	-60.1	177.7	0	0	0	113.5	P51 L52 N53 I57 L338 V346 I347	P51-L55 HydrophobicContact CG-CD1 4.08Å; P51-L55 HydrophobicContact CG-CG 4.49Å; P51-L55 WeakPolarHBondContact O-CG 3.34Å; P51-L55 PolarHBondContact O-N 3.13Å; L52-L55 CarbonylContact O-C 3.57Å; L52-L55 PolarHBondContact O-N 2.99Å; L52-L55 VanDerWaalsContact O-N 3.17Å; N53-L55 PolarHBondContact O-N 3.18Å; L55-I57 VanDerWaalsContact C-N 3.26Å; L55-I57 HydrophobicContact CB-CD1 4.18Å; L55-I57 HydrophobicContact CB-CG1 4.22Å; L55-I57 PolarHBondContact O-N 3Å; L55-L338 HydrophobicContact CD1-CB 3.92Å; L55-L338 WeakPolarHBondContact CD1-O 3.48Å; L55-V346 WeakPolarHBondContact O-CG1 3.46Å; L55-I347 HydrophobicContact CD2-CD1 4.17Å
56	G	93.8	Very high	93.1	Very high	42 Å²	42	55.6 Å²	55.6	43%	0.433	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.3	20.1	-177.7	0	0	0	0	0	114	L52 N53	L52-G56 PolarHBondContact O-N 2.83Å; N53-G56 PolarHBondContact O-N 3.01Å; N53-G56 VanDerWaalsContact O-N 3.12Å
57	I	97.5	Very high	92.6	Very high	3 Å²	3	53.5 Å²	53.5	2%	0.015	30%	0.3	C	S	.	.			trans	-94	119.8	177.5	-58.3	173.1	0	0	0	109	V33 W35 L52 L55 A59 L318 L338 L342 V346	V33-I57 HydrophobicContact CG1-CG1 4.27Å; V33-I57 HydrophobicContact CG1-CG2 4.4Å; W35-I57 HydrophobicContact CB-CG2 3.8Å; W35-I57 HydrophobicContact CD2-CG2 4.45Å; W35-I57 HydrophobicContact CE3-CG2 3.97Å; W35-I57 HydrophobicContact CG-CG2 4.46Å; L52-I57 HydrophobicContact CB-CB 4.25Å; L52-I57 HydrophobicContact CD2-CB 4.45Å; L52-I57 HydrophobicContact CD2-CD1 4.17Å; L52-I57 HydrophobicContact CD2-CG2 4.31Å; L52-I57 WeakPolarHBondContact O-CB 3.5Å; L52-I57 PolarHBondContact O-N 3.35Å; L55-I57 VanDerWaalsContact C-N 3.26Å; L55-I57 HydrophobicContact CB-CD1 4.18Å; L55-I57 HydrophobicContact CB-CG1 4.22Å; L55-I57 PolarHBondContact O-N 3Å; I57-A59 PolarHBondContact O-N 2.66Å; I57-L318 HydrophobicContact CD1-CD1 4.32Å; I57-L318 HydrophobicContact CG2-CD1 4.28Å; I57-L338 HydrophobicContact CD1-CD2 3.96Å; I57-L342 HydrophobicContact CD1-CD2 4.23Å; I57-V346 HydrophobicContact CG1-CG1 4.06Å; I57-V346 HydrophobicContact CG1-CG2 4.46Å
58	I	96.1	Very high	92.1	Very high	51 Å²	51	55.3 Å²	55.3	26%	0.262	30%	0.296	S	S	.	.	B	Isolated β-bridge	trans	-78.6	110.3	-178.5	-56.1	172.2	0	0	0	109.1	V33 L34 W35 N69	V33-I58 PolarHBondContact O-N 3.41Å; L34-I58 CarbonylContact C-O 3.53Å; L34-I58 WeakPolarHBondContact CA-O 3.4Å; W35-I58 PolarHBondContact N-O 3.3Å; I58-N69 HydrophobicContact CG2-CB 3.81Å
59	A	95.1	Very high	91.8	Very high	19 Å²	19	57.9 Å²	57.9	16%	0.157	31%	0.309	C	S	.	.			trans	-119.9	151.9	178.9	0	0	0	0	0	111.5	W35 L52 I57 N69	W35-A59 HydrophobicContact CB-CB 3.74Å; W35-A59 HydrophobicContact CG-CB 4.22Å; L52-A59 HydrophobicContact CB-CB 4.4Å; L52-A59 HydrophobicContact CD1-CB 3.65Å; I57-A59 PolarHBondContact O-N 2.66Å; A59-N69 PolarHBondContact O-ND2 3.49Å
60	N	93.6	Very high	91.7	Very high	10 Å²	10	52.3 Å²	52.3	5%	0.053	28%	0.284	C	S	.	.			trans	-60	157.8	169.4	-73.6	-33.9	0	0	0	111.3	D62 Q63 H64 G67 Q68 N69 M70	N60-D62 PolarHBondContact O-N 3.04Å; N60-Q63 WeakPolarHBondContact O-CA 3.4Å; N60-Q63 PolarHBondContact O-N 3.26Å; N60-H64 WeakPolarHBondContact CB-O 3.36Å; N60-H64 PolarHBondContact ND2-O 2.86Å; N60-G67 VanDerWaalsContact CG-CA 3.42Å; N60-G67 PolarHBondContact ND2-N 3Å; N60-G67 WeakPolarHBondContact OD1-CA 3.15Å; N60-Q68 PolarHBondContact OD1-N 2.84Å; N60-N69 WeakPolarHBondContact OD1-CA 3.18Å; N60-N69 WeakPolarHBondContact OD1-CB 3.45Å; N60-N69 PolarHBondContact OD1-N 3.49Å; N60-M70 PolarHBondContact ND2-O 3.37Å; N60-M70 PolarHBondContact OD1-N 2.9Å; N60-M70 VanDerWaalsContact OD1-N 3.08Å; N60-M70 PolarHBondContact OD1-O 3.31Å
61	R	90.3	Very high	91.6	Very high	180 Å²	180	51.7 Å²	51.7	68%	0.679	28%	0.28	S	S	*	.	G	3₁₀ helix	trans	-57.5	135.9	177.2	-177.5	178.8	174.3	163.7	2.9	109	Q63 H64	R61-Q63 PolarHBondContact O-N 2.94Å; R61-H64 PolarHBondContact O-CD2 2.88Å; R61-H64 PolarHBondContact O-N 2.89Å
62	D	85.9	Confident	91.6	Very high	78 Å²	78	49.8 Å²	49.8	42%	0.417	27%	0.268	S	S	.	.	G	3₁₀ helix	trans	52.2	23.6	-177	-62.8	-59.3	0	0	0	114	K43 N60 H64	K43-D62 IonicContact NZ-OD1 3.66Å; K43-D62 PolarHBondContact NZ-OD1 3.27Å; N60-D62 PolarHBondContact O-N 3.04Å; D62-H64 PolarHBondContact O-N 2.91Å
63	Q	87.8	Confident	91.6	Very high	25 Å²	25	49.7 Å²	49.7	12%	0.117	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	57	26.1	-177.1	-52.8	174.2	14.2	0	0	113.4	S39 A40 L52 N60 R61 F65	S39-Q63 PolarHBondContact O-OE1 2.98Å; S39-Q63 PolarHBondContact OG-OE1 3.36Å; A40-Q63 HydrophobicContact CB-CB 4.46Å; L52-Q63 HydrophobicContact CD1-CG 4Å; N60-Q63 WeakPolarHBondContact O-CA 3.4Å; N60-Q63 PolarHBondContact O-N 3.26Å; R61-Q63 PolarHBondContact O-N 2.94Å; Q63-F65 PolarHBondContact O-N 3.24Å
64	H	84.1	Confident	91.7	Very high	115 Å²	115	45.5 Å²	45.5	53%	0.532	24%	0.241	S	C	.	.			trans	-55.9	134.2	173.5	-80.6	-70.4	0	0	0	110.6	N60 R61 D62 H66	N60-H64 WeakPolarHBondContact CB-O 3.36Å; N60-H64 PolarHBondContact ND2-O 2.86Å; R61-H64 PolarHBondContact O-CD2 2.88Å; R61-H64 PolarHBondContact O-N 2.89Å; D62-H64 PolarHBondContact O-N 2.91Å; H64-H66 WeakPolarHBondContact CB-O 3.49Å; H64-H66 PolarHBondContact O-N 2.89Å
65	F	80.7	Confident	91.6	Very high	37 Å²	37	44.7 Å²	44.7	16%	0.162	22%	0.222	C	C	.	.	S	Bend	trans	-66.2	-29	-176.1	-164.5	-108.2	0	0	0	113	N36 P38 Q63 I72 Y74	N36-F65 WeakPolarHBondContact ND2-CE2 3.45Å; P38-F65 HydrophobicContact CB-CD2 3.84Å; P38-F65 HydrophobicContact CB-CE2 4.16Å; Q63-F65 PolarHBondContact O-N 3.24Å; F65-I72 HydrophobicContact CD1-CG2 4.09Å; F65-I72 HydrophobicContact CE1-CG2 3.2Å; F65-I72 HydrophobicContact CE2-CG2 4.48Å; F65-I72 HydrophobicContact CZ-CG2 3.44Å; F65-I72 VanDerWaalsContact CZ-CG2 3.44Å; F65-Y74 HydrophobicContact CD1-CE2 4.38Å; F65-Y74 HydrophobicContact CE1-CD2 4.32Å; F65-Y74 AromaticContact CE1-CE2 3.37Å; F65-Y74 HydrophobicContact CE1-CE2 3.37Å; F65-Y74 AromaticContact CE1-CZ 3.81Å; F65-Y74 AromaticContact CZ-CE2 3.88Å; F65-Y74 HydrophobicContact CZ-CE2 3.88Å; F65-Y74 AromaticContact CZ-CZ 3.85Å; F65-Y74 WeakPolarHBondContact CZ-OH 3.32Å
66	H	83	Confident	91.3	Very high	69 Å²	69	49 Å²	49	32%	0.319	25%	0.245	S	C	.	.	S	Bend	trans	-114.3	128.4	169.9	-51.7	-86.3	0	0	0	108.4	H64 T71 I72 Q77	H64-H66 WeakPolarHBondContact CB-O 3.49Å; H64-H66 PolarHBondContact O-N 2.89Å; H66-T71 HydrophobicContact CB-CG2 4.05Å; H66-I72 PolarHBondContact CE1-O 2.94Å; H66-I72 PolarHBondContact ND1-O 2.95Å; H66-I72 VanDerWaalsContact ND1-O 3.08Å; H66-Q77 PolarHBondContact CE1-OE1 2.92Å; H66-Q77 VanDerWaalsContact CE1-OE1 3.31Å; H66-Q77 PolarHBondContact NE2-NE2 3.48Å
67	G	85.9	Confident	91.4	Very high	15 Å²	15	49.9 Å²	49.9	16%	0.155	24%	0.238	C	C	.	.	S	Bend	trans	-174.2	-167.3	-174.6	0	0	0	0	0	114.6	N60 N69 M70 T71 F120	N60-G67 VanDerWaalsContact CG-CA 3.42Å; N60-G67 PolarHBondContact ND2-N 3Å; N60-G67 WeakPolarHBondContact OD1-CA 3.15Å; G67-N69 VanDerWaalsContact C-N 3.33Å; G67-N69 PolarHBondContact O-N 3.14Å; G67-M70 PolarHBondContact N-O 3Å; G67-T71 PolarHBondContact N-OG1 3.42Å; G67-T71 PolarHBondContact O-OG1 3.33Å; G67-T71 VanDerWaalsContact O-OG1 3.13Å; G67-F120 WeakPolarHBondContact O-CE2 3.22Å
68	Q	87.8	Confident	91.4	Very high	85 Å²	85	49.8 Å²	49.8	40%	0.397	24%	0.237	S	C	.	.	S	Bend	trans	-71.5	-24.2	-166.8	76.9	-73.5	-1.5	0	0	114.6	N60	N60-Q68 PolarHBondContact OD1-N 2.84Å
69	N	91.1	Very high	91.4	Very high	55 Å²	55	47.8 Å²	47.8	29%	0.294	23%	0.229	S	C	.	.	S	Bend	trans	-98.3	-30.1	-175.8	-72.5	-22.6	0	0	0	112.3	I58 A59 N60 G67 G122 P123	I58-N69 HydrophobicContact CG2-CB 3.81Å; A59-N69 PolarHBondContact O-ND2 3.49Å; N60-N69 WeakPolarHBondContact OD1-CA 3.18Å; N60-N69 WeakPolarHBondContact OD1-CB 3.45Å; N60-N69 PolarHBondContact OD1-N 3.49Å; G67-N69 VanDerWaalsContact C-N 3.33Å; G67-N69 PolarHBondContact O-N 3.14Å; N69-G122 WeakPolarHBondContact O-CA 3.37Å; N69-P123 WeakPolarHBondContact O-CD 3.43Å
70	M	94.4	Very high	91.6	Very high	3 Å²	3	48.8 Å²	48.8	2%	0.015	23%	0.232	C	C	.	.			trans	-160.2	140.6	-178	176.2	68.6	-171.2	0	0	110.1	L34 N60 G67 P123 V125 Y284 V317	L34-M70 HydrophobicContact CD2-CB 4.17Å; L34-M70 HydrophobicContact CD2-SD 4.47Å; N60-M70 PolarHBondContact ND2-O 3.37Å; N60-M70 PolarHBondContact OD1-N 2.9Å; N60-M70 VanDerWaalsContact OD1-N 3.08Å; N60-M70 PolarHBondContact OD1-O 3.31Å; G67-M70 PolarHBondContact N-O 3Å; M70-P123 HydrophobicContact CE-CB 4.17Å; M70-P123 HydrophobicContact SD-CB 3.33Å; M70-P123 WeakPolarHBondContact SD-CB 3.24Å; M70-P123 HydrophobicContact SD-CG 3.41Å; M70-P123 WeakPolarHBondContact SD-CG 3.23Å; M70-V125 HydrophobicContact CE-CB 3.84Å; M70-V125 HydrophobicContact CE-CG2 3.25Å; M70-V125 HydrophobicContact SD-CG2 4.4Å; M70-Y284 WeakPolarHBondContact CE-OH 3.3Å; M70-V317 HydrophobicContact CE-CG1 4.31Å; M70-V317 HydrophobicContact CE-CG2 4.48Å
71	T	96.1	Very high	91.8	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	127.6	170.1	-65.9	0	0	0	0	110	H66 G67 F73 L116 P123 A124 V125	H66-T71 HydrophobicContact CB-CG2 4.05Å; G67-T71 PolarHBondContact N-OG1 3.42Å; G67-T71 PolarHBondContact O-OG1 3.33Å; G67-T71 VanDerWaalsContact O-OG1 3.13Å; T71-F73 HydrophobicContact CG2-CD1 4.41Å; T71-F73 HydrophobicContact CG2-CD2 4.2Å; T71-F73 HydrophobicContact CG2-CE1 3.9Å; T71-F73 HydrophobicContact CG2-CE2 3.67Å; T71-F73 HydrophobicContact CG2-CZ 3.5Å; T71-L116 HydrophobicContact CG2-CD2 4.06Å; T71-L116 WeakPolarHBondContact OG1-CD2 3.19Å; T71-P123 PolarHBondContact N-O 3.44Å; T71-A124 CarbonylContact O-C 3.58Å; T71-A124 WeakPolarHBondContact O-CA 3.27Å; T71-V125 PolarHBondContact O-N 3.43Å
72	I	96.4	Very high	92.2	Very high	1 Å²	1	39.9 Å²	39.9	1%	0.005	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	138.4	169.2	-177.4	166	0	0	0	108.6	F65 H66 Y74 V125 D127 Y284	F65-I72 HydrophobicContact CD1-CG2 4.09Å; F65-I72 HydrophobicContact CE1-CG2 3.2Å; F65-I72 HydrophobicContact CE2-CG2 4.48Å; F65-I72 HydrophobicContact CZ-CG2 3.44Å; F65-I72 VanDerWaalsContact CZ-CG2 3.44Å; H66-I72 PolarHBondContact CE1-O 2.94Å; H66-I72 PolarHBondContact ND1-O 2.95Å; H66-I72 VanDerWaalsContact ND1-O 3.08Å; I72-Y74 HydrophobicContact CD1-CE1 4.03Å; I72-Y74 HydrophobicContact CG1-CE1 4.45Å; I72-V125 CarbonylContact C-O 3.25Å; I72-V125 VanDerWaalsContact CA-O 3.31Å; I72-V125 WeakPolarHBondContact CA-O 3.44Å; I72-V125 HydrophobicContact CB-CB 4.42Å; I72-V125 HydrophobicContact CD1-CG1 4.46Å; I72-V125 HydrophobicContact CG1-CB 4.32Å; I72-V125 HydrophobicContact CG1-CG1 4.34Å; I72-D127 HydrophobicContact CD1-CB 3.86Å; I72-D127 HydrophobicContact CG1-CB 3.93Å; I72-Y284 HydrophobicContact CD1-CE1 4.39Å
73	F	97.2	Very high	92.8	Very high	4 Å²	4	37.4 Å²	37.4	2%	0.018	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	104.2	176.5	-62.2	-82.9	0	0	0	108.8	T71 Q77 L78 L116 A124 V125 D127 W197	T71-F73 HydrophobicContact CG2-CD1 4.41Å; T71-F73 HydrophobicContact CG2-CD2 4.2Å; T71-F73 HydrophobicContact CG2-CE1 3.9Å; T71-F73 HydrophobicContact CG2-CE2 3.67Å; T71-F73 HydrophobicContact CG2-CZ 3.5Å; F73-Q77 HydrophobicContact CB-CB 4.49Å; F73-Q77 HydrophobicContact CD1-CB 4.47Å; F73-L78 HydrophobicContact CB-CB 3.79Å; F73-L78 HydrophobicContact CB-CD2 4.33Å; F73-L78 HydrophobicContact CD1-CB 3.95Å; F73-L78 HydrophobicContact CD1-CD1 4.3Å; F73-L78 HydrophobicContact CD1-CG 4.5Å; F73-L78 HydrophobicContact CD2-CD2 4.18Å; F73-L78 HydrophobicContact CE1-CD1 4.34Å; F73-L78 HydrophobicContact CG-CB 3.97Å; F73-L78 HydrophobicContact CG-CD2 4.11Å; F73-L78 HydrophobicContact CG-CG 4.48Å; F73-L116 HydrophobicContact CE2-CD1 4.33Å; F73-L116 HydrophobicContact CZ-CD1 4.04Å; F73-L116 HydrophobicContact CZ-CD2 4.5Å; F73-L116 HydrophobicContact CZ-CG 4.26Å; F73-A124 HydrophobicContact CE2-CB 4.43Å; F73-V125 PolarHBondContact N-O 3.04Å; F73-D127 PolarHBondContact O-N 2.83Å; F73-W197 HydrophobicContact CE2-CH2 4.3Å; F73-W197 HydrophobicContact CE2-CZ3 4.23Å
74	Y	96.3	Very high	93.2	Very high	64 Å²	64	38 Å²	38	25%	0.251	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	164.5	171.3	-64.8	-59.6	0	0	0	111.1	F65 I72 N76 Q77 D127 W319	F65-Y74 HydrophobicContact CD1-CE2 4.38Å; F65-Y74 HydrophobicContact CE1-CD2 4.32Å; F65-Y74 AromaticContact CE1-CE2 3.37Å; F65-Y74 HydrophobicContact CE1-CE2 3.37Å; F65-Y74 AromaticContact CE1-CZ 3.81Å; F65-Y74 AromaticContact CZ-CE2 3.88Å; F65-Y74 HydrophobicContact CZ-CE2 3.88Å; F65-Y74 AromaticContact CZ-CZ 3.85Å; F65-Y74 WeakPolarHBondContact CZ-OH 3.32Å; I72-Y74 HydrophobicContact CD1-CE1 4.03Å; I72-Y74 HydrophobicContact CG1-CE1 4.45Å; Y74-N76 PolarHBondContact O-N 3.49Å; Y74-Q77 WeakPolarHBondContact O-CB 3.41Å; Y74-Q77 PolarHBondContact O-N 3.46Å; Y74-D127 HydrophobicContact CD1-CB 3.88Å; Y74-D127 VanDerWaalsContact CD1-OD2 3.22Å; Y74-D127 WeakPolarHBondContact CD1-OD2 3.33Å; Y74-D127 HydrophobicContact CE1-CB 4.35Å; Y74-D127 WeakPolarHBondContact CE1-OD2 3.37Å; Y74-W319 PolarHBondContact OH-NE1 3.42Å
75	K	93.3	Very high	93.6	Very high	63 Å²	63	33 Å²	33	27%	0.274	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-45.1	-25.5	-176.7	68	179.4	174	-177	0	117.2	Y81 Y83 D127 E130	K75-Y81 HydrophobicContact CB-CD1 3.73Å; K75-Y81 HydrophobicContact CB-CE1 3.98Å; K75-Y81 WeakPolarHBondContact O-CB 3.36Å; K75-Y83 HydrophobicContact CD-CD1 4.43Å; K75-Y83 HydrophobicContact CD-CD2 4.24Å; K75-Y83 HydrophobicContact CD-CE1 4.41Å; K75-Y83 HydrophobicContact CD-CE2 4.25Å; K75-Y83 HydrophobicContact CD-CG 4.36Å; K75-Y83 HydrophobicContact CG-CE1 4.49Å; K75-D127 PolarHBondContact N-O 3.27Å; K75-E130 HydrophobicContact CD-CG 3.98Å; K75-E130 WeakPolarHBondContact CD-OE1 3.49Å; K75-E130 WeakPolarHBondContact CE-OE1 3.34Å; K75-E130 IonicContact NZ-OE1 3.45Å; K75-E130 PolarHBondContact NZ-OE1 2.82Å
76	N	92.1	Very high	94	Very high	111 Å²	111	38.1 Å²	38.1	59%	0.594	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	-110.4	13.2	-178.7	64.8	-28.1	0	0	0	113.8	Y74	Y74-N76 PolarHBondContact O-N 3.49Å
77	Q	94.9	Very high	94.3	Very high	60 Å²	60	45.8 Å²	45.8	28%	0.28	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-113.9	-11.7	-173	-62.5	-177.9	-37.2	0	0	114.2	H66 F73 Y74	H66-Q77 PolarHBondContact CE1-OE1 2.92Å; H66-Q77 VanDerWaalsContact CE1-OE1 3.31Å; H66-Q77 PolarHBondContact NE2-NE2 3.48Å; F73-Q77 HydrophobicContact CB-CB 4.49Å; F73-Q77 HydrophobicContact CD1-CB 4.47Å; Y74-Q77 WeakPolarHBondContact O-CB 3.41Å; Y74-Q77 PolarHBondContact O-N 3.46Å
78	L	96.7	Very high	94.6	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	24%	0.244	C	C	.	.	S	Bend	trans	-139.1	116.9	178.8	-171.1	69	0	0	0	112.1	F73 A108 Q111 I112 L126 T184	F73-L78 HydrophobicContact CB-CB 3.79Å; F73-L78 HydrophobicContact CB-CD2 4.33Å; F73-L78 HydrophobicContact CD1-CB 3.95Å; F73-L78 HydrophobicContact CD1-CD1 4.3Å; F73-L78 HydrophobicContact CD1-CG 4.5Å; F73-L78 HydrophobicContact CD2-CD2 4.18Å; F73-L78 HydrophobicContact CE1-CD1 4.34Å; F73-L78 HydrophobicContact CG-CB 3.97Å; F73-L78 HydrophobicContact CG-CD2 4.11Å; F73-L78 HydrophobicContact CG-CG 4.48Å; L78-A108 HydrophobicContact CD1-CB 3.87Å; L78-A108 HydrophobicContact CG-CB 4.06Å; L78-Q111 VanDerWaalsContact CA-OE1 3.26Å; L78-Q111 HydrophobicContact CD1-CB 4.28Å; L78-I112 HydrophobicContact CD1-CD1 4.07Å; L78-I112 HydrophobicContact CD1-CG1 3.74Å; L78-L126 HydrophobicContact CD2-CD2 3.8Å; L78-L126 HydrophobicContact CD2-CG 4.09Å; L78-T184 HydrophobicContact CD2-CG2 4.15Å
79	G	97.9	Very high	94.9	Very high	9 Å²	9	46.9 Å²	46.9	9%	0.093	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.7	-151.3	-177.5	0	0	0	0	0	113.3
80	L	98.1	Very high	95.2	Very high	41 Å²	41	46.9 Å²	46.9	22%	0.215	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110	55.3	-179.4	-62.2	175.9	0	0	0	110.8	N92 L99 R103 H104 L107	L80-N92 VanDerWaalsContact C-ND2 3.33Å; L80-N92 HydrophobicContact CB-CB 4.21Å; L80-N92 WeakPolarHBondContact O-CB 3.47Å; L80-L99 HydrophobicContact CB-CD1 3.66Å; L80-L99 HydrophobicContact CD1-CD1 4.42Å; L80-L99 VanDerWaalsContact O-CD1 3.27Å; L80-L99 WeakPolarHBondContact O-CD1 3.47Å; L80-L99 WeakPolarHBondContact O-CD2 3.46Å; L80-R103 HydrophobicContact CD1-CB 3.83Å; L80-H104 HydrophobicContact CB-CB 4.19Å; L80-H104 PolarHBondContact N-ND1 2.95Å; L80-L107 HydrophobicContact CD2-CD2 3.55Å; L80-L107 HydrophobicContact CG-CD2 3.89Å
81	Y	98.4	Very high	95.3	Very high	2 Å²	2	50.1 Å²	50.1	1%	0.008	27%	0.269	C	S	.	.			trans	-58.9	126.9	179.1	176.9	-113.1	0	0	0	111	K75 Y83 N92 W128 E130 W131 L180	K75-Y81 HydrophobicContact CB-CD1 3.73Å; K75-Y81 HydrophobicContact CB-CE1 3.98Å; K75-Y81 WeakPolarHBondContact O-CB 3.36Å; Y81-Y83 HydrophobicContact CD1-CD1 4.06Å; Y81-Y83 WeakPolarHBondContact O-CD1 3.44Å; Y81-N92 PolarHBondContact O-ND2 3.38Å; Y81-W128 HydrophobicContact CD1-CD2 4.38Å; Y81-W128 HydrophobicContact CD1-CG 4.17Å; Y81-W128 HydrophobicContact CD2-CB 4.28Å; Y81-W128 AromaticContact CD2-CD2 3.19Å; Y81-W128 HydrophobicContact CD2-CD2 3.19Å; Y81-W128 AromaticContact CD2-CE2 3.67Å; Y81-W128 AromaticContact CD2-CE3 3.18Å; Y81-W128 HydrophobicContact CD2-CE3 3.18Å; Y81-W128 AromaticContact CD2-CG 3.7Å; Y81-W128 HydrophobicContact CD2-CG 3.7Å; Y81-W128 HydrophobicContact CD2-CH2 4.14Å; Y81-W128 HydrophobicContact CD2-CZ2 4.12Å; Y81-W128 AromaticContact CD2-CZ3 3.69Å; Y81-W128 HydrophobicContact CD2-CZ3 3.69Å; Y81-W128 HydrophobicContact CE1-CB 4.13Å; Y81-W128 HydrophobicContact CE1-CG 4.11Å; Y81-W128 HydrophobicContact CE2-CB 3.68Å; Y81-W128 AromaticContact CE2-CD2 3.47Å; Y81-W128 HydrophobicContact CE2-CD2 3.47Å; Y81-W128 VanDerWaalsContact CE2-CD2 3.47Å; Y81-W128 AromaticContact CE2-CE3 3.36Å; Y81-W128 HydrophobicContact CE2-CE3 3.36Å; Y81-W128 AromaticContact CE2-CG 3.63Å; Y81-W128 HydrophobicContact CE2-CG 3.63Å; Y81-W128 HydrophobicContact CE2-CZ3 4.22Å; Y81-W128 AromaticContact CG-CD2 3.69Å; Y81-W128 HydrophobicContact CG-CD2 3.69Å; Y81-W128 AromaticContact CG-CE2 3.77Å; Y81-W128 HydrophobicContact CG-CE3 4.12Å; Y81-W128 AromaticContact CG-CG 3.96Å; Y81-W128 HydrophobicContact CG-CG 3.96Å; Y81-W128 HydrophobicContact CG-CZ2 4.28Å; Y81-W128 AromaticContact CG-NE1 4Å; Y81-W128 AromaticContact CZ-CG 3.85Å; Y81-E130 HydrophobicContact CE1-CB 3.91Å; Y81-E130 HydrophobicContact CE1-CG 3.78Å; Y81-E130 WeakPolarHBondContact OH-CB 3.49Å; Y81-E130 PolarHBondContact OH-N 3.31Å; Y81-W131 AromaticContact CD2-CZ2 3.95Å; Y81-W131 HydrophobicContact CD2-CZ2 3.95Å; Y81-W131 HydrophobicContact CE2-CD2 4.45Å; Y81-W131 AromaticContact CE2-CE2 3.43Å; Y81-W131 VanDerWaalsContact CE2-CE2 3.43Å; Y81-W131 HydrophobicContact CE2-CH2 4.08Å; Y81-W131 AromaticContact CE2-CZ2 3.22Å; Y81-W131 HydrophobicContact CE2-CZ2 3.22Å; Y81-W131 AromaticContact CE2-NE1 3.5Å; Y81-W131 AromaticContact CZ-CE2 3.75Å; Y81-W131 AromaticContact CZ-NE1 3.44Å; Y81-W131 PolarHBondContact OH-NE1 3.48Å; Y81-L180 HydrophobicContact CD2-CD2 4.46Å
82	P	98.1	Very high	95.3	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	29%	0.287	C	S	.	.			trans	-86.3	132.1	-176.4	31.5	-28.4	0	0	0	111.1	H91 N92 P96 L99 W131 L180	P82-H91 WeakPolarHBondContact CA-O 3.31Å; P82-N92 HydrophobicContact CB-CB 4.41Å; P82-P96 HydrophobicContact CG-CG 4.44Å; P82-L99 HydrophobicContact CG-CD2 4.36Å; P82-W131 HydrophobicContact CG-CZ2 4.4Å; P82-W131 PolarHBondContact O-NE1 2.96Å; P82-L180 HydrophobicContact CG-CD2 4.01Å
83	Y	97.8	Very high	95.3	Very high	26 Å²	26	55.3 Å²	55.3	10%	0.102	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.7	165.6	178.7	68.3	-86	0	0	0	112.6	K75 Y81 H91 E130	K75-Y83 HydrophobicContact CD-CD1 4.43Å; K75-Y83 HydrophobicContact CD-CD2 4.24Å; K75-Y83 HydrophobicContact CD-CE1 4.41Å; K75-Y83 HydrophobicContact CD-CE2 4.25Å; K75-Y83 HydrophobicContact CD-CG 4.36Å; K75-Y83 HydrophobicContact CG-CE1 4.49Å; Y81-Y83 HydrophobicContact CD1-CD1 4.06Å; Y81-Y83 WeakPolarHBondContact O-CD1 3.44Å; Y83-H91 HydrophobicContact CD1-CB 3.94Å; Y83-H91 HydrophobicContact CD2-CB 4.44Å; Y83-H91 AromaticContact CD2-CD2 3.94Å; Y83-H91 HydrophobicContact CE1-CB 3.64Å; Y83-H91 AromaticContact CE1-CG 3.97Å; Y83-H91 HydrophobicContact CE2-CB 4.14Å; Y83-H91 AromaticContact CE2-CD2 3.32Å; Y83-H91 WeakPolarHBondContact CE2-CD2 3.36Å; Y83-H91 AromaticContact CE2-CG 3.77Å; Y83-H91 AromaticContact CE2-NE2 3.91Å; Y83-H91 HydrophobicContact CG-CB 4.32Å; Y83-H91 AromaticContact CZ-CD2 3.56Å; Y83-H91 AromaticContact CZ-CG 3.5Å; Y83-H91 PolarHBondContact N-O 2.82Å; Y83-H91 PolarHBondContact O-N 3.22Å; Y83-E130 HydrophobicContact CG-CG 4.24Å
84	F	96.9	Very high	95.3	Very high	38 Å²	38	55.1 Å²	55.1	17%	0.167	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	128.5	169.9	-63.7	-68.1	0	0	0	111.5	G88 T89 A90 I95 A144 Y145 A148	F84-G88 WeakPolarHBondContact CD1-O 3.4Å; F84-T89 CarbonylContact C-O 3.46Å; F84-T89 WeakPolarHBondContact CA-O 3.31Å; F84-A90 HydrophobicContact CD1-CB 4.1Å; F84-A90 HydrophobicContact CE1-CB 3.81Å; F84-I95 HydrophobicContact CE2-CG2 4.28Å; F84-I95 HydrophobicContact CZ-CG2 4.21Å; F84-A144 HydrophobicContact CD2-CB 4.34Å; F84-Y145 AromaticContact CD2-CD1 3.84Å; F84-Y145 HydrophobicContact CD2-CD1 3.84Å; F84-Y145 AromaticContact CD2-CE1 3.41Å; F84-Y145 HydrophobicContact CD2-CE1 3.41Å; F84-Y145 VanDerWaalsContact CD2-CE1 3.41Å; F84-Y145 HydrophobicContact CD2-CE2 4.19Å; F84-Y145 HydrophobicContact CD2-CG 4.36Å; F84-Y145 AromaticContact CD2-CZ 3.58Å; F84-Y145 AromaticContact CE2-CD1 3.59Å; F84-Y145 HydrophobicContact CE2-CD1 3.59Å; F84-Y145 AromaticContact CE2-CE1 3.61Å; F84-Y145 HydrophobicContact CE2-CE1 3.61Å; F84-Y145 HydrophobicContact CE2-CG 4.17Å; F84-Y145 HydrophobicContact CG-CE1 4.46Å; F84-Y145 PolarHBondContact N-OH 3.21Å; F84-Y145 VanDerWaalsContact N-OH 3.13Å; F84-A148 HydrophobicContact CE2-CB 3.98Å; F84-A148 HydrophobicContact CZ-CB 3.47Å; F84-A148 VanDerWaalsContact CZ-CB 3.47Å
85	G	93.2	Very high	95.4	Very high	9 Å²	9	52.2 Å²	52.2	9%	0.093	30%	0.296	C	S	.	.			trans	-69.2	173.7	172.2	0	0	0	0	0	112.6	R87 G88 T89	G85-R87 PolarHBondContact O-N 3.4Å; G85-G88 PolarHBondContact O-N 3.25Å; G85-T89 PolarHBondContact N-O 3.27Å
86	P	88.8	Confident	95.6	Very high	146 Å²	146	49.4 Å²	49.4	95%	0.948	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-27.6	-176.4	-27	35.1	0	0	0	115.2
87	R	90.1	Very high	95.9	Very high	229 Å²	229	45.5 Å²	45.5	86%	0.864	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96	13.4	177.5	-62.9	-172.7	-67.9	-129.2	0.4	113.6	G85 T89	G85-R87 PolarHBondContact O-N 3.4Å; R87-T89 VanDerWaalsContact C-N 3.27Å; R87-T89 PolarHBondContact O-N 3.15Å
88	G	90.8	Very high	96	Very high	50 Å²	50	44.4 Å²	44.4	52%	0.515	26%	0.263	S	S	.	.			trans	77.4	6.9	-175.8	0	0	0	0	0	114.7	F84 G85 A90	F84-G88 WeakPolarHBondContact CD1-O 3.4Å; G85-G88 PolarHBondContact O-N 3.25Å; G88-A90 PolarHBondContact O-N 2.98Å
89	T	94.8	Very high	96	Very high	74 Å²	74	45.3 Å²	45.3	45%	0.454	27%	0.268	S	S	.	.	P	Polyproline II helix	trans	-62.3	122.7	177	-47.2	0	0	0	0	110.1	F84 G85 R87 H91	F84-T89 CarbonylContact C-O 3.46Å; F84-T89 WeakPolarHBondContact CA-O 3.31Å; G85-T89 PolarHBondContact N-O 3.27Å; R87-T89 VanDerWaalsContact C-N 3.27Å; R87-T89 PolarHBondContact O-N 3.15Å; T89-H91 PolarHBondContact O-CD2 3.26Å; T89-H91 PolarHBondContact O-N 3.36Å
90	A	96.6	Very high	96	Very high	55 Å²	55	47.7 Å²	47.7	46%	0.455	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	123.6	177.3	0	0	0	0	0	110.8	F84 G88	F84-A90 HydrophobicContact CD1-CB 4.1Å; F84-A90 HydrophobicContact CE1-CB 3.81Å; G88-A90 PolarHBondContact O-N 2.98Å
91	H	97	Very high	96	Very high	70 Å²	70	48 Å²	48	32%	0.324	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	133.6	170	-66.4	-90.5	0	0	0	109.2	P82 Y83 T89 G93 G94	P82-H91 WeakPolarHBondContact CA-O 3.31Å; Y83-H91 HydrophobicContact CD1-CB 3.94Å; Y83-H91 HydrophobicContact CD2-CB 4.44Å; Y83-H91 AromaticContact CD2-CD2 3.94Å; Y83-H91 HydrophobicContact CE1-CB 3.64Å; Y83-H91 AromaticContact CE1-CG 3.97Å; Y83-H91 HydrophobicContact CE2-CB 4.14Å; Y83-H91 AromaticContact CE2-CD2 3.32Å; Y83-H91 WeakPolarHBondContact CE2-CD2 3.36Å; Y83-H91 AromaticContact CE2-CG 3.77Å; Y83-H91 AromaticContact CE2-NE2 3.91Å; Y83-H91 HydrophobicContact CG-CB 4.32Å; Y83-H91 AromaticContact CZ-CD2 3.56Å; Y83-H91 AromaticContact CZ-CG 3.5Å; Y83-H91 PolarHBondContact N-O 2.82Å; Y83-H91 PolarHBondContact O-N 3.22Å; T89-H91 PolarHBondContact O-CD2 3.26Å; T89-H91 PolarHBondContact O-N 3.36Å; H91-G93 PolarHBondContact O-N 2.97Å; H91-G94 WeakPolarHBondContact O-CA 3.48Å; H91-G94 PolarHBondContact O-N 2.86Å
92	N	96.9	Very high	96	Very high	67 Å²	67	54.3 Å²	54.3	36%	0.358	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.9	38.5	-179.6	-51.4	-45.3	0	0	0	113.4	L80 Y81 P82 G94 L99	L80-N92 VanDerWaalsContact C-ND2 3.33Å; L80-N92 HydrophobicContact CB-CB 4.21Å; L80-N92 WeakPolarHBondContact O-CB 3.47Å; Y81-N92 PolarHBondContact O-ND2 3.38Å; P82-N92 HydrophobicContact CB-CB 4.41Å; N92-G94 VanDerWaalsContact C-N 3.31Å; N92-G94 PolarHBondContact O-N 3.44Å; N92-L99 HydrophobicContact CB-CD1 4.14Å
93	G	95.1	Very high	96	Very high	43 Å²	43	61.9 Å²	61.9	44%	0.443	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.8	-8	-176.4	0	0	0	0	0	114.9	H91 I95	H91-G93 PolarHBondContact O-N 2.97Å; G93-I95 PolarHBondContact O-N 3.22Å
94	G	97.4	Very high	96	Very high	0 Å²	0	60.7 Å²	60.7	0%	0	34%	0.336	C	S	.	.	S	Bend	trans	75.7	-32.9	174.3	0	0	0	0	0	115	H91 N92 Y145	H91-G94 WeakPolarHBondContact O-CA 3.48Å; H91-G94 PolarHBondContact O-N 2.86Å; N92-G94 VanDerWaalsContact C-N 3.31Å; N92-G94 PolarHBondContact O-N 3.44Å; G94-Y145 VanDerWaalsContact O-CE1 3.23Å; G94-Y145 WeakPolarHBondContact O-CE1 3.38Å
95	I	98.5	Very high	96.1	Very high	4 Å²	4	60.8 Å²	60.8	2%	0.021	34%	0.338	C	S	.	.	S	Bend	trans	-122.8	151.9	179.3	59.7	-178.3	0	0	0	111.8	F84 G93 Q97 A98 Y145 A148 W152	F84-I95 HydrophobicContact CE2-CG2 4.28Å; F84-I95 HydrophobicContact CZ-CG2 4.21Å; G93-I95 PolarHBondContact O-N 3.22Å; I95-Q97 HydrophobicContact CD1-CG 4.05Å; I95-Q97 HydrophobicContact CG1-CG 4.4Å; I95-Q97 PolarHBondContact O-N 2.92Å; I95-A98 HydrophobicContact CD1-CB 4.28Å; I95-A98 HydrophobicContact CG1-CB 3.65Å; I95-A98 PolarHBondContact O-N 2.86Å; I95-Y145 HydrophobicContact CG2-CD1 4.25Å; I95-A148 HydrophobicContact CG2-CB 3.71Å; I95-W152 HydrophobicContact CD1-CB 3.63Å; I95-W152 HydrophobicContact CD1-CG 3.87Å
96	P	98.4	Very high	96.4	Very high	4 Å²	4	63.4 Å²	63.4	3%	0.026	36%	0.359	C	S	.	.	G	3₁₀ helix	trans	-56.3	-43.3	-177.9	-27.3	36.6	0	0	0	114.8	P82 A98 L99 W131 F173 A176 A177	P82-P96 HydrophobicContact CG-CG 4.44Å; P96-A98 PolarHBondContact O-N 3.33Å; P96-L99 WeakPolarHBondContact O-CB 3.32Å; P96-L99 PolarHBondContact O-N 3.49Å; P96-L99 VanDerWaalsContact O-N 3.15Å; P96-W131 HydrophobicContact CG-CD2 4.26Å; P96-W131 HydrophobicContact CG-CE3 4.47Å; P96-W131 HydrophobicContact CG-CH2 3.97Å; P96-W131 HydrophobicContact CG-CZ2 3.68Å; P96-W131 HydrophobicContact CG-CZ3 4.36Å; P96-F173 VanDerWaalsContact CD-CE2 3.47Å; P96-F173 HydrophobicContact CG-CD2 4.17Å; P96-F173 HydrophobicContact CG-CE2 3.85Å; P96-F173 HydrophobicContact CG-CZ 4.36Å; P96-A176 HydrophobicContact CB-CB 3.76Å; P96-A177 HydrophobicContact CB-CB 4.28Å; P96-A177 HydrophobicContact CG-CB 4.09Å
97	Q	98.2	Very high	96.8	Very high	28 Å²	28	59.3 Å²	59.3	13%	0.131	33%	0.329	C	S	.	.	G	3₁₀ helix	trans	-74.4	-9.8	-175.7	68.7	-86.6	35.3	0	0	114.5	I95 S149 W152 A176	I95-Q97 HydrophobicContact CD1-CG 4.05Å; I95-Q97 HydrophobicContact CG1-CG 4.4Å; I95-Q97 PolarHBondContact O-N 2.92Å; Q97-S149 PolarHBondContact NE2-OG 2.96Å; Q97-W152 HydrophobicContact CB-CH2 4.35Å; Q97-W152 HydrophobicContact CB-CZ2 4.36Å; Q97-W152 HydrophobicContact CG-CD2 3.78Å; Q97-W152 HydrophobicContact CG-CE3 3.73Å; Q97-W152 HydrophobicContact CG-CG 4.5Å; Q97-W152 HydrophobicContact CG-CH2 3.94Å; Q97-W152 HydrophobicContact CG-CZ2 3.97Å; Q97-W152 HydrophobicContact CG-CZ3 3.82Å; Q97-A176 VanDerWaalsContact CA-CB 3.43Å; Q97-A176 HydrophobicContact CB-CB 3.71Å
98	A	96.9	Very high	97.2	Very high	38 Å²	38	48.4 Å²	48.4	31%	0.314	29%	0.288	S	S	.	.	G	3₁₀ helix	trans	-91.2	-5.8	172.7	0	0	0	0	0	112.8	I95 P96	I95-A98 HydrophobicContact CD1-CB 4.28Å; I95-A98 HydrophobicContact CG1-CB 3.65Å; I95-A98 PolarHBondContact O-N 2.86Å; P96-A98 PolarHBondContact O-N 3.33Å
99	L	96.2	Very high	97.6	Very high	18 Å²	18	47.5 Å²	47.5	9%	0.094	28%	0.275	C	S	.	.	S	Bend	trans	-89.1	128.7	-175.7	176.9	67.9	0	0	0	111.8	L80 P82 N92 P96 L101 H104 L180	L80-L99 HydrophobicContact CB-CD1 3.66Å; L80-L99 HydrophobicContact CD1-CD1 4.42Å; L80-L99 VanDerWaalsContact O-CD1 3.27Å; L80-L99 WeakPolarHBondContact O-CD1 3.47Å; L80-L99 WeakPolarHBondContact O-CD2 3.46Å; P82-L99 HydrophobicContact CG-CD2 4.36Å; N92-L99 HydrophobicContact CB-CD1 4.14Å; P96-L99 WeakPolarHBondContact O-CB 3.32Å; P96-L99 PolarHBondContact O-N 3.49Å; P96-L99 VanDerWaalsContact O-N 3.15Å; L99-L101 PolarHBondContact O-N 3.24Å; L99-H104 HydrophobicContact CD2-CB 3.91Å; L99-H104 HydrophobicContact CG-CB 4.36Å; L99-L180 HydrophobicContact CD2-CD1 3.64Å; L99-L180 HydrophobicContact CD2-CD2 3.92Å; L99-L180 HydrophobicContact CD2-CG 4.39Å
100	P	97.1	Very high	97.8	Very high	59 Å²	59	50.5 Å²	50.5	38%	0.383	28%	0.28	S	S	.	.			trans	-68.7	95.9	166.7	-19.4	33.3	0	0	0	111.2	H102 R103 H104	P100-H102 VanDerWaalsContact C-N 3.29Å; P100-H102 PolarHBondContact O-N 3.01Å; P100-R103 HydrophobicContact CB-CB 4.34Å; P100-R103 HydrophobicContact CB-CG 4.07Å; P100-R103 WeakPolarHBondContact O-CB 3.05Å; P100-R103 PolarHBondContact O-N 3.28Å; P100-H104 PolarHBondContact O-N 3.29Å
101	L	98.3	Very high	97.8	Very high	48 Å²	48	50.1 Å²	50.1	25%	0.251	27%	0.268	S	S	.	.	H	α-helix	trans	-53.6	-40.2	-173.9	-178.5	60.2	0	0	0	113.6	L99 R103 H104 L105 A179 L180	L99-L101 PolarHBondContact O-N 3.24Å; L101-R103 VanDerWaalsContact C-N 3.29Å; L101-R103 PolarHBondContact O-N 3.43Å; L101-H104 WeakPolarHBondContact O-CB 3.12Å; L101-H104 PolarHBondContact O-N 2.94Å; L101-H104 VanDerWaalsContact O-N 3.15Å; L101-L105 HydrophobicContact CD1-CD1 4.28Å; L101-L105 HydrophobicContact CD1-CG 4.18Å; L101-L105 HydrophobicContact CG-CD1 4.04Å; L101-L105 HydrophobicContact CG-CG 4.37Å; L101-L105 WeakPolarHBondContact O-CG 3.39Å; L101-L105 PolarHBondContact O-N 3.39Å; L101-A179 HydrophobicContact CD2-CB 3.95Å; L101-L180 HydrophobicContact CD1-CB 4.41Å; L101-L180 HydrophobicContact CD1-CD1 3.96Å
102	H	98.2	Very high	97.8	Very high	134 Å²	134	46.8 Å²	46.8	62%	0.62	25%	0.253	S	S	*	.	H	α-helix	trans	-60.5	-36.2	177.8	68.5	-87	0	0	0	112.9	P100 A106	P100-H102 VanDerWaalsContact C-N 3.29Å; P100-H102 PolarHBondContact O-N 3.01Å; H102-A106 WeakPolarHBondContact O-CB 3.37Å; H102-A106 PolarHBondContact O-N 3.13Å
103	R	98.4	Very high	97.7	Very high	160 Å²	160	49.5 Å²	49.5	60%	0.604	26%	0.263	S	S	*	.	H	α-helix	trans	-71.4	-38.1	176.5	-62.7	-167.9	176.2	-174.7	-3.1	111.3	L80 P100 L101 L107	L80-R103 HydrophobicContact CD1-CB 3.83Å; P100-R103 HydrophobicContact CB-CB 4.34Å; P100-R103 HydrophobicContact CB-CG 4.07Å; P100-R103 WeakPolarHBondContact O-CB 3.05Å; P100-R103 PolarHBondContact O-N 3.28Å; L101-R103 VanDerWaalsContact C-N 3.29Å; L101-R103 PolarHBondContact O-N 3.43Å; R103-L107 WeakPolarHBondContact O-CB 3.38Å; R103-L107 PolarHBondContact O-N 3.27Å; R103-L107 VanDerWaalsContact O-N 3.09Å
104	H	98.6	Very high	97.6	Very high	0 Å²	0	53 Å²	53	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-57.7	-52.9	173.4	173.7	93.1	0	0	0	110.8	L80 L99 P100 L101 L107 A108 W128 L180 T184	L80-H104 HydrophobicContact CB-CB 4.19Å; L80-H104 PolarHBondContact N-ND1 2.95Å; L99-H104 HydrophobicContact CD2-CB 3.91Å; L99-H104 HydrophobicContact CG-CB 4.36Å; P100-H104 PolarHBondContact O-N 3.29Å; L101-H104 WeakPolarHBondContact O-CB 3.12Å; L101-H104 PolarHBondContact O-N 2.94Å; L101-H104 VanDerWaalsContact O-N 3.15Å; H104-L107 PolarHBondContact O-N 3.24Å; H104-A108 VanDerWaalsContact O-CB 3.29Å; H104-A108 WeakPolarHBondContact O-CB 3.38Å; H104-A108 PolarHBondContact O-N 2.81Å; H104-W128 AromaticContact CE1-CH2 3.44Å; H104-W128 VanDerWaalsContact CE1-CH2 3.44Å; H104-W128 WeakPolarHBondContact CE1-CH2 3.16Å; H104-W128 AromaticContact CE1-CZ2 3.79Å; H104-W128 AromaticContact NE2-CH2 3.67Å; H104-L180 HydrophobicContact CB-CD1 4.36Å; H104-T184 PolarHBondContact NE2-OG1 3.22Å
105	L	98.8	Very high	97.3	Very high	40 Å²	40	55.6 Å²	55.6	21%	0.209	29%	0.286	C	S	.	.	H	α-helix	trans	-64.4	-42.3	-178.2	-65.9	173.3	0	0	0	111.8	L101 L107 A108 A109 D183 M187	L101-L105 HydrophobicContact CD1-CD1 4.28Å; L101-L105 HydrophobicContact CD1-CG 4.18Å; L101-L105 HydrophobicContact CG-CD1 4.04Å; L101-L105 HydrophobicContact CG-CG 4.37Å; L101-L105 WeakPolarHBondContact O-CG 3.39Å; L101-L105 PolarHBondContact O-N 3.39Å; L105-L107 PolarHBondContact O-N 3.19Å; L105-A108 PolarHBondContact O-N 3.23Å; L105-A109 VanDerWaalsContact O-CB 3.29Å; L105-A109 WeakPolarHBondContact O-CB 3.16Å; L105-A109 PolarHBondContact O-N 3.02Å; L105-D183 HydrophobicContact CD1-CB 4.16Å; L105-D183 HydrophobicContact CD2-CB 4.13Å; L105-M187 HydrophobicContact CB-SD 4.07Å; L105-M187 HydrophobicContact CD2-CB 4.32Å; L105-M187 HydrophobicContact CD2-CE 4.46Å; L105-M187 HydrophobicContact CD2-SD 3.9Å
106	A	98.6	Very high	97.1	Very high	64 Å²	64	55.6 Å²	55.6	53%	0.529	29%	0.286	S	S	.	.	H	α-helix	trans	-60	-45.4	177	0	0	0	0	0	112.4	H102 Y110	H102-A106 WeakPolarHBondContact O-CB 3.37Å; H102-A106 PolarHBondContact O-N 3.13Å; A106-Y110 PolarHBondContact O-N 3.48Å; A106-Y110 VanDerWaalsContact O-N 3.1Å
107	L	98.6	Very high	96.9	Very high	61 Å²	61	64.3 Å²	64.3	32%	0.319	32%	0.318	S	S	.	.	H	α-helix	trans	-67.7	-42.7	177.5	179.5	60	0	0	0	111.9	L80 R103 H104 L105 Y110 Q111	L80-L107 HydrophobicContact CD2-CD2 3.55Å; L80-L107 HydrophobicContact CG-CD2 3.89Å; R103-L107 WeakPolarHBondContact O-CB 3.38Å; R103-L107 PolarHBondContact O-N 3.27Å; R103-L107 VanDerWaalsContact O-N 3.09Å; H104-L107 PolarHBondContact O-N 3.24Å; L105-L107 PolarHBondContact O-N 3.19Å; L107-Y110 WeakPolarHBondContact O-CB 3.43Å; L107-Y110 PolarHBondContact O-N 2.93Å; L107-Q111 HydrophobicContact CD1-CG 4.29Å; L107-Q111 WeakPolarHBondContact O-CG 3.27Å; L107-Q111 PolarHBondContact O-N 3.46Å; L107-Q111 PolarHBondContact O-OE1 2.6Å
108	A	98.4	Very high	96.7	Very high	0 Å²	0	67.7 Å²	67.7	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-62.8	-42.9	178.3	0	0	0	0	0	111.4	L78 H104 L105 Y110 Q111 I112 M187	L78-A108 HydrophobicContact CD1-CB 3.87Å; L78-A108 HydrophobicContact CG-CB 4.06Å; H104-A108 VanDerWaalsContact O-CB 3.29Å; H104-A108 WeakPolarHBondContact O-CB 3.38Å; H104-A108 PolarHBondContact O-N 2.81Å; L105-A108 PolarHBondContact O-N 3.23Å; A108-Y110 PolarHBondContact O-N 2.95Å; A108-Q111 PolarHBondContact O-N 3.01Å; A108-I112 WeakPolarHBondContact O-CB 3.27Å; A108-I112 VanDerWaalsContact O-CG1 3.27Å; A108-I112 WeakPolarHBondContact O-CG1 3.22Å; A108-I112 PolarHBondContact O-N 3.5Å; A108-M187 HydrophobicContact CB-CE 3.43Å; A108-M187 VanDerWaalsContact CB-CE 3.43Å; A108-M187 HydrophobicContact CB-SD 4.21Å
109	A	98.4	Very high	96.5	Very high	30 Å²	30	70.3 Å²	70.3	25%	0.248	36%	0.358	C	S	.	.	H	α-helix	trans	-59.8	-45.7	175.1	0	0	0	0	0	111.9	L105 I112 H113 M187 L191	L105-A109 VanDerWaalsContact O-CB 3.29Å; L105-A109 WeakPolarHBondContact O-CB 3.16Å; L105-A109 PolarHBondContact O-N 3.02Å; A109-I112 PolarHBondContact O-N 3.33Å; A109-H113 WeakPolarHBondContact O-CB 3.46Å; A109-H113 PolarHBondContact O-N 2.91Å; A109-M187 HydrophobicContact CB-SD 3.8Å; A109-L191 HydrophobicContact CB-CD1 3.85Å
110	Y	98.3	Very high	96.4	Very high	138 Å²	138	69.7 Å²	69.7	54%	0.541	36%	0.355	S	S	.	.	H	α-helix	trans	-57.7	-49.9	174	174.3	-90.2	0	0	0	111.2	A106 L107 A108 I112 H113 H114	A106-Y110 PolarHBondContact O-N 3.48Å; A106-Y110 VanDerWaalsContact O-N 3.1Å; L107-Y110 WeakPolarHBondContact O-CB 3.43Å; L107-Y110 PolarHBondContact O-N 2.93Å; A108-Y110 PolarHBondContact O-N 2.95Å; Y110-I112 PolarHBondContact O-N 3.44Å; Y110-H113 WeakPolarHBondContact O-CB 3.45Å; Y110-H113 PolarHBondContact O-N 3.05Å; Y110-H114 AromaticContact CD1-ND1 3.96Å; Y110-H114 AromaticContact CD2-CE1 3.39Å; Y110-H114 WeakPolarHBondContact CD2-CE1 3.37Å; Y110-H114 AromaticContact CD2-ND1 3.75Å; Y110-H114 AromaticContact CE1-ND1 3.83Å; Y110-H114 AromaticContact CE2-CE1 3.03Å; Y110-H114 WeakPolarHBondContact CE2-CE1 3.46Å; Y110-H114 AromaticContact CE2-ND1 3.65Å; Y110-H114 AromaticContact CE2-NE2 3.69Å; Y110-H114 AromaticContact CG-ND1 3.91Å; Y110-H114 AromaticContact CZ-CE1 3.36Å; Y110-H114 AromaticContact CZ-ND1 3.66Å; Y110-H114 AromaticContact CZ-NE2 3.77Å; Y110-H114 PolarHBondContact O-N 2.97Å; Y110-H114 PolarHBondContact O-ND1 3.37Å
111	Q	97.4	Very high	96.3	Very high	47 Å²	47	69.8 Å²	69.8	22%	0.22	36%	0.36	C	S	.	.	H	α-helix	trans	-62.6	-40.2	-179.6	-73.6	166.7	-32.9	0	0	112.6	L78 L107 A108 H113 H114 S115	L78-Q111 VanDerWaalsContact CA-OE1 3.26Å; L78-Q111 HydrophobicContact CD1-CB 4.28Å; L107-Q111 HydrophobicContact CD1-CG 4.29Å; L107-Q111 WeakPolarHBondContact O-CG 3.27Å; L107-Q111 PolarHBondContact O-N 3.46Å; L107-Q111 PolarHBondContact O-OE1 2.6Å; A108-Q111 PolarHBondContact O-N 3.01Å; Q111-H113 VanDerWaalsContact C-N 3.34Å; Q111-H114 PolarHBondContact O-N 3.28Å; Q111-S115 VanDerWaalsContact O-CB 3.3Å; Q111-S115 WeakPolarHBondContact O-CB 3.49Å; Q111-S115 PolarHBondContact O-N 2.95Å; Q111-S115 PolarHBondContact O-OG 3.08Å
112	I	97	Very high	96.1	Very high	0 Å²	0	68 Å²	68	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-62.9	-42.7	175	-70.8	167.8	0	0	0	110.7	L78 A108 A109 Y110 H114 S115 L116 M187 L191 R192 W197	L78-I112 HydrophobicContact CD1-CD1 4.07Å; L78-I112 HydrophobicContact CD1-CG1 3.74Å; A108-I112 WeakPolarHBondContact O-CB 3.27Å; A108-I112 VanDerWaalsContact O-CG1 3.27Å; A108-I112 WeakPolarHBondContact O-CG1 3.22Å; A108-I112 PolarHBondContact O-N 3.5Å; A109-I112 PolarHBondContact O-N 3.33Å; Y110-I112 PolarHBondContact O-N 3.44Å; I112-H114 PolarHBondContact O-N 2.95Å; I112-S115 PolarHBondContact O-N 3.45Å; I112-L116 HydrophobicContact CG2-CD1 4.36Å; I112-L116 PolarHBondContact O-N 3.19Å; I112-M187 HydrophobicContact CD1-CE 3.7Å; I112-L191 HydrophobicContact CB-CD1 4.17Å; I112-L191 HydrophobicContact CD1-CD1 4.26Å; I112-L191 HydrophobicContact CG2-CB 4.05Å; I112-L191 HydrophobicContact CG2-CD1 4Å; I112-R192 HydrophobicContact CG2-CG 3.95Å; I112-R192 PolarHBondContact O-NH2 2.75Å; I112-W197 HydrophobicContact CD1-CH2 3.55Å; I112-W197 HydrophobicContact CD1-CZ2 4.29Å; I112-W197 HydrophobicContact CD1-CZ3 4.22Å; I112-W197 HydrophobicContact CG1-CH2 3.92Å
113	H	95.3	Very high	96.1	Very high	123 Å²	123	61.8 Å²	61.8	57%	0.569	33%	0.325	S	S	*	.	H	α-helix	trans	-58.3	-38.6	178.9	-165.8	81.1	0	0	0	112.3	A109 Y110 Q111	A109-H113 WeakPolarHBondContact O-CB 3.46Å; A109-H113 PolarHBondContact O-N 2.91Å; Y110-H113 WeakPolarHBondContact O-CB 3.45Å; Y110-H113 PolarHBondContact O-N 3.05Å; Q111-H113 VanDerWaalsContact C-N 3.34Å
114	H	92.6	Very high	96.1	Very high	118 Å²	118	54.1 Å²	54.1	55%	0.546	30%	0.296	S	S	.	.	H	α-helix	trans	-87	-27.6	-177.1	-67.9	79.1	0	0	0	114	Y110 Q111 I112	Y110-H114 AromaticContact CD1-ND1 3.96Å; Y110-H114 AromaticContact CD2-CE1 3.39Å; Y110-H114 WeakPolarHBondContact CD2-CE1 3.37Å; Y110-H114 AromaticContact CD2-ND1 3.75Å; Y110-H114 AromaticContact CE1-ND1 3.83Å; Y110-H114 AromaticContact CE2-CE1 3.03Å; Y110-H114 WeakPolarHBondContact CE2-CE1 3.46Å; Y110-H114 AromaticContact CE2-ND1 3.65Å; Y110-H114 AromaticContact CE2-NE2 3.69Å; Y110-H114 AromaticContact CG-ND1 3.91Å; Y110-H114 AromaticContact CZ-CE1 3.36Å; Y110-H114 AromaticContact CZ-ND1 3.66Å; Y110-H114 AromaticContact CZ-NE2 3.77Å; Y110-H114 PolarHBondContact O-N 2.97Å; Y110-H114 PolarHBondContact O-ND1 3.37Å; Q111-H114 PolarHBondContact O-N 3.28Å; I112-H114 PolarHBondContact O-N 2.95Å
115	S	91.2	Very high	96	Very high	53 Å²	53	54.1 Å²	54.1	37%	0.371	30%	0.296	S	S	.	.	H	α-helix	trans	-95.3	-29.5	-175	57.5	0	0	0	0	113.9	Q111 I112	Q111-S115 VanDerWaalsContact O-CB 3.3Å; Q111-S115 WeakPolarHBondContact O-CB 3.49Å; Q111-S115 PolarHBondContact O-N 2.95Å; Q111-S115 PolarHBondContact O-OG 3.08Å; I112-S115 PolarHBondContact O-N 3.45Å
116	L	94.4	Very high	96	Very high	5 Å²	5	52.2 Å²	52.2	3%	0.026	29%	0.286	C	S	.	.	S	Bend	trans	-117.6	135.6	-174.8	-59.2	-176.2	0	0	0	111	T71 F73 I112 F120 R192 W197	T71-L116 HydrophobicContact CG2-CD2 4.06Å; T71-L116 WeakPolarHBondContact OG1-CD2 3.19Å; F73-L116 HydrophobicContact CE2-CD1 4.33Å; F73-L116 HydrophobicContact CZ-CD1 4.04Å; F73-L116 HydrophobicContact CZ-CD2 4.5Å; F73-L116 HydrophobicContact CZ-CG 4.26Å; I112-L116 HydrophobicContact CG2-CD1 4.36Å; I112-L116 PolarHBondContact O-N 3.19Å; L116-F120 HydrophobicContact CB-CB 4.33Å; L116-F120 HydrophobicContact CB-CG 4.43Å; L116-F120 HydrophobicContact CD1-CD1 4.09Å; L116-F120 HydrophobicContact CD1-CE1 4.27Å; L116-F120 HydrophobicContact CD1-CG 4.45Å; L116-F120 HydrophobicContact CD2-CD2 4.08Å; L116-F120 HydrophobicContact CD2-CE2 4.13Å; L116-F120 HydrophobicContact CD2-CG 4.29Å; L116-F120 HydrophobicContact CD2-CZ 4.37Å; L116-R192 HydrophobicContact CB-CG 4.3Å; L116-R192 HydrophobicContact CD1-CG 4.27Å; L116-R192 VanDerWaalsContact O-CZ 3.31Å; L116-R192 PolarHBondContact O-NE 3.27Å; L116-R192 VanDerWaalsContact O-NE 3.13Å; L116-R192 PolarHBondContact O-NH2 3.3Å; L116-W197 HydrophobicContact CD1-CH2 4.04Å; L116-W197 HydrophobicContact CD1-CZ2 4.04Å
117	R	93.9	Very high	96	Very high	187 Å²	187	49.9 Å²	49.9	71%	0.706	27%	0.265	S	S	*	.			trans	-67.6	150.1	172.3	-66.2	-175	175.9	-140.7	-3	110.9	S119 F120 R192	R117-S119 PolarHBondContact O-N 3.37Å; R117-S119 VanDerWaalsContact O-N 3.15Å; R117-F120 WeakPolarHBondContact O-CB 3.14Å; R117-F120 PolarHBondContact O-N 2.87Å; R117-R192 WeakPolarHBondContact O-CD 3.3Å; R117-R192 PolarHBondContact O-NE 3.09Å
118	P	93.9	Very high	96	Very high	99 Å²	99	47.5 Å²	47.5	64%	0.643	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.8	-34.1	176.2	-28.2	35.9	0	0	0	114.1	F120	P118-F120 VanDerWaalsContact C-N 3.28Å; P118-F120 PolarHBondContact O-N 2.83Å
119	S	93	Very high	95.9	Very high	92 Å²	92	50.8 Å²	50.8	64%	0.643	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.9	12.2	178.3	66.8	0	0	0	0	114.4	R117 A121	R117-S119 PolarHBondContact O-N 3.37Å; R117-S119 VanDerWaalsContact O-N 3.15Å; S119-A121 PolarHBondContact O-N 3.31Å
120	F	94.9	Very high	95.9	Very high	6 Å²	6	51.8 Å²	51.8	3%	0.026	27%	0.266	C	S	.	.			trans	-61.4	123.7	-179.1	176.9	-96.8	0	0	0	110.8	G67 L116 R117 P118 G122 P123 A124 H194 G195	G67-F120 WeakPolarHBondContact O-CE2 3.22Å; L116-F120 HydrophobicContact CB-CB 4.33Å; L116-F120 HydrophobicContact CB-CG 4.43Å; L116-F120 HydrophobicContact CD1-CD1 4.09Å; L116-F120 HydrophobicContact CD1-CE1 4.27Å; L116-F120 HydrophobicContact CD1-CG 4.45Å; L116-F120 HydrophobicContact CD2-CD2 4.08Å; L116-F120 HydrophobicContact CD2-CE2 4.13Å; L116-F120 HydrophobicContact CD2-CG 4.29Å; L116-F120 HydrophobicContact CD2-CZ 4.37Å; R117-F120 WeakPolarHBondContact O-CB 3.14Å; R117-F120 PolarHBondContact O-N 2.87Å; P118-F120 VanDerWaalsContact C-N 3.28Å; P118-F120 PolarHBondContact O-N 2.83Å; F120-G122 WeakPolarHBondContact CE1-O 3.48Å; F120-G122 VanDerWaalsContact CZ-O 3.32Å; F120-G122 WeakPolarHBondContact CZ-O 3.4Å; F120-P123 WeakPolarHBondContact CZ-O 3.45Å; F120-A124 HydrophobicContact CE1-CB 3.87Å; F120-A124 HydrophobicContact CZ-CB 4.48Å; F120-H194 CarbonylContact O-C 3.27Å; F120-G195 PolarHBondContact O-N 2.81Å
121	A	93.8	Very high	95.8	Very high	60 Å²	60	45.4 Å²	45.4	50%	0.496	24%	0.241	S	C	.	.			trans	-125.1	6.4	-179.4	0	0	0	0	0	113.3	S119 H194	S119-A121 PolarHBondContact O-N 3.31Å; A121-H194 VanDerWaalsContact CA-O 3.3Å; A121-H194 WeakPolarHBondContact CA-O 3.41Å; A121-H194 HydrophobicContact CB-CB 3.88Å
122	G	94.6	Very high	95.8	Very high	10 Å²	10	43.9 Å²	43.9	10%	0.103	24%	0.236	C	C	.	.	S	Bend	trans	-81.2	-178.2	177.1	0	0	0	0	0	112.6	N69 F120 L196	N69-G122 WeakPolarHBondContact O-CA 3.37Å; F120-G122 WeakPolarHBondContact CE1-O 3.48Å; F120-G122 VanDerWaalsContact CZ-O 3.32Å; F120-G122 WeakPolarHBondContact CZ-O 3.4Å; G122-L196 PolarHBondContact O-N 3.17Å
123	P	97.7	Very high	95.8	Very high	4 Å²	4	43.9 Å²	43.9	3%	0.026	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	131.7	173.6	-1.7	18.2	0	0	0	113.2	L34 N69 M70 T71 F120 V125 L196 F242 L282	L34-P123 HydrophobicContact CD2-CG 3.76Å; N69-P123 WeakPolarHBondContact O-CD 3.43Å; M70-P123 HydrophobicContact CE-CB 4.17Å; M70-P123 HydrophobicContact SD-CB 3.33Å; M70-P123 WeakPolarHBondContact SD-CB 3.24Å; M70-P123 HydrophobicContact SD-CG 3.41Å; M70-P123 WeakPolarHBondContact SD-CG 3.23Å; T71-P123 PolarHBondContact N-O 3.44Å; F120-P123 WeakPolarHBondContact CZ-O 3.45Å; P123-V125 HydrophobicContact CB-CG2 4.27Å; P123-L196 CarbonylContact C-O 3.2Å; P123-L196 WeakPolarHBondContact CA-O 3.33Å; P123-L196 HydrophobicContact CB-CB 4.16Å; P123-F242 HydrophobicContact CB-CE1 3.61Å; P123-F242 HydrophobicContact CB-CZ 3.63Å; P123-F242 HydrophobicContact CG-CE1 4.46Å; P123-L282 HydrophobicContact CG-CD2 3.98Å
124	A	97.8	Very high	96	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	93.6	176.5	0	0	0	0	0	108.3	T71 F73 F120 L196 W197 G198	T71-A124 CarbonylContact O-C 3.58Å; T71-A124 WeakPolarHBondContact O-CA 3.27Å; F73-A124 HydrophobicContact CE2-CB 4.43Å; F120-A124 HydrophobicContact CE1-CB 3.87Å; F120-A124 HydrophobicContact CZ-CB 4.48Å; A124-L196 PolarHBondContact N-O 3.21Å; A124-W197 HydrophobicContact CB-CD2 3.54Å; A124-W197 HydrophobicContact CB-CE3 3.53Å; A124-W197 HydrophobicContact CB-CG 4.18Å; A124-W197 HydrophobicContact CB-CH2 3.87Å; A124-W197 HydrophobicContact CB-CZ2 3.89Å; A124-W197 HydrophobicContact CB-CZ3 3.71Å; A124-W197 WeakPolarHBondContact O-CA 3.38Å; A124-G198 PolarHBondContact O-N 3.42Å
125	V	98.5	Very high	96.2	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	125.4	-168.3	179.2	0	0	0	0	110.8	M70 T71 I72 F73 P123 G198 F242 Y284	M70-V125 HydrophobicContact CE-CB 3.84Å; M70-V125 HydrophobicContact CE-CG2 3.25Å; M70-V125 HydrophobicContact SD-CG2 4.4Å; T71-V125 PolarHBondContact O-N 3.43Å; I72-V125 CarbonylContact C-O 3.25Å; I72-V125 VanDerWaalsContact CA-O 3.31Å; I72-V125 WeakPolarHBondContact CA-O 3.44Å; I72-V125 HydrophobicContact CB-CB 4.42Å; I72-V125 HydrophobicContact CD1-CG1 4.46Å; I72-V125 HydrophobicContact CG1-CB 4.32Å; I72-V125 HydrophobicContact CG1-CG1 4.34Å; F73-V125 PolarHBondContact N-O 3.04Å; P123-V125 HydrophobicContact CB-CG2 4.27Å; V125-G198 WeakPolarHBondContact CA-O 3.42Å; V125-F242 HydrophobicContact CG1-CD2 4.44Å; V125-F242 HydrophobicContact CG1-CG 4.41Å; V125-F242 HydrophobicContact CG2-CD1 3.7Å; V125-F242 HydrophobicContact CG2-CD2 3.83Å; V125-F242 HydrophobicContact CG2-CE1 3.58Å; V125-F242 HydrophobicContact CG2-CE2 3.73Å; V125-F242 HydrophobicContact CG2-CG 3.82Å; V125-F242 HydrophobicContact CG2-CZ 3.61Å; V125-Y284 HydrophobicContact CG1-CE2 4.1Å; V125-Y284 HydrophobicContact CG2-CE2 4.18Å
126	L	98.6	Very high	96.4	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	117.4	173.3	-66.1	86.2	0	0	0	109.5	L78 W128 T184 L185 W197 G198 F199 Y200	L78-L126 HydrophobicContact CD2-CD2 3.8Å; L78-L126 HydrophobicContact CD2-CG 4.09Å; L126-W128 HydrophobicContact CD2-CH2 4.17Å; L126-W128 HydrophobicContact CD2-CZ2 3.97Å; L126-W128 PolarHBondContact O-N 3.46Å; L126-T184 HydrophobicContact CD2-CG2 3.63Å; L126-L185 HydrophobicContact CD1-CD2 3.94Å; L126-W197 HydrophobicContact CD1-CE3 3.87Å; L126-W197 HydrophobicContact CD1-CZ3 4.22Å; L126-G198 PolarHBondContact N-O 3.48Å; L126-F199 HydrophobicContact CB-CD1 3.49Å; L126-F199 VanDerWaalsContact CB-CD1 3.49Å; L126-F199 HydrophobicContact CB-CE1 3.5Å; L126-F199 VanDerWaalsContact CB-CE1 3.5Å; L126-F199 HydrophobicContact CB-CG 4.22Å; L126-F199 HydrophobicContact CB-CZ 4.26Å; L126-F199 HydrophobicContact CD2-CE1 3.73Å; L126-F199 HydrophobicContact CD2-CZ 3.83Å; L126-F199 HydrophobicContact CG-CE1 4.18Å; L126-F199 WeakPolarHBondContact O-CA 3.3Å; L126-Y200 PolarHBondContact O-N 2.91Å
127	D	98.3	Very high	96.3	Very high	15 Å²	15	35.4 Å²	35.4	8%	0.08	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	76.6	179.8	-171.8	6.2	0	0	0	111.1	I72 F73 Y74 K75 E129 Y200	I72-D127 HydrophobicContact CD1-CB 3.86Å; I72-D127 HydrophobicContact CG1-CB 3.93Å; F73-D127 PolarHBondContact O-N 2.83Å; Y74-D127 HydrophobicContact CD1-CB 3.88Å; Y74-D127 VanDerWaalsContact CD1-OD2 3.22Å; Y74-D127 WeakPolarHBondContact CD1-OD2 3.33Å; Y74-D127 HydrophobicContact CE1-CB 4.35Å; Y74-D127 WeakPolarHBondContact CE1-OD2 3.37Å; K75-D127 PolarHBondContact N-O 3.27Å; D127-E129 WeakPolarHBondContact OD1-CG 3.5Å; D127-Y200 HydrophobicContact CB-CD1 4.45Å; D127-Y200 WeakPolarHBondContact OD1-CD1 3.22Å
128	W	97.9	Very high	96.4	Very high	10 Å²	10	26.6 Å²	26.6	4%	0.038	17%	0.168	C	C	.	.			trans	-111.5	92.4	-177.6	-71.9	6.6	0	0	0	109.9	Y81 H104 L126 L180 M181 T184 F199	Y81-W128 HydrophobicContact CD1-CD2 4.38Å; Y81-W128 HydrophobicContact CD1-CG 4.17Å; Y81-W128 HydrophobicContact CD2-CB 4.28Å; Y81-W128 AromaticContact CD2-CD2 3.19Å; Y81-W128 HydrophobicContact CD2-CD2 3.19Å; Y81-W128 AromaticContact CD2-CE2 3.67Å; Y81-W128 AromaticContact CD2-CE3 3.18Å; Y81-W128 HydrophobicContact CD2-CE3 3.18Å; Y81-W128 AromaticContact CD2-CG 3.7Å; Y81-W128 HydrophobicContact CD2-CG 3.7Å; Y81-W128 HydrophobicContact CD2-CH2 4.14Å; Y81-W128 HydrophobicContact CD2-CZ2 4.12Å; Y81-W128 AromaticContact CD2-CZ3 3.69Å; Y81-W128 HydrophobicContact CD2-CZ3 3.69Å; Y81-W128 HydrophobicContact CE1-CB 4.13Å; Y81-W128 HydrophobicContact CE1-CG 4.11Å; Y81-W128 HydrophobicContact CE2-CB 3.68Å; Y81-W128 AromaticContact CE2-CD2 3.47Å; Y81-W128 HydrophobicContact CE2-CD2 3.47Å; Y81-W128 VanDerWaalsContact CE2-CD2 3.47Å; Y81-W128 AromaticContact CE2-CE3 3.36Å; Y81-W128 HydrophobicContact CE2-CE3 3.36Å; Y81-W128 AromaticContact CE2-CG 3.63Å; Y81-W128 HydrophobicContact CE2-CG 3.63Å; Y81-W128 HydrophobicContact CE2-CZ3 4.22Å; Y81-W128 AromaticContact CG-CD2 3.69Å; Y81-W128 HydrophobicContact CG-CD2 3.69Å; Y81-W128 AromaticContact CG-CE2 3.77Å; Y81-W128 HydrophobicContact CG-CE3 4.12Å; Y81-W128 AromaticContact CG-CG 3.96Å; Y81-W128 HydrophobicContact CG-CG 3.96Å; Y81-W128 HydrophobicContact CG-CZ2 4.28Å; Y81-W128 AromaticContact CG-NE1 4Å; Y81-W128 AromaticContact CZ-CG 3.85Å; H104-W128 AromaticContact CE1-CH2 3.44Å; H104-W128 VanDerWaalsContact CE1-CH2 3.44Å; H104-W128 WeakPolarHBondContact CE1-CH2 3.16Å; H104-W128 AromaticContact CE1-CZ2 3.79Å; H104-W128 AromaticContact NE2-CH2 3.67Å; L126-W128 HydrophobicContact CD2-CH2 4.17Å; L126-W128 HydrophobicContact CD2-CZ2 3.97Å; L126-W128 PolarHBondContact O-N 3.46Å; W128-L180 HydrophobicContact CH2-CD1 4.41Å; W128-L180 HydrophobicContact CH2-CG 4.45Å; W128-L180 HydrophobicContact CZ3-CD1 4.45Å; W128-L180 HydrophobicContact CZ3-CD2 4.37Å; W128-L180 HydrophobicContact CZ3-CG 4.01Å; W128-M181 HydrophobicContact CE3-CG 4.46Å; W128-M181 HydrophobicContact CZ3-CG 4.44Å; W128-T184 HydrophobicContact CH2-CG2 4.08Å; W128-F199 HydrophobicContact CB-CD1 4.28Å; W128-F199 HydrophobicContact CB-CE1 4.23Å; W128-F199 AromaticContact CD2-CE1 3.84Å; W128-F199 HydrophobicContact CD2-CE1 3.84Å; W128-F199 AromaticContact CE3-CE1 3.48Å; W128-F199 HydrophobicContact CE3-CE1 3.48Å; W128-F199 VanDerWaalsContact CE3-CE1 3.48Å; W128-F199 HydrophobicContact CE3-CZ 4.06Å; W128-F199 HydrophobicContact CG-CE1 4.19Å; W128-F199 HydrophobicContact CZ3-CE1 4.03Å; W128-F199 HydrophobicContact CZ3-CZ 4.18Å
129	E	96.9	Very high	96.3	Very high	70 Å²	70	28.6 Å²	28.6	33%	0.327	16%	0.163	S	C	.	.			trans	-106.3	3.4	-172.7	-51.9	-161.1	-108	0	0	114.7	D127 R142 Y200 R201	D127-E129 WeakPolarHBondContact OD1-CG 3.5Å; E129-R142 VanDerWaalsContact O-CZ 3.28Å; E129-R142 PolarHBondContact O-NE 2.91Å; E129-R142 PolarHBondContact O-NH2 3.5Å; E129-Y200 HydrophobicContact CG-CD1 4.27Å; E129-Y200 HydrophobicContact CG-CE1 4.42Å; E129-R201 WeakPolarHBondContact OE2-CD 3.18Å; E129-R201 IonicContact OE2-CZ 2.71Å; E129-R201 IonicContact OE2-NE 2.75Å; E129-R201 IonicContact OE2-NH1 2.65Å; E129-R201 PolarHBondContact OE2-NH1 3.35Å
130	E	96.9	Very high	96.3	Very high	50 Å²	50	26.7 Å²	26.7	23%	0.234	16%	0.158	C	C	.	.	S	Bend	trans	-76.8	-36.1	-164.2	-63.2	-65.5	168.2	0	0	111.9	K75 Y81 Y83 R142 Y145	K75-E130 HydrophobicContact CD-CG 3.98Å; K75-E130 WeakPolarHBondContact CD-OE1 3.49Å; K75-E130 WeakPolarHBondContact CE-OE1 3.34Å; K75-E130 IonicContact NZ-OE1 3.45Å; K75-E130 PolarHBondContact NZ-OE1 2.82Å; Y81-E130 HydrophobicContact CE1-CB 3.91Å; Y81-E130 HydrophobicContact CE1-CG 3.78Å; Y81-E130 WeakPolarHBondContact OH-CB 3.49Å; Y81-E130 PolarHBondContact OH-N 3.31Å; Y83-E130 HydrophobicContact CG-CG 4.24Å; E130-R142 WeakPolarHBondContact O-CG 3.3Å; E130-R142 PolarHBondContact O-NE 2.88Å; E130-Y145 WeakPolarHBondContact CB-OH 3.32Å; E130-Y145 WeakPolarHBondContact O-CE2 3.32Å
131	W	97.3	Very high	96.1	Very high	4 Å²	4	38.1 Å²	38.1	2%	0.015	20%	0.201	C	C	.	.	S	Bend	trans	-136.6	164.6	176.9	44.7	-96	0	0	0	112	Y81 P82 P96 P133 N138 Y145 F173 A177 L180 M181	Y81-W131 AromaticContact CD2-CZ2 3.95Å; Y81-W131 HydrophobicContact CD2-CZ2 3.95Å; Y81-W131 HydrophobicContact CE2-CD2 4.45Å; Y81-W131 AromaticContact CE2-CE2 3.43Å; Y81-W131 VanDerWaalsContact CE2-CE2 3.43Å; Y81-W131 HydrophobicContact CE2-CH2 4.08Å; Y81-W131 AromaticContact CE2-CZ2 3.22Å; Y81-W131 HydrophobicContact CE2-CZ2 3.22Å; Y81-W131 AromaticContact CE2-NE1 3.5Å; Y81-W131 AromaticContact CZ-CE2 3.75Å; Y81-W131 AromaticContact CZ-NE1 3.44Å; Y81-W131 PolarHBondContact OH-NE1 3.48Å; P82-W131 HydrophobicContact CG-CZ2 4.4Å; P82-W131 PolarHBondContact O-NE1 2.96Å; P96-W131 HydrophobicContact CG-CD2 4.26Å; P96-W131 HydrophobicContact CG-CE3 4.47Å; P96-W131 HydrophobicContact CG-CH2 3.97Å; P96-W131 HydrophobicContact CG-CZ2 3.68Å; P96-W131 HydrophobicContact CG-CZ3 4.36Å; W131-P133 HydrophobicContact CZ3-CB 4.22Å; W131-N138 WeakPolarHBondContact CA-OD1 3.4Å; W131-N138 WeakPolarHBondContact CB-OD1 3.24Å; W131-Y145 HydrophobicContact CB-CD1 4.02Å; W131-Y145 HydrophobicContact CB-CD2 3.81Å; W131-Y145 HydrophobicContact CB-CE1 4.17Å; W131-Y145 HydrophobicContact CB-CE2 3.98Å; W131-Y145 HydrophobicContact CB-CG 3.87Å; W131-Y145 AromaticContact CD1-CD1 3.82Å; W131-Y145 AromaticContact CD1-CE1 3.42Å; W131-Y145 VanDerWaalsContact CD1-CE1 3.42Å; W131-Y145 AromaticContact CD1-CZ 3.8Å; W131-Y145 HydrophobicContact CG-CD1 4.18Å; W131-Y145 HydrophobicContact CG-CE1 4.13Å; W131-F173 HydrophobicContact CB-CZ 4.23Å; W131-F173 HydrophobicContact CD2-CZ 4.35Å; W131-F173 HydrophobicContact CE3-CZ 4.16Å; W131-F173 HydrophobicContact CG-CZ 4.41Å; W131-A177 HydrophobicContact CE3-CB 4.4Å; W131-A177 HydrophobicContact CH2-CB 4.06Å; W131-A177 HydrophobicContact CZ3-CB 3.67Å; W131-L180 HydrophobicContact CH2-CD2 4.14Å; W131-L180 HydrophobicContact CZ2-CD2 3.86Å; W131-M181 HydrophobicContact CH2-CG 4.06Å; W131-M181 HydrophobicContact CH2-SD 4.09Å; W131-M181 HydrophobicContact CZ3-CG 4.36Å; W131-M181 HydrophobicContact CZ3-SD 3.79Å
132	C	96.9	Very high	96.2	Very high	15 Å²	15	38.3 Å²	38.3	10%	0.101	19%	0.189	C	C	.	.			trans	-97.9	136.9	170.4	-172.4	0	0	0	0	109.2	L134 N138 F173	C132-L134 PolarHBondContact O-N 2.85Å; C132-N138 PolarHBondContact N-OD1 2.9Å; C132-N138 PolarHBondContact O-ND2 3.28Å; C132-F173 VanDerWaalsContact O-CE1 3.24Å; C132-F173 WeakPolarHBondContact O-CE1 3.48Å; C132-F173 WeakPolarHBondContact O-CZ 3.47Å
133	P	97.8	Very high	96.3	Very high	1 Å²	1	45.8 Å²	45.8	1%	0.006	21%	0.214	C	C	.	.	S	Bend	trans	-64	-21.2	179.7	22.5	-33.4	0	0	0	114	W131 A177 M181 Y202 L231 W233	W131-P133 HydrophobicContact CZ3-CB 4.22Å; P133-A177 HydrophobicContact CB-CB 4.08Å; P133-M181 HydrophobicContact CB-SD 3.7Å; P133-M181 HydrophobicContact CG-CE 4.42Å; P133-M181 HydrophobicContact CG-SD 3.81Å; P133-Y202 WeakPolarHBondContact CD-OH 3.33Å; P133-L231 HydrophobicContact CB-CD2 4.38Å; P133-L231 HydrophobicContact CG-CD2 3.79Å; P133-W233 HydrophobicContact CB-CH2 4.07Å; P133-W233 HydrophobicContact CB-CZ2 3.98Å; P133-W233 HydrophobicContact CG-CH2 4.46Å; P133-W233 HydrophobicContact CG-CZ2 4.41Å
134	L	98.1	Very high	96.2	Very high	10 Å²	10	47.9 Å²	47.9	5%	0.052	23%	0.231	C	C	.	.	S	Bend	trans	-93.8	133	170.8	-57.2	179.2	0	0	0	109.7	C132 A136 G137 N138 E174 R227 Q230 L231	C132-L134 PolarHBondContact O-N 2.85Å; L134-A136 VanDerWaalsContact C-N 3.3Å; L134-A136 PolarHBondContact O-N 2.83Å; L134-G137 WeakPolarHBondContact O-CA 3.39Å; L134-G137 PolarHBondContact O-N 3.31Å; L134-N138 PolarHBondContact O-ND2 3.22Å; L134-N138 VanDerWaalsContact O-ND2 3.1Å; L134-E174 WeakPolarHBondContact CA-OE1 3.24Å; L134-R227 HydrophobicContact CD1-CB 3.84Å; L134-R227 HydrophobicContact CD1-CG 3.89Å; L134-Q230 HydrophobicContact CD1-CB 4.03Å; L134-L231 HydrophobicContact CD1-CD2 4.23Å; L134-L231 HydrophobicContact CD1-CG 4.1Å; L134-L231 HydrophobicContact CD2-CD2 4.05Å; L134-L231 HydrophobicContact CG-CD2 3.91Å; L134-L231 HydrophobicContact CG-CG 4.32Å
135	W	97.8	Very high	96.3	Very high	41 Å²	41	48.3 Å²	48.3	16%	0.155	23%	0.233	C	C	.	.	G	3₁₀ helix	trans	-52.7	-47.5	-179.9	179.8	-94.5	0	0	0	112.1	G137 N138 Q146 L166 A169 Y170 F173 E174	W135-G137 PolarHBondContact O-N 2.91Å; W135-N138 PolarHBondContact O-N 2.88Å; W135-Q146 HydrophobicContact CD2-CG 3.97Å; W135-Q146 HydrophobicContact CE3-CG 4.2Å; W135-Q146 HydrophobicContact CH2-CB 3.68Å; W135-Q146 HydrophobicContact CH2-CG 3.98Å; W135-Q146 HydrophobicContact CZ2-CB 3.62Å; W135-Q146 HydrophobicContact CZ2-CG 3.71Å; W135-Q146 HydrophobicContact CZ3-CB 4.26Å; W135-Q146 HydrophobicContact CZ3-CG 4.21Å; W135-Q146 PolarHBondContact O-NE2 3.35Å; W135-L166 HydrophobicContact CZ2-CD1 4.04Å; W135-A169 HydrophobicContact CH2-CB 4.21Å; W135-A169 HydrophobicContact CZ3-CB 4.46Å; W135-Y170 HydrophobicContact CB-CD2 3.45Å; W135-Y170 VanDerWaalsContact CB-CD2 3.45Å; W135-Y170 HydrophobicContact CB-CE2 3.59Å; W135-Y170 AromaticContact CD1-CD2 3.93Å; W135-Y170 AromaticContact CD2-CD2 3.92Å; W135-Y170 HydrophobicContact CD2-CD2 3.92Å; W135-Y170 HydrophobicContact CE3-CD2 4.39Å; W135-Y170 AromaticContact CG-CD2 3.51Å; W135-Y170 HydrophobicContact CG-CD2 3.51Å; W135-Y170 HydrophobicContact CG-CE2 4.09Å; W135-F173 HydrophobicContact CE3-CB 3.98Å; W135-F173 HydrophobicContact CE3-CD1 4.18Å; W135-F173 HydrophobicContact CE3-CG 4.13Å; W135-F173 HydrophobicContact CZ3-CB 4.1Å; W135-F173 HydrophobicContact CZ3-CG 4.44Å; W135-E174 HydrophobicContact CB-CG 4.07Å; W135-E174 WeakPolarHBondContact CB-OE1 3.45Å; W135-E174 PolarHBondContact N-OE1 2.9Å
136	A	94.7	Very high	96.3	Very high	70 Å²	70	50.3 Å²	50.3	58%	0.579	24%	0.242	S	C	*	.	G	3₁₀ helix	trans	-62.4	-16.1	178.8	0	0	0	0	0	113.1	L134 N138 W139	L134-A136 VanDerWaalsContact C-N 3.3Å; L134-A136 PolarHBondContact O-N 2.83Å; A136-N138 VanDerWaalsContact C-N 3.35Å; A136-W139 WeakPolarHBondContact O-CZ3 3.2Å
137	G	92.9	Very high	96.2	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	-76.8	-12.1	175.3	0	0	0	0	0	115.7	L134 W135 W139	L134-G137 WeakPolarHBondContact O-CA 3.39Å; L134-G137 PolarHBondContact O-N 3.31Å; W135-G137 PolarHBondContact O-N 2.91Å; G137-W139 VanDerWaalsContact C-CE3 3.45Å; G137-W139 PolarHBondContact O-N 2.69Å
138	N	96.1	Very high	96.2	Very high	1 Å²	1	53.9 Å²	53.9	1%	0.005	27%	0.274	C	S	.	.			trans	-98.9	61.6	-169.3	-69.5	-65.1	0	0	0	113	W131 C132 L134 W135 A136 R142 R143 Q146 F173	W131-N138 WeakPolarHBondContact CA-OD1 3.4Å; W131-N138 WeakPolarHBondContact CB-OD1 3.24Å; C132-N138 PolarHBondContact N-OD1 2.9Å; C132-N138 PolarHBondContact O-ND2 3.28Å; L134-N138 PolarHBondContact O-ND2 3.22Å; L134-N138 VanDerWaalsContact O-ND2 3.1Å; W135-N138 PolarHBondContact O-N 2.88Å; A136-N138 VanDerWaalsContact C-N 3.35Å; N138-R142 HydrophobicContact CB-CB 4.01Å; N138-R142 CarbonylContact O-C 3.58Å; N138-R143 PolarHBondContact O-N 3.38Å; N138-Q146 HydrophobicContact CB-CG 4.06Å; N138-F173 WeakPolarHBondContact ND2-CE1 3.44Å
139	W	92.3	Very high	96.2	Very high	142 Å²	142	53.4 Å²	53.4	54%	0.538	27%	0.272	S	S	.	.			trans	-92.6	172.9	176.8	56.5	78	0	0	0	113.8	A136 G137 R141 R142	A136-W139 WeakPolarHBondContact O-CZ3 3.2Å; G137-W139 VanDerWaalsContact C-CE3 3.45Å; G137-W139 PolarHBondContact O-N 2.69Å; W139-R141 PolarHBondContact O-N 3.4Å; W139-R142 WeakPolarHBondContact O-CB 3.49Å; W139-R142 PolarHBondContact O-N 3.1Å
140	G	92.6	Very high	96.3	Very high	52 Å²	52	53.3 Å²	53.3	54%	0.536	27%	0.269	S	S	.	.	G	3₁₀ helix	trans	59.9	-129.1	178.9	0	0	0	0	0	111.5	R142 R143	G140-R142 PolarHBondContact O-N 2.95Å; G140-R143 WeakPolarHBondContact O-CB 3.45Å; G140-R143 WeakPolarHBondContact O-CG 2.88Å; G140-R143 PolarHBondContact O-N 2.91Å; G140-R143 VanDerWaalsContact O-N 3.12Å
141	R	91.3	Very high	96.3	Very high	245 Å²	245	52.8 Å²	52.8	93%	0.925	27%	0.273	S	S	*	.	G	3₁₀ helix	trans	-61.2	-24.8	177	-66.6	-175.3	179.4	-177.9	-1.4	113.2	W139 R143 A144	W139-R141 PolarHBondContact O-N 3.4Å; R141-R143 PolarHBondContact O-N 3.4Å; R141-A144 PolarHBondContact O-N 3.14Å
142	R	95.3	Very high	96.4	Very high	65 Å²	65	55.4 Å²	55.4	25%	0.245	28%	0.283	C	S	.	.	G	3₁₀ helix	trans	-75.7	-6.3	178.5	-60.3	-176.7	177.5	172.6	3.3	113.5	E129 E130 N138 W139 G140 A144 Y145	E129-R142 VanDerWaalsContact O-CZ 3.28Å; E129-R142 PolarHBondContact O-NE 2.91Å; E129-R142 PolarHBondContact O-NH2 3.5Å; E130-R142 WeakPolarHBondContact O-CG 3.3Å; E130-R142 PolarHBondContact O-NE 2.88Å; N138-R142 HydrophobicContact CB-CB 4.01Å; N138-R142 CarbonylContact O-C 3.58Å; W139-R142 WeakPolarHBondContact O-CB 3.49Å; W139-R142 PolarHBondContact O-N 3.1Å; G140-R142 PolarHBondContact O-N 2.95Å; R142-A144 PolarHBondContact O-N 3.46Å; R142-A144 VanDerWaalsContact O-N 3.12Å; R142-Y145 HydrophobicContact CB-CD2 4.09Å; R142-Y145 WeakPolarHBondContact O-CB 3.3Å; R142-Y145 WeakPolarHBondContact O-CD2 3.44Å; R142-Y145 PolarHBondContact O-N 3.15Å
143	R	96.3	Very high	96.5	Very high	167 Å²	167	54.7 Å²	54.7	63%	0.63	28%	0.278	S	S	*	.	H	α-helix	trans	-58.9	-22.4	170	-73.7	-174.6	177.1	174.2	-0	112.6	N138 G140 R141 Y145 Q146 A147	N138-R143 PolarHBondContact O-N 3.38Å; G140-R143 WeakPolarHBondContact O-CB 3.45Å; G140-R143 WeakPolarHBondContact O-CG 2.88Å; G140-R143 PolarHBondContact O-N 2.91Å; G140-R143 VanDerWaalsContact O-N 3.12Å; R141-R143 PolarHBondContact O-N 3.4Å; R143-Y145 PolarHBondContact O-N 3.09Å; R143-Q146 WeakPolarHBondContact O-CB 3.25Å; R143-Q146 PolarHBondContact O-N 2.76Å; R143-Q146 VanDerWaalsContact O-N 3.08Å; R143-A147 PolarHBondContact O-N 2.83Å
144	A	96.7	Very high	96.5	Very high	47 Å²	47	59 Å²	59	39%	0.388	30%	0.298	S	S	.	.	H	α-helix	trans	-54.5	-34.8	171.9	0	0	0	0	0	112.7	F84 R141 R142 A148	F84-A144 HydrophobicContact CD2-CB 4.34Å; R141-A144 PolarHBondContact O-N 3.14Å; R142-A144 PolarHBondContact O-N 3.46Å; R142-A144 VanDerWaalsContact O-N 3.12Å; A144-A148 VanDerWaalsContact O-CB 3.24Å; A144-A148 WeakPolarHBondContact O-CB 2.98Å; A144-A148 PolarHBondContact O-N 3.39Å
145	Y	98.4	Very high	96.4	Very high	9 Å²	9	66 Å²	66	4%	0.035	33%	0.33	C	S	.	.	H	α-helix	trans	-70.7	-36.4	177	-64.3	-81.2	0	0	0	112.5	F84 G94 I95 E130 W131 R142 R143 S149	F84-Y145 AromaticContact CD2-CD1 3.84Å; F84-Y145 HydrophobicContact CD2-CD1 3.84Å; F84-Y145 AromaticContact CD2-CE1 3.41Å; F84-Y145 HydrophobicContact CD2-CE1 3.41Å; F84-Y145 VanDerWaalsContact CD2-CE1 3.41Å; F84-Y145 HydrophobicContact CD2-CE2 4.19Å; F84-Y145 HydrophobicContact CD2-CG 4.36Å; F84-Y145 AromaticContact CD2-CZ 3.58Å; F84-Y145 AromaticContact CE2-CD1 3.59Å; F84-Y145 HydrophobicContact CE2-CD1 3.59Å; F84-Y145 AromaticContact CE2-CE1 3.61Å; F84-Y145 HydrophobicContact CE2-CE1 3.61Å; F84-Y145 HydrophobicContact CE2-CG 4.17Å; F84-Y145 HydrophobicContact CG-CE1 4.46Å; F84-Y145 PolarHBondContact N-OH 3.21Å; F84-Y145 VanDerWaalsContact N-OH 3.13Å; G94-Y145 VanDerWaalsContact O-CE1 3.23Å; G94-Y145 WeakPolarHBondContact O-CE1 3.38Å; I95-Y145 HydrophobicContact CG2-CD1 4.25Å; E130-Y145 WeakPolarHBondContact CB-OH 3.32Å; E130-Y145 WeakPolarHBondContact O-CE2 3.32Å; W131-Y145 HydrophobicContact CB-CD1 4.02Å; W131-Y145 HydrophobicContact CB-CD2 3.81Å; W131-Y145 HydrophobicContact CB-CE1 4.17Å; W131-Y145 HydrophobicContact CB-CE2 3.98Å; W131-Y145 HydrophobicContact CB-CG 3.87Å; W131-Y145 AromaticContact CD1-CD1 3.82Å; W131-Y145 AromaticContact CD1-CE1 3.42Å; W131-Y145 VanDerWaalsContact CD1-CE1 3.42Å; W131-Y145 AromaticContact CD1-CZ 3.8Å; W131-Y145 HydrophobicContact CG-CD1 4.18Å; W131-Y145 HydrophobicContact CG-CE1 4.13Å; R142-Y145 HydrophobicContact CB-CD2 4.09Å; R142-Y145 WeakPolarHBondContact O-CB 3.3Å; R142-Y145 WeakPolarHBondContact O-CD2 3.44Å; R142-Y145 PolarHBondContact O-N 3.15Å; R143-Y145 PolarHBondContact O-N 3.09Å; Y145-S149 VanDerWaalsContact O-CB 3.22Å; Y145-S149 WeakPolarHBondContact O-CB 3.34Å; Y145-S149 PolarHBondContact O-N 3.34Å; Y145-S149 PolarHBondContact O-OG 3.24Å
146	Q	98.3	Very high	96.4	Very high	42 Å²	42	67.3 Å²	67.3	20%	0.196	34%	0.343	C	S	.	.	H	α-helix	trans	-67	-45.8	174.4	-63.8	177.4	-31	0	0	110.7	W135 N138 R143 S149 W150	W135-Q146 HydrophobicContact CD2-CG 3.97Å; W135-Q146 HydrophobicContact CE3-CG 4.2Å; W135-Q146 HydrophobicContact CH2-CB 3.68Å; W135-Q146 HydrophobicContact CH2-CG 3.98Å; W135-Q146 HydrophobicContact CZ2-CB 3.62Å; W135-Q146 HydrophobicContact CZ2-CG 3.71Å; W135-Q146 HydrophobicContact CZ3-CB 4.26Å; W135-Q146 HydrophobicContact CZ3-CG 4.21Å; W135-Q146 PolarHBondContact O-NE2 3.35Å; N138-Q146 HydrophobicContact CB-CG 4.06Å; R143-Q146 WeakPolarHBondContact O-CB 3.25Å; R143-Q146 PolarHBondContact O-N 2.76Å; R143-Q146 VanDerWaalsContact O-N 3.08Å; Q146-S149 PolarHBondContact O-N 2.88Å; Q146-W150 PolarHBondContact O-N 3.01Å
147	A	97.5	Very high	96.6	Very high	63 Å²	63	67 Å²	67	52%	0.521	33%	0.329	S	S	.	.	H	α-helix	trans	-63.4	-44	177.6	0	0	0	0	0	112.3	R143 W150 A151	R143-A147 PolarHBondContact O-N 2.83Å; A147-W150 WeakPolarHBondContact O-CB 3.4Å; A147-W150 PolarHBondContact O-N 3.32Å; A147-A151 PolarHBondContact O-N 2.86Å
148	A	98.2	Very high	96.8	Very high	27 Å²	27	70.9 Å²	70.9	22%	0.223	35%	0.354	C	S	.	.	H	α-helix	trans	-66.6	-38.1	176.4	0	0	0	0	0	112.3	F84 I95 A144 W150 A151 W152	F84-A148 HydrophobicContact CE2-CB 3.98Å; F84-A148 HydrophobicContact CZ-CB 3.47Å; F84-A148 VanDerWaalsContact CZ-CB 3.47Å; I95-A148 HydrophobicContact CG2-CB 3.71Å; A144-A148 VanDerWaalsContact O-CB 3.24Å; A144-A148 WeakPolarHBondContact O-CB 2.98Å; A144-A148 PolarHBondContact O-N 3.39Å; A148-W150 VanDerWaalsContact C-N 3.31Å; A148-W150 PolarHBondContact O-N 2.64Å; A148-A151 PolarHBondContact O-N 3.13Å; A148-W152 WeakPolarHBondContact O-CB 3.44Å; A148-W152 PolarHBondContact O-N 2.94Å
149	S	98.7	Very high	96.9	Very high	0 Å²	0	78.3 Å²	78.3	0%	0	39%	0.394	C	S	.	.	H	α-helix	trans	-63.4	-38.9	174.4	-63.6	0	0	0	0	112.1	Q97 Y145 Q146 A153 A169 F173	Q97-S149 PolarHBondContact NE2-OG 2.96Å; Y145-S149 VanDerWaalsContact O-CB 3.22Å; Y145-S149 WeakPolarHBondContact O-CB 3.34Å; Y145-S149 PolarHBondContact O-N 3.34Å; Y145-S149 PolarHBondContact O-OG 3.24Å; Q146-S149 PolarHBondContact O-N 2.88Å; S149-A153 PolarHBondContact O-N 2.69Å; S149-A169 VanDerWaalsContact O-CB 3.31Å; S149-A169 WeakPolarHBondContact O-CB 3.45Å; S149-F173 WeakPolarHBondContact OG-CD2 3.49Å
150	W	98.4	Very high	97.1	Very high	69 Å²	69	74.1 Å²	74.1	26%	0.261	38%	0.382	S	S	.	.	H	α-helix	trans	-63.4	-50.8	173.4	-176.9	-79.8	0	0	0	111.7	Q146 A147 A148 W152 A153 Q154 P162 Q165 L166	Q146-W150 PolarHBondContact O-N 3.01Å; A147-W150 WeakPolarHBondContact O-CB 3.4Å; A147-W150 PolarHBondContact O-N 3.32Å; A148-W150 VanDerWaalsContact C-N 3.31Å; A148-W150 PolarHBondContact O-N 2.64Å; W150-W152 VanDerWaalsContact C-N 3.25Å; W150-W152 PolarHBondContact O-N 3.29Å; W150-A153 WeakPolarHBondContact O-CB 3.45Å; W150-A153 PolarHBondContact O-N 3.16Å; W150-Q154 VanDerWaalsContact CD1-OE1 3.29Å; W150-Q154 WeakPolarHBondContact O-CG 3.46Å; W150-Q154 PolarHBondContact O-N 2.94Å; W150-P162 HydrophobicContact CH2-CB 4.45Å; W150-P162 WeakPolarHBondContact CH2-O 3.41Å; W150-P162 HydrophobicContact CZ2-CB 4.16Å; W150-P162 VanDerWaalsContact CZ2-O 3.25Å; W150-P162 WeakPolarHBondContact CZ2-O 3.36Å; W150-Q165 HydrophobicContact CZ2-CB 4.43Å; W150-L166 VanDerWaalsContact CE3-CA 3.49Å; W150-L166 HydrophobicContact CE3-CB 3.71Å; W150-L166 HydrophobicContact CE3-CD1 3.3Å; W150-L166 HydrophobicContact CE3-CG 3.91Å; W150-L166 HydrophobicContact CH2-CB 3.48Å; W150-L166 VanDerWaalsContact CH2-CB 3.48Å; W150-L166 HydrophobicContact CH2-CG 4.27Å; W150-L166 HydrophobicContact CZ3-CB 2.95Å; W150-L166 HydrophobicContact CZ3-CD1 3.24Å; W150-L166 HydrophobicContact CZ3-CD2 3.73Å; W150-L166 HydrophobicContact CZ3-CG 3.33Å
151	A	98	Very high	97.4	Very high	39 Å²	39	75.5 Å²	75.5	32%	0.322	38%	0.377	S	S	.	.	H	α-helix	trans	-58.8	-39.2	178.5	0	0	0	0	0	111.8	A147 A148 Q154 Q155	A147-A151 PolarHBondContact O-N 2.86Å; A148-A151 PolarHBondContact O-N 3.13Å; A151-Q154 PolarHBondContact O-N 3.03Å; A151-Q155 WeakPolarHBondContact O-CG 3.13Å; A151-Q155 PolarHBondContact O-N 2.92Å
152	W	98.1	Very high	97.7	Very high	59 Å²	59	67.9 Å²	67.9	22%	0.223	36%	0.359	C	S	.	.	H	α-helix	trans	-60.9	-45	171.9	173.3	87.8	0	0	0	111.9	I95 Q97 A148 W150 Q154 Q155 V156 F157	I95-W152 HydrophobicContact CD1-CB 3.63Å; I95-W152 HydrophobicContact CD1-CG 3.87Å; Q97-W152 HydrophobicContact CB-CH2 4.35Å; Q97-W152 HydrophobicContact CB-CZ2 4.36Å; Q97-W152 HydrophobicContact CG-CD2 3.78Å; Q97-W152 HydrophobicContact CG-CE3 3.73Å; Q97-W152 HydrophobicContact CG-CG 4.5Å; Q97-W152 HydrophobicContact CG-CH2 3.94Å; Q97-W152 HydrophobicContact CG-CZ2 3.97Å; Q97-W152 HydrophobicContact CG-CZ3 3.82Å; A148-W152 WeakPolarHBondContact O-CB 3.44Å; A148-W152 PolarHBondContact O-N 2.94Å; W150-W152 VanDerWaalsContact C-N 3.25Å; W150-W152 PolarHBondContact O-N 3.29Å; W152-Q154 VanDerWaalsContact C-N 3.34Å; W152-Q154 PolarHBondContact O-N 2.87Å; W152-Q155 PolarHBondContact O-N 2.78Å; W152-V156 HydrophobicContact CD2-CG2 4.11Å; W152-V156 HydrophobicContact CG-CG2 4.37Å; W152-V156 HydrophobicContact CZ2-CB 4.47Å; W152-V156 HydrophobicContact CZ2-CG1 4.36Å; W152-V156 HydrophobicContact CZ2-CG2 3.98Å; W152-V156 WeakPolarHBondContact O-CB 3.08Å; W152-V156 WeakPolarHBondContact O-CG2 3.47Å; W152-V156 PolarHBondContact O-N 3.37Å; W152-F157 HydrophobicContact CH2-CE2 4.02Å; W152-F157 HydrophobicContact CH2-CZ 4.5Å; W152-F157 AromaticContact CZ3-CE2 3.93Å; W152-F157 HydrophobicContact CZ3-CE2 3.93Å
153	A	98.4	Very high	97.8	Very high	0 Å²	0	72.3 Å²	72.3	0%	0	38%	0.382	C	S	.	.	H	α-helix	trans	-65	-36.8	178.9	0	0	0	0	0	112.5	S149 W150 Q155 V156 F157 Q165 K168 A169	S149-A153 PolarHBondContact O-N 2.69Å; W150-A153 WeakPolarHBondContact O-CB 3.45Å; W150-A153 PolarHBondContact O-N 3.16Å; A153-Q155 VanDerWaalsContact C-N 3.28Å; A153-Q155 PolarHBondContact O-N 2.65Å; A153-V156 PolarHBondContact O-N 2.84Å; A153-F157 HydrophobicContact CB-CD2 4.32Å; A153-F157 WeakPolarHBondContact O-CA 3.49Å; A153-F157 WeakPolarHBondContact O-CB 3.33Å; A153-F157 PolarHBondContact O-N 3.24Å; A153-Q165 HydrophobicContact CB-CB 4.47Å; A153-Q165 VanDerWaalsContact CB-O 3.31Å; A153-Q165 WeakPolarHBondContact CB-O 3.24Å; A153-K168 HydrophobicContact CB-CB 4.33Å; A153-A169 HydrophobicContact CB-CB 3.86Å
154	Q	98.3	Very high	97.8	Very high	90 Å²	90	68.7 Å²	68.7	42%	0.421	37%	0.373	S	S	.	.	H	α-helix	trans	-62	-36.6	174	-68.9	179.8	-56	0	0	112.5	W150 A151 W152 P158	W150-Q154 VanDerWaalsContact CD1-OE1 3.29Å; W150-Q154 WeakPolarHBondContact O-CG 3.46Å; W150-Q154 PolarHBondContact O-N 2.94Å; A151-Q154 PolarHBondContact O-N 3.03Å; W152-Q154 VanDerWaalsContact C-N 3.34Å; W152-Q154 PolarHBondContact O-N 2.87Å; Q154-P158 WeakPolarHBondContact O-CA 3.45Å
155	Q	97.5	Very high	97.9	Very high	157 Å²	157	67.2 Å²	67.2	73%	0.734	36%	0.358	S	S	*	.	H	α-helix	trans	-76.5	-39	178.8	-70.5	175.8	-4.2	0	0	112.5	A151 W152 A153	A151-Q155 WeakPolarHBondContact O-CG 3.13Å; A151-Q155 PolarHBondContact O-N 2.92Å; W152-Q155 PolarHBondContact O-N 2.78Å; A153-Q155 VanDerWaalsContact C-N 3.28Å; A153-Q155 PolarHBondContact O-N 2.65Å
156	V	97.4	Very high	97.9	Very high	70 Å²	70	70.2 Å²	70.2	42%	0.424	37%	0.374	S	S	.	.	H	α-helix	trans	-83	-28.6	-175.8	176.3	0	0	0	0	112.1	W152 A153 P158	W152-V156 HydrophobicContact CD2-CG2 4.11Å; W152-V156 HydrophobicContact CG-CG2 4.37Å; W152-V156 HydrophobicContact CZ2-CB 4.47Å; W152-V156 HydrophobicContact CZ2-CG1 4.36Å; W152-V156 HydrophobicContact CZ2-CG2 3.98Å; W152-V156 WeakPolarHBondContact O-CB 3.08Å; W152-V156 WeakPolarHBondContact O-CG2 3.47Å; W152-V156 PolarHBondContact O-N 3.37Å; A153-V156 PolarHBondContact O-N 2.84Å; V156-P158 VanDerWaalsContact C-CD 3.44Å
157	F	97.6	Very high	97.9	Very high	62 Å²	62	74.7 Å²	74.7	27%	0.272	39%	0.39	S	S	.	.			trans	-127.7	61.5	-177.9	-51	-72.2	0	0	0	111.3	W152 A153 D159 L160 Q165 K168	W152-F157 HydrophobicContact CH2-CE2 4.02Å; W152-F157 HydrophobicContact CH2-CZ 4.5Å; W152-F157 AromaticContact CZ3-CE2 3.93Å; W152-F157 HydrophobicContact CZ3-CE2 3.93Å; A153-F157 HydrophobicContact CB-CD2 4.32Å; A153-F157 WeakPolarHBondContact O-CA 3.49Å; A153-F157 WeakPolarHBondContact O-CB 3.33Å; A153-F157 PolarHBondContact O-N 3.24Å; F157-D159 PolarHBondContact O-N 3.37Å; F157-L160 HydrophobicContact CB-CB 4.37Å; F157-L160 HydrophobicContact CB-CD1 3.65Å; F157-L160 HydrophobicContact CB-CG 3.92Å; F157-L160 HydrophobicContact CD1-CD1 4.28Å; F157-L160 HydrophobicContact CG-CD1 4.03Å; F157-L160 PolarHBondContact O-N 2.8Å; F157-Q165 PolarHBondContact O-NE2 2.78Å; F157-K168 HydrophobicContact CD2-CB 3.79Å; F157-K168 HydrophobicContact CD2-CG 3.88Å; F157-K168 HydrophobicContact CE2-CB 3.79Å; F157-K168 HydrophobicContact CE2-CD 4.33Å; F157-K168 HydrophobicContact CE2-CG 3.99Å; F157-K168 HydrophobicContact CG-CG 4.31Å; F157-K168 HydrophobicContact CZ-CD 4.4Å; F157-K168 HydrophobicContact CZ-CG 4.49Å
158	P	97.5	Very high	97.9	Very high	82 Å²	82	75.4 Å²	75.4	53%	0.532	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-25.6	-173.5	27.9	-35.9	0	0	0	113.4	Q154 V156	Q154-P158 WeakPolarHBondContact O-CA 3.45Å; V156-P158 VanDerWaalsContact C-CD 3.44Å
159	D	98	Very high	98	Very high	158 Å²	158	74.1 Å²	74.1	85%	0.845	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.9	-11.7	-176	-54.1	-44.6	0	0	0	113.8	F157	F157-D159 PolarHBondContact O-N 3.37Å
160	L	97.6	Very high	97.9	Very high	54 Å²	54	78 Å²	78	28%	0.283	39%	0.386	S	S	.	.	S	Bend	trans	-81.2	152.2	177.6	-60.7	-175.2	0	0	0	110.9	F157 E164 Q165 K168	F157-L160 HydrophobicContact CB-CB 4.37Å; F157-L160 HydrophobicContact CB-CD1 3.65Å; F157-L160 HydrophobicContact CB-CG 3.92Å; F157-L160 HydrophobicContact CD1-CD1 4.28Å; F157-L160 HydrophobicContact CG-CD1 4.03Å; F157-L160 PolarHBondContact O-N 2.8Å; L160-E164 HydrophobicContact CB-CB 3.97Å; L160-E164 HydrophobicContact CD1-CB 4.27Å; L160-E164 WeakPolarHBondContact CD2-OE2 3.34Å; L160-Q165 HydrophobicContact CB-CG 4.03Å; L160-Q165 PolarHBondContact O-NE2 3.08Å; L160-Q165 VanDerWaalsContact O-NE2 3.14Å; L160-K168 HydrophobicContact CD1-CG 3.9Å
161	D	97.4	Very high	97.9	Very high	80 Å²	80	76.4 Å²	76.4	43%	0.428	38%	0.382	S	S	.	.			trans	-69	161.7	174.2	79.9	64.4	0	0	0	111.6	Q163 E164 Q165	D161-Q163 VanDerWaalsContact C-N 3.29Å; D161-Q163 PolarHBondContact O-N 2.87Å; D161-Q163 WeakPolarHBondContact OD1-CA 3.31Å; D161-Q163 VanDerWaalsContact OD1-CB 3.3Å; D161-Q163 WeakPolarHBondContact OD1-CB 3.46Å; D161-Q163 PolarHBondContact OD1-N 2.86Å; D161-E164 PolarHBondContact O-N 2.86Å; D161-E164 VanDerWaalsContact O-N 3.15Å; D161-E164 PolarHBondContact OD1-N 2.94Å; D161-E164 VanDerWaalsContact OD1-N 3.09Å; D161-E164 WeakPolarHBondContact OD2-CG 3.35Å; D161-Q165 WeakPolarHBondContact O-CG 3.44Å; D161-Q165 PolarHBondContact O-N 3.39Å
162	P	97.3	Very high	98	Very high	85 Å²	85	75.1 Å²	75.1	55%	0.552	37%	0.373	S	S	*	.	H	α-helix	trans	-56.8	-36.7	-176.9	-28.1	36.6	0	0	0	114.5	W150 Q165 L166	W150-P162 HydrophobicContact CH2-CB 4.45Å; W150-P162 WeakPolarHBondContact CH2-O 3.41Å; W150-P162 HydrophobicContact CZ2-CB 4.16Å; W150-P162 VanDerWaalsContact CZ2-O 3.25Å; W150-P162 WeakPolarHBondContact CZ2-O 3.36Å; P162-Q165 PolarHBondContact O-N 3.19Å; P162-L166 PolarHBondContact O-N 3.38Å
163	Q	97.6	Very high	98	Very high	158 Å²	158	72.3 Å²	72.3	74%	0.738	36%	0.362	S	S	*	.	H	α-helix	trans	-70.4	-38.2	-180	-174.9	176.7	-25.2	0	0	111.2	D161 L166 Y167	D161-Q163 VanDerWaalsContact C-N 3.29Å; D161-Q163 PolarHBondContact O-N 2.87Å; D161-Q163 WeakPolarHBondContact OD1-CA 3.31Å; D161-Q163 VanDerWaalsContact OD1-CB 3.3Å; D161-Q163 WeakPolarHBondContact OD1-CB 3.46Å; D161-Q163 PolarHBondContact OD1-N 2.86Å; Q163-L166 WeakPolarHBondContact O-CB 3.47Å; Q163-L166 PolarHBondContact O-N 2.98Å; Q163-Y167 PolarHBondContact O-N 2.75Å; Q163-Y167 VanDerWaalsContact O-N 3.1Å
164	E	98	Very high	98	Very high	92 Å²	92	74.1 Å²	74.1	43%	0.43	37%	0.371	S	S	.	.	H	α-helix	trans	-66.3	-40.2	172.5	-71	-175	139.4	0	0	112	L160 D161 L166 Y167 K168	L160-E164 HydrophobicContact CB-CB 3.97Å; L160-E164 HydrophobicContact CD1-CB 4.27Å; L160-E164 WeakPolarHBondContact CD2-OE2 3.34Å; D161-E164 PolarHBondContact O-N 2.86Å; D161-E164 VanDerWaalsContact O-N 3.15Å; D161-E164 PolarHBondContact OD1-N 2.94Å; D161-E164 VanDerWaalsContact OD1-N 3.09Å; D161-E164 WeakPolarHBondContact OD2-CG 3.35Å; E164-L166 VanDerWaalsContact C-N 3.34Å; E164-L166 PolarHBondContact O-N 2.84Å; E164-Y167 WeakPolarHBondContact O-CB 3.43Å; E164-Y167 PolarHBondContact O-N 3.46Å; E164-Y167 VanDerWaalsContact O-N 3.14Å; E164-K168 WeakPolarHBondContact O-CG 3.46Å; E164-K168 PolarHBondContact O-N 3.34Å
165	Q	98.3	Very high	98	Very high	15 Å²	15	76.1 Å²	76.1	7%	0.07	38%	0.38	C	S	.	.	H	α-helix	trans	-60.3	-41.6	173	-69.7	172.1	-15	0	0	111.7	W150 A153 F157 L160 D161 P162 Y167 K168 A169	W150-Q165 HydrophobicContact CZ2-CB 4.43Å; A153-Q165 HydrophobicContact CB-CB 4.47Å; A153-Q165 VanDerWaalsContact CB-O 3.31Å; A153-Q165 WeakPolarHBondContact CB-O 3.24Å; F157-Q165 PolarHBondContact O-NE2 2.78Å; L160-Q165 HydrophobicContact CB-CG 4.03Å; L160-Q165 PolarHBondContact O-NE2 3.08Å; L160-Q165 VanDerWaalsContact O-NE2 3.14Å; D161-Q165 WeakPolarHBondContact O-CG 3.44Å; D161-Q165 PolarHBondContact O-N 3.39Å; P162-Q165 PolarHBondContact O-N 3.19Å; Q165-Y167 VanDerWaalsContact C-N 3.28Å; Q165-Y167 PolarHBondContact O-N 2.93Å; Q165-K168 PolarHBondContact O-N 3.46Å; Q165-A169 WeakPolarHBondContact O-CB 3.35Å; Q165-A169 PolarHBondContact O-N 3.29Å
166	L	97.9	Very high	98.1	Very high	72 Å²	72	69.7 Å²	69.7	38%	0.377	35%	0.354	S	S	.	.	H	α-helix	trans	-55	-49	172.3	-173.7	39.8	0	0	0	111.1	W135 W150 P162 Q163 E164 K168 A169 Y170	W135-L166 HydrophobicContact CZ2-CD1 4.04Å; W150-L166 VanDerWaalsContact CE3-CA 3.49Å; W150-L166 HydrophobicContact CE3-CB 3.71Å; W150-L166 HydrophobicContact CE3-CD1 3.3Å; W150-L166 HydrophobicContact CE3-CG 3.91Å; W150-L166 HydrophobicContact CH2-CB 3.48Å; W150-L166 VanDerWaalsContact CH2-CB 3.48Å; W150-L166 HydrophobicContact CH2-CG 4.27Å; W150-L166 HydrophobicContact CZ3-CB 2.95Å; W150-L166 HydrophobicContact CZ3-CD1 3.24Å; W150-L166 HydrophobicContact CZ3-CD2 3.73Å; W150-L166 HydrophobicContact CZ3-CG 3.33Å; P162-L166 PolarHBondContact O-N 3.38Å; Q163-L166 WeakPolarHBondContact O-CB 3.47Å; Q163-L166 PolarHBondContact O-N 2.98Å; E164-L166 VanDerWaalsContact C-N 3.34Å; E164-L166 PolarHBondContact O-N 2.84Å; L166-K168 VanDerWaalsContact C-N 3.33Å; L166-K168 PolarHBondContact O-N 3.08Å; L166-A169 WeakPolarHBondContact O-CB 3.2Å; L166-A169 PolarHBondContact O-N 2.94Å; L166-Y170 WeakPolarHBondContact O-CB 3.14Å; L166-Y170 PolarHBondContact O-N 2.81Å
167	Y	98.3	Very high	98.2	Very high	137 Å²	137	66.4 Å²	66.4	54%	0.537	33%	0.334	S	S	.	.	H	α-helix	trans	-64.6	-42.1	-175.8	-179.2	-108.4	0	0	0	110.3	Q163 E164 Q165 A169 Y170 I171	Q163-Y167 PolarHBondContact O-N 2.75Å; Q163-Y167 VanDerWaalsContact O-N 3.1Å; E164-Y167 WeakPolarHBondContact O-CB 3.43Å; E164-Y167 PolarHBondContact O-N 3.46Å; E164-Y167 VanDerWaalsContact O-N 3.14Å; Q165-Y167 VanDerWaalsContact C-N 3.28Å; Q165-Y167 PolarHBondContact O-N 2.93Å; Y167-A169 PolarHBondContact O-N 2.77Å; Y167-Y170 HydrophobicContact CD2-CD1 4.19Å; Y167-Y170 HydrophobicContact CE2-CD1 4.27Å; Y167-Y170 PolarHBondContact O-N 3.04Å; Y167-I171 HydrophobicContact CD1-CD1 4.21Å; Y167-I171 HydrophobicContact CD1-CG2 4.45Å; Y167-I171 HydrophobicContact CD2-CG2 4.11Å; Y167-I171 HydrophobicContact CE1-CD1 3.85Å; Y167-I171 HydrophobicContact CE1-CG2 4Å; Y167-I171 HydrophobicContact CE2-CG2 3.61Å; Y167-I171 WeakPolarHBondContact O-CG1 3.04Å; Y167-I171 PolarHBondContact O-N 3.44Å
168	K	98.3	Very high	98.2	Very high	78 Å²	78	68 Å²	68	34%	0.339	34%	0.338	S	S	.	.	H	α-helix	trans	-60.2	-41.9	172.3	-68.9	-57	-169.3	-174.4	0	112.6	A153 F157 L160 E164 Q165 L166 I171 G172	A153-K168 HydrophobicContact CB-CB 4.33Å; F157-K168 HydrophobicContact CD2-CB 3.79Å; F157-K168 HydrophobicContact CD2-CG 3.88Å; F157-K168 HydrophobicContact CE2-CB 3.79Å; F157-K168 HydrophobicContact CE2-CD 4.33Å; F157-K168 HydrophobicContact CE2-CG 3.99Å; F157-K168 HydrophobicContact CG-CG 4.31Å; F157-K168 HydrophobicContact CZ-CD 4.4Å; F157-K168 HydrophobicContact CZ-CG 4.49Å; L160-K168 HydrophobicContact CD1-CG 3.9Å; E164-K168 WeakPolarHBondContact O-CG 3.46Å; E164-K168 PolarHBondContact O-N 3.34Å; Q165-K168 PolarHBondContact O-N 3.46Å; L166-K168 VanDerWaalsContact C-N 3.33Å; L166-K168 PolarHBondContact O-N 3.08Å; K168-I171 HydrophobicContact CD-CD1 4.14Å; K168-G172 WeakPolarHBondContact O-CA 3.09Å; K168-G172 PolarHBondContact O-N 3.25Å
169	A	98.6	Very high	98.3	Very high	0 Å²	0	65.6 Å²	65.6	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-62.3	-45.3	175.4	0	0	0	0	0	111.8	W135 S149 A153 Q165 L166 Y167 F173	W135-A169 HydrophobicContact CH2-CB 4.21Å; W135-A169 HydrophobicContact CZ3-CB 4.46Å; S149-A169 VanDerWaalsContact O-CB 3.31Å; S149-A169 WeakPolarHBondContact O-CB 3.45Å; A153-A169 HydrophobicContact CB-CB 3.86Å; Q165-A169 WeakPolarHBondContact O-CB 3.35Å; Q165-A169 PolarHBondContact O-N 3.29Å; L166-A169 WeakPolarHBondContact O-CB 3.2Å; L166-A169 PolarHBondContact O-N 2.94Å; Y167-A169 PolarHBondContact O-N 2.77Å; A169-F173 VanDerWaalsContact O-CB 3.22Å; A169-F173 WeakPolarHBondContact O-CB 3.49Å; A169-F173 PolarHBondContact O-N 3.46Å
170	Y	98.5	Very high	98.3	Very high	82 Å²	82	58.2 Å²	58.2	32%	0.322	29%	0.285	S	S	.	.	H	α-helix	trans	-60.9	-58.5	178.2	163.1	-110.4	0	0	0	112	W135 L166 Y167 G172 F173 E174	W135-Y170 HydrophobicContact CB-CD2 3.45Å; W135-Y170 VanDerWaalsContact CB-CD2 3.45Å; W135-Y170 HydrophobicContact CB-CE2 3.59Å; W135-Y170 AromaticContact CD1-CD2 3.93Å; W135-Y170 AromaticContact CD2-CD2 3.92Å; W135-Y170 HydrophobicContact CD2-CD2 3.92Å; W135-Y170 HydrophobicContact CE3-CD2 4.39Å; W135-Y170 AromaticContact CG-CD2 3.51Å; W135-Y170 HydrophobicContact CG-CD2 3.51Å; W135-Y170 HydrophobicContact CG-CE2 4.09Å; L166-Y170 WeakPolarHBondContact O-CB 3.14Å; L166-Y170 PolarHBondContact O-N 2.81Å; Y167-Y170 HydrophobicContact CD2-CD1 4.19Å; Y167-Y170 HydrophobicContact CE2-CD1 4.27Å; Y167-Y170 PolarHBondContact O-N 3.04Å; Y170-G172 VanDerWaalsContact C-N 3.35Å; Y170-G172 PolarHBondContact O-N 2.64Å; Y170-F173 PolarHBondContact O-N 2.82Å; Y170-E174 HydrophobicContact CD2-CG 4.48Å; Y170-E174 HydrophobicContact CE2-CG 4.03Å; Y170-E174 WeakPolarHBondContact CE2-OE1 3.22Å; Y170-E174 WeakPolarHBondContact CE2-OE2 3.44Å; Y170-E174 VanDerWaalsContact CZ-OE2 3.28Å; Y170-E174 PolarHBondContact O-N 3.1Å; Y170-E174 PolarHBondContact OH-OE2 3.24Å
171	I	98.3	Very high	98.4	Very high	34 Å²	34	55.8 Å²	55.8	17%	0.174	27%	0.272	C	S	.	.	H	α-helix	trans	-66.8	-38.9	-177	69	-178.7	0	0	0	111.4	Y167 K168 F173 E174 Q175	Y167-I171 HydrophobicContact CD1-CD1 4.21Å; Y167-I171 HydrophobicContact CD1-CG2 4.45Å; Y167-I171 HydrophobicContact CD2-CG2 4.11Å; Y167-I171 HydrophobicContact CE1-CD1 3.85Å; Y167-I171 HydrophobicContact CE1-CG2 4Å; Y167-I171 HydrophobicContact CE2-CG2 3.61Å; Y167-I171 WeakPolarHBondContact O-CG1 3.04Å; Y167-I171 PolarHBondContact O-N 3.44Å; K168-I171 HydrophobicContact CD-CD1 4.14Å; I171-F173 VanDerWaalsContact C-N 3.35Å; I171-F173 PolarHBondContact O-N 2.83Å; I171-E174 PolarHBondContact O-N 3.16Å; I171-Q175 VanDerWaalsContact O-CB 3.27Å; I171-Q175 WeakPolarHBondContact O-CB 3.45Å; I171-Q175 VanDerWaalsContact O-CG 3.22Å; I171-Q175 WeakPolarHBondContact O-CG 3.21Å; I171-Q175 PolarHBondContact O-N 3.03Å
172	G	98.4	Very high	98.5	Very high	12 Å²	12	52.6 Å²	52.6	12%	0.124	26%	0.255	C	S	.	.	H	α-helix	trans	-63.4	-43.4	-179.6	0	0	0	0	0	111.2	K168 Y170 A176	K168-G172 WeakPolarHBondContact O-CA 3.09Å; K168-G172 PolarHBondContact O-N 3.25Å; Y170-G172 VanDerWaalsContact C-N 3.35Å; Y170-G172 PolarHBondContact O-N 2.64Å; G172-A176 WeakPolarHBondContact O-CB 3.1Å; G172-A176 PolarHBondContact O-N 3.47Å
173	F	98.8	Very high	98.5	Very high	1 Å²	1	50.8 Å²	50.8	0%	0.004	24%	0.241	C	C	.	.	H	α-helix	trans	-61.1	-53.2	175.8	179.7	-87.6	0	0	0	112	P96 W131 C132 W135 N138 S149 A169 Y170 I171 Q175 A176 A177	P96-F173 VanDerWaalsContact CD-CE2 3.47Å; P96-F173 HydrophobicContact CG-CD2 4.17Å; P96-F173 HydrophobicContact CG-CE2 3.85Å; P96-F173 HydrophobicContact CG-CZ 4.36Å; W131-F173 HydrophobicContact CB-CZ 4.23Å; W131-F173 HydrophobicContact CD2-CZ 4.35Å; W131-F173 HydrophobicContact CE3-CZ 4.16Å; W131-F173 HydrophobicContact CG-CZ 4.41Å; C132-F173 VanDerWaalsContact O-CE1 3.24Å; C132-F173 WeakPolarHBondContact O-CE1 3.48Å; C132-F173 WeakPolarHBondContact O-CZ 3.47Å; W135-F173 HydrophobicContact CE3-CB 3.98Å; W135-F173 HydrophobicContact CE3-CD1 4.18Å; W135-F173 HydrophobicContact CE3-CG 4.13Å; W135-F173 HydrophobicContact CZ3-CB 4.1Å; W135-F173 HydrophobicContact CZ3-CG 4.44Å; N138-F173 WeakPolarHBondContact ND2-CE1 3.44Å; S149-F173 WeakPolarHBondContact OG-CD2 3.49Å; A169-F173 VanDerWaalsContact O-CB 3.22Å; A169-F173 WeakPolarHBondContact O-CB 3.49Å; A169-F173 PolarHBondContact O-N 3.46Å; Y170-F173 PolarHBondContact O-N 2.82Å; I171-F173 VanDerWaalsContact C-N 3.35Å; I171-F173 PolarHBondContact O-N 2.83Å; F173-Q175 PolarHBondContact O-N 3.22Å; F173-A176 PolarHBondContact O-N 3.41Å; F173-A177 HydrophobicContact CE1-CB 4.42Å; F173-A177 WeakPolarHBondContact O-CB 3.5Å; F173-A177 PolarHBondContact O-N 3.42Å
174	E	98.8	Very high	98.6	Very high	38 Å²	38	43.3 Å²	43.3	18%	0.178	21%	0.206	C	C	.	.	H	α-helix	trans	-67.1	-39.2	-175.9	-67.6	-163.8	155.4	0	0	112.3	L134 W135 Y170 I171 R178	L134-E174 WeakPolarHBondContact CA-OE1 3.24Å; W135-E174 HydrophobicContact CB-CG 4.07Å; W135-E174 WeakPolarHBondContact CB-OE1 3.45Å; W135-E174 PolarHBondContact N-OE1 2.9Å; Y170-E174 HydrophobicContact CD2-CG 4.48Å; Y170-E174 HydrophobicContact CE2-CG 4.03Å; Y170-E174 WeakPolarHBondContact CE2-OE1 3.22Å; Y170-E174 WeakPolarHBondContact CE2-OE2 3.44Å; Y170-E174 VanDerWaalsContact CZ-OE2 3.28Å; Y170-E174 PolarHBondContact O-N 3.1Å; Y170-E174 PolarHBondContact OH-OE2 3.24Å; I171-E174 PolarHBondContact O-N 3.16Å; E174-R178 WeakPolarHBondContact O-CB 3.42Å; E174-R178 PolarHBondContact O-N 2.97Å
175	Q	98.7	Very high	98.6	Very high	132 Å²	132	38.9 Å²	38.9	62%	0.617	19%	0.185	S	C	*	.	H	α-helix	trans	-64.7	-46.7	176.7	-73.1	175.8	-11.7	0	0	111.7	I171 F173 R178 A179	I171-Q175 VanDerWaalsContact O-CB 3.27Å; I171-Q175 WeakPolarHBondContact O-CB 3.45Å; I171-Q175 VanDerWaalsContact O-CG 3.22Å; I171-Q175 WeakPolarHBondContact O-CG 3.21Å; I171-Q175 PolarHBondContact O-N 3.03Å; F173-Q175 PolarHBondContact O-N 3.22Å; Q175-R178 PolarHBondContact O-N 3.23Å; Q175-A179 WeakPolarHBondContact O-CB 3.47Å; Q175-A179 PolarHBondContact O-N 3.35Å
176	A	98.8	Very high	98.6	Very high	22 Å²	22	44.4 Å²	44.4	18%	0.182	21%	0.205	C	C	.	.	H	α-helix	trans	-70.6	-36	179.3	0	0	0	0	0	112.3	P96 Q97 G172 F173 A179 L180	P96-A176 HydrophobicContact CB-CB 3.76Å; Q97-A176 VanDerWaalsContact CA-CB 3.43Å; Q97-A176 HydrophobicContact CB-CB 3.71Å; G172-A176 WeakPolarHBondContact O-CB 3.1Å; G172-A176 PolarHBondContact O-N 3.47Å; F173-A176 PolarHBondContact O-N 3.41Å; A176-A179 PolarHBondContact O-N 3.06Å; A176-L180 WeakPolarHBondContact O-CB 3.36Å; A176-L180 PolarHBondContact O-N 3.21Å
177	A	98.8	Very high	98.7	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-62.2	-44.8	173.7	0	0	0	0	0	111.5	P96 W131 P133 F173 M181	P96-A177 HydrophobicContact CB-CB 4.28Å; P96-A177 HydrophobicContact CG-CB 4.09Å; W131-A177 HydrophobicContact CE3-CB 4.4Å; W131-A177 HydrophobicContact CH2-CB 4.06Å; W131-A177 HydrophobicContact CZ3-CB 3.67Å; P133-A177 HydrophobicContact CB-CB 4.08Å; F173-A177 HydrophobicContact CE1-CB 4.42Å; F173-A177 WeakPolarHBondContact O-CB 3.5Å; F173-A177 PolarHBondContact O-N 3.42Å; A177-M181 WeakPolarHBondContact O-CB 3.4Å; A177-M181 WeakPolarHBondContact O-CG 3.34Å; A177-M181 PolarHBondContact O-N 3.29Å
178	R	98.8	Very high	98.7	Very high	97 Å²	97	35.9 Å²	35.9	37%	0.366	17%	0.169	S	C	.	.	H	α-helix	trans	-60.2	-55.4	173.9	172.9	172.5	177.1	173.7	2.7	111.2	E174 Q175 L180 M181 E182 W233	E174-R178 WeakPolarHBondContact O-CB 3.42Å; E174-R178 PolarHBondContact O-N 2.97Å; Q175-R178 PolarHBondContact O-N 3.23Å; R178-L180 VanDerWaalsContact C-N 3.29Å; R178-L180 PolarHBondContact O-N 3.08Å; R178-M181 PolarHBondContact O-N 3.12Å; R178-E182 IonicContact CZ-OE2 3.86Å; R178-E182 IonicContact NE-OE2 3.56Å; R178-E182 PolarHBondContact NE-OE2 3.12Å; R178-E182 IonicContact NH2-OE1 3.54Å; R178-E182 IonicContact NH2-OE2 3.53Å; R178-E182 PolarHBondContact NH2-OE2 3.16Å; R178-E182 WeakPolarHBondContact O-CB 3.4Å; R178-E182 PolarHBondContact O-N 3.33Å; R178-W233 HydrophobicContact CB-CD2 4.35Å; R178-W233 HydrophobicContact CB-CH2 4.17Å; R178-W233 HydrophobicContact CB-CZ2 3.96Å; R178-W233 HydrophobicContact CB-CZ3 4.42Å; R178-W233 HydrophobicContact CG-CD2 3.65Å; R178-W233 HydrophobicContact CG-CE3 3.8Å; R178-W233 HydrophobicContact CG-CG 4.12Å; R178-W233 HydrophobicContact CG-CH2 4.34Å; R178-W233 HydrophobicContact CG-CZ2 4.19Å; R178-W233 HydrophobicContact CG-CZ3 4.15Å; R178-W233 VanDerWaalsContact CZ-CB 3.48Å
179	A	98.8	Very high	98.6	Very high	30 Å²	30	34.7 Å²	34.7	25%	0.248	16%	0.164	C	C	.	.	H	α-helix	trans	-56	-46.5	-178.4	0	0	0	0	0	111.3	L101 Q175 A176 D183	L101-A179 HydrophobicContact CD2-CB 3.95Å; Q175-A179 WeakPolarHBondContact O-CB 3.47Å; Q175-A179 PolarHBondContact O-N 3.35Å; A176-A179 PolarHBondContact O-N 3.06Å; A179-D183 WeakPolarHBondContact O-CB 3.32Å; A179-D183 PolarHBondContact O-N 3.34Å
180	L	98.9	Very high	98.6	Very high	3 Å²	3	38.7 Å²	38.7	2%	0.016	20%	0.197	C	C	.	.	H	α-helix	trans	-58.7	-51.3	177.3	179	59.4	0	0	0	112.5	Y81 P82 L99 L101 H104 W128 W131 A176 R178 T184	Y81-L180 HydrophobicContact CD2-CD2 4.46Å; P82-L180 HydrophobicContact CG-CD2 4.01Å; L99-L180 HydrophobicContact CD2-CD1 3.64Å; L99-L180 HydrophobicContact CD2-CD2 3.92Å; L99-L180 HydrophobicContact CD2-CG 4.39Å; L101-L180 HydrophobicContact CD1-CB 4.41Å; L101-L180 HydrophobicContact CD1-CD1 3.96Å; H104-L180 HydrophobicContact CB-CD1 4.36Å; W128-L180 HydrophobicContact CH2-CD1 4.41Å; W128-L180 HydrophobicContact CH2-CG 4.45Å; W128-L180 HydrophobicContact CZ3-CD1 4.45Å; W128-L180 HydrophobicContact CZ3-CD2 4.37Å; W128-L180 HydrophobicContact CZ3-CG 4.01Å; W131-L180 HydrophobicContact CH2-CD2 4.14Å; W131-L180 HydrophobicContact CZ2-CD2 3.86Å; A176-L180 WeakPolarHBondContact O-CB 3.36Å; A176-L180 PolarHBondContact O-N 3.21Å; R178-L180 VanDerWaalsContact C-N 3.29Å; R178-L180 PolarHBondContact O-N 3.08Å; L180-T184 VanDerWaalsContact O-CB 3.27Å; L180-T184 WeakPolarHBondContact O-CB 3.44Å; L180-T184 PolarHBondContact O-N 3.27Å; L180-T184 PolarHBondContact O-OG1 3.02Å
181	M	98.9	Very high	98.6	Very high	4 Å²	4	37.6 Å²	37.6	2%	0.02	20%	0.196	C	C	.	.	H	α-helix	trans	-72	-43.9	-176.8	-69.3	-179.5	72.8	0	0	112.5	W128 W131 P133 A177 R178 L185 F199 W233 L234	W128-M181 HydrophobicContact CE3-CG 4.46Å; W128-M181 HydrophobicContact CZ3-CG 4.44Å; W131-M181 HydrophobicContact CH2-CG 4.06Å; W131-M181 HydrophobicContact CH2-SD 4.09Å; W131-M181 HydrophobicContact CZ3-CG 4.36Å; W131-M181 HydrophobicContact CZ3-SD 3.79Å; P133-M181 HydrophobicContact CB-SD 3.7Å; P133-M181 HydrophobicContact CG-CE 4.42Å; P133-M181 HydrophobicContact CG-SD 3.81Å; A177-M181 WeakPolarHBondContact O-CB 3.4Å; A177-M181 WeakPolarHBondContact O-CG 3.34Å; A177-M181 PolarHBondContact O-N 3.29Å; R178-M181 PolarHBondContact O-N 3.12Å; M181-L185 WeakPolarHBondContact O-CG 3.49Å; M181-L185 PolarHBondContact O-N 2.85Å; M181-F199 HydrophobicContact CB-CE2 3.88Å; M181-F199 HydrophobicContact CB-CZ 3.74Å; M181-F199 HydrophobicContact CE-CD1 3.79Å; M181-F199 HydrophobicContact CE-CD2 3.67Å; M181-F199 HydrophobicContact CE-CE1 3.77Å; M181-F199 HydrophobicContact CE-CE2 3.6Å; M181-F199 HydrophobicContact CE-CG 3.74Å; M181-F199 HydrophobicContact CE-CZ 3.67Å; M181-F199 HydrophobicContact CG-CE1 4.3Å; M181-F199 HydrophobicContact CG-CE2 4.27Å; M181-F199 HydrophobicContact CG-CZ 3.78Å; M181-W233 HydrophobicContact CB-CH2 4.03Å; M181-W233 HydrophobicContact CB-CZ3 3.89Å; M181-W233 HydrophobicContact SD-CH2 4.18Å; M181-L234 HydrophobicContact CE-CD1 3.99Å; M181-L234 HydrophobicContact CE-CD2 4.24Å
182	E	98.8	Very high	98.6	Very high	12 Å²	12	36.4 Å²	36.4	6%	0.056	19%	0.19	C	C	.	.	H	α-helix	trans	-67.2	-48.4	-177.6	-176.4	163.6	-159.1	0	0	111.4	R178 T184 L185 R186 W233 A237	R178-E182 IonicContact CZ-OE2 3.86Å; R178-E182 IonicContact NE-OE2 3.56Å; R178-E182 PolarHBondContact NE-OE2 3.12Å; R178-E182 IonicContact NH2-OE1 3.54Å; R178-E182 IonicContact NH2-OE2 3.53Å; R178-E182 PolarHBondContact NH2-OE2 3.16Å; R178-E182 WeakPolarHBondContact O-CB 3.4Å; R178-E182 PolarHBondContact O-N 3.33Å; E182-T184 VanDerWaalsContact C-N 3.32Å; E182-T184 PolarHBondContact O-N 3.46Å; E182-L185 PolarHBondContact O-N 2.99Å; E182-R186 WeakPolarHBondContact O-CG 3.44Å; E182-R186 PolarHBondContact O-N 3.01Å; E182-R186 IonicContact OE1-CZ 3.23Å; E182-R186 VanDerWaalsContact OE1-CZ 3.23Å; E182-R186 IonicContact OE1-NE 3.7Å; E182-R186 IonicContact OE1-NH1 3.94Å; E182-R186 IonicContact OE1-NH2 2.64Å; E182-R186 PolarHBondContact OE1-NH2 3.36Å; E182-W233 HydrophobicContact CB-CE3 3.98Å; E182-W233 HydrophobicContact CB-CZ3 4.18Å; E182-A237 HydrophobicContact CG-CB 3.88Å
183	D	98.8	Very high	98.4	Very high	48 Å²	48	39.3 Å²	39.3	26%	0.257	21%	0.207	S	C	.	.	H	α-helix	trans	-71.5	-29.9	-177.6	-66.2	-17.7	0	0	0	111.9	L105 A179 R186 M187	L105-D183 HydrophobicContact CD1-CB 4.16Å; L105-D183 HydrophobicContact CD2-CB 4.13Å; A179-D183 WeakPolarHBondContact O-CB 3.32Å; A179-D183 PolarHBondContact O-N 3.34Å; D183-R186 PolarHBondContact O-N 3.34Å; D183-R186 IonicContact OD1-NH1 3.85Å; D183-M187 WeakPolarHBondContact O-CB 3.08Å; D183-M187 PolarHBondContact O-N 2.9Å
184	T	98.9	Very high	98.3	Very high	0 Å²	0	44 Å²	44	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-64.8	-43.3	173	-57.5	0	0	0	0	111.5	L78 H104 L126 W128 L180 E182 M187 G188	L78-T184 HydrophobicContact CD2-CG2 4.15Å; H104-T184 PolarHBondContact NE2-OG1 3.22Å; L126-T184 HydrophobicContact CD2-CG2 3.63Å; W128-T184 HydrophobicContact CH2-CG2 4.08Å; L180-T184 VanDerWaalsContact O-CB 3.27Å; L180-T184 WeakPolarHBondContact O-CB 3.44Å; L180-T184 PolarHBondContact O-N 3.27Å; L180-T184 PolarHBondContact O-OG1 3.02Å; E182-T184 VanDerWaalsContact C-N 3.32Å; E182-T184 PolarHBondContact O-N 3.46Å; T184-M187 HydrophobicContact CG2-CE 4.44Å; T184-G188 PolarHBondContact O-N 3.26Å
185	L	98.8	Very high	98.1	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-65	-44.4	176.3	-72.8	175.3	0	0	0	112	L126 M181 E182 G188 Q189 W197 F199 L234 A237	L126-L185 HydrophobicContact CD1-CD2 3.94Å; M181-L185 WeakPolarHBondContact O-CG 3.49Å; M181-L185 PolarHBondContact O-N 2.85Å; E182-L185 PolarHBondContact O-N 2.99Å; L185-G188 PolarHBondContact O-N 3.3Å; L185-Q189 PolarHBondContact O-N 3.43Å; L185-Q189 PolarHBondContact O-NE2 2.91Å; L185-Q189 VanDerWaalsContact O-NE2 3.16Å; L185-W197 HydrophobicContact CD2-CB 4Å; L185-F199 HydrophobicContact CD1-CD2 3.96Å; L185-F199 HydrophobicContact CD1-CE2 3.62Å; L185-F199 HydrophobicContact CD2-CD2 4.21Å; L185-F199 HydrophobicContact CD2-CE2 3.93Å; L185-F199 HydrophobicContact CG-CD2 4.27Å; L185-F199 HydrophobicContact CG-CE2 3.64Å; L185-F199 HydrophobicContact CG-CZ 4.46Å; L185-L234 HydrophobicContact CD1-CD1 3.85Å; L185-A237 HydrophobicContact CB-CB 4.43Å; L185-A237 WeakPolarHBondContact CB-O 3.45Å; L185-A237 HydrophobicContact CD1-CB 4.15Å
186	R	98.6	Very high	98.1	Very high	131 Å²	131	38.3 Å²	38.3	49%	0.494	20%	0.203	S	C	.	.	H	α-helix	trans	-63.5	-44.3	178.5	-72.8	173.6	176.5	177.6	-3.8	111.6	E182 D183 Q189 A190	E182-R186 WeakPolarHBondContact O-CG 3.44Å; E182-R186 PolarHBondContact O-N 3.01Å; E182-R186 IonicContact OE1-CZ 3.23Å; E182-R186 VanDerWaalsContact OE1-CZ 3.23Å; E182-R186 IonicContact OE1-NE 3.7Å; E182-R186 IonicContact OE1-NH1 3.94Å; E182-R186 IonicContact OE1-NH2 2.64Å; E182-R186 PolarHBondContact OE1-NH2 3.36Å; D183-R186 PolarHBondContact O-N 3.34Å; D183-R186 IonicContact OD1-NH1 3.85Å; R186-Q189 PolarHBondContact O-N 3.04Å; R186-A190 WeakPolarHBondContact O-CB 3.42Å; R186-A190 PolarHBondContact O-N 3.09Å
187	M	98.4	Very high	98.1	Very high	30 Å²	30	37.2 Å²	37.2	15%	0.148	19%	0.194	C	C	.	.	H	α-helix	trans	-62.1	-44.7	175	179.4	-156.3	64.3	0	0	111.2	L105 A108 A109 I112 D183 T184 Q189 A190 L191	L105-M187 HydrophobicContact CB-SD 4.07Å; L105-M187 HydrophobicContact CD2-CB 4.32Å; L105-M187 HydrophobicContact CD2-CE 4.46Å; L105-M187 HydrophobicContact CD2-SD 3.9Å; A108-M187 HydrophobicContact CB-CE 3.43Å; A108-M187 VanDerWaalsContact CB-CE 3.43Å; A108-M187 HydrophobicContact CB-SD 4.21Å; A109-M187 HydrophobicContact CB-SD 3.8Å; I112-M187 HydrophobicContact CD1-CE 3.7Å; D183-M187 WeakPolarHBondContact O-CB 3.08Å; D183-M187 PolarHBondContact O-N 2.9Å; T184-M187 HydrophobicContact CG2-CE 4.44Å; M187-Q189 VanDerWaalsContact C-N 3.34Å; M187-Q189 PolarHBondContact O-N 3.12Å; M187-A190 PolarHBondContact O-N 3.08Å; M187-L191 HydrophobicContact CG-CD1 4.13Å; M187-L191 WeakPolarHBondContact O-CG 3.45Å; M187-L191 PolarHBondContact O-N 3.01Å
188	G	98.2	Very high	98.1	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-57.2	-46.5	176.2	0	0	0	0	0	112.3	T184 L185 L191 R192 W197	T184-G188 PolarHBondContact O-N 3.26Å; L185-G188 PolarHBondContact O-N 3.3Å; G188-L191 PolarHBondContact O-N 3.36Å; G188-R192 PolarHBondContact O-N 3.43Å; G188-W197 VanDerWaalsContact C-NE1 3.35Å; G188-W197 WeakPolarHBondContact O-CZ2 3.45Å; G188-W197 PolarHBondContact O-NE1 3.09Å
189	Q	98.1	Very high	98.1	Very high	53 Å²	53	32.9 Å²	32.9	25%	0.248	18%	0.178	C	C	.	.	H	α-helix	trans	-66.8	-39.2	176.1	-77.2	168.1	78.1	0	0	112.9	L185 R186 M187 L191 R192 P193 W197 A237	L185-Q189 PolarHBondContact O-N 3.43Å; L185-Q189 PolarHBondContact O-NE2 2.91Å; L185-Q189 VanDerWaalsContact O-NE2 3.16Å; R186-Q189 PolarHBondContact O-N 3.04Å; M187-Q189 VanDerWaalsContact C-N 3.34Å; M187-Q189 PolarHBondContact O-N 3.12Å; Q189-L191 VanDerWaalsContact C-N 3.26Å; Q189-L191 PolarHBondContact O-N 3.42Å; Q189-R192 CarbonylContact O-C 3.49Å; Q189-R192 PolarHBondContact O-N 2.85Å; Q189-P193 WeakPolarHBondContact O-CA 3.41Å; Q189-W197 HydrophobicContact CG-CB 4.08Å; Q189-W197 VanDerWaalsContact CG-CD1 3.41Å; Q189-W197 HydrophobicContact CG-CG 3.91Å; Q189-A237 PolarHBondContact NE2-O 2.68Å
190	A	97.8	Very high	98.1	Very high	83 Å²	83	32.4 Å²	32.4	69%	0.686	17%	0.17	S	C	*	.	H	α-helix	trans	-61.4	-37.5	175.6	0	0	0	0	0	111.8	R186 M187	R186-A190 WeakPolarHBondContact O-CB 3.42Å; R186-A190 PolarHBondContact O-N 3.09Å; M187-A190 PolarHBondContact O-N 3.08Å
191	L	97.8	Very high	98	Very high	59 Å²	59	37 Å²	37	31%	0.309	19%	0.187	S	C	.	.	H	α-helix	trans	-79.8	-35.5	178.3	-66.7	173.7	0	0	0	112.7	A109 I112 M187 G188 Q189	A109-L191 HydrophobicContact CB-CD1 3.85Å; I112-L191 HydrophobicContact CB-CD1 4.17Å; I112-L191 HydrophobicContact CD1-CD1 4.26Å; I112-L191 HydrophobicContact CG2-CB 4.05Å; I112-L191 HydrophobicContact CG2-CD1 4Å; M187-L191 HydrophobicContact CG-CD1 4.13Å; M187-L191 WeakPolarHBondContact O-CG 3.45Å; M187-L191 PolarHBondContact O-N 3.01Å; G188-L191 PolarHBondContact O-N 3.36Å; Q189-L191 VanDerWaalsContact C-N 3.26Å; Q189-L191 PolarHBondContact O-N 3.42Å
192	R	97.9	Very high	97.9	Very high	10 Å²	10	38.2 Å²	38.2	4%	0.038	19%	0.192	C	C	.	.			trans	-133.1	77.7	-177.4	-58.4	-62.9	177.7	-94	2.4	109.1	I112 L116 R117 G188 Q189 H194 G195 W197	I112-R192 HydrophobicContact CG2-CG 3.95Å; I112-R192 PolarHBondContact O-NH2 2.75Å; L116-R192 HydrophobicContact CB-CG 4.3Å; L116-R192 HydrophobicContact CD1-CG 4.27Å; L116-R192 VanDerWaalsContact O-CZ 3.31Å; L116-R192 PolarHBondContact O-NE 3.27Å; L116-R192 VanDerWaalsContact O-NE 3.13Å; L116-R192 PolarHBondContact O-NH2 3.3Å; R117-R192 WeakPolarHBondContact O-CD 3.3Å; R117-R192 PolarHBondContact O-NE 3.09Å; G188-R192 PolarHBondContact O-N 3.43Å; Q189-R192 CarbonylContact O-C 3.49Å; Q189-R192 PolarHBondContact O-N 2.85Å; R192-H194 PolarHBondContact O-N 3.05Å; R192-G195 PolarHBondContact O-N 3.31Å; R192-W197 HydrophobicContact CB-CZ2 4.08Å; R192-W197 HydrophobicContact CG-CZ2 4.25Å; R192-W197 PolarHBondContact O-NE1 3.15Å
193	P	96.3	Very high	97.9	Very high	73 Å²	73	37.7 Å²	37.7	47%	0.474	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-22.2	-169.8	24.5	-34.9	0	0	0	114.2	Q189	Q189-P193 WeakPolarHBondContact O-CA 3.41Å
194	H	94.7	Very high	97.8	Very high	100 Å²	100	37.2 Å²	37.2	46%	0.463	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.6	-8	175.5	-58.5	-59.8	0	0	0	113.1	Q21 F120 A121 R192	Q21-H194 PolarHBondContact NE2-CE1 3.19Å; Q21-H194 PolarHBondContact NE2-NE2 3.33Å; F120-H194 CarbonylContact O-C 3.27Å; A121-H194 VanDerWaalsContact CA-O 3.3Å; A121-H194 WeakPolarHBondContact CA-O 3.41Å; A121-H194 HydrophobicContact CB-CB 3.88Å; R192-H194 PolarHBondContact O-N 3.05Å
195	G	96.3	Very high	97.7	Very high	1 Å²	1	37.2 Å²	37.2	1%	0.01	19%	0.192	C	C	.	.	S	Bend	trans	-68.9	143.5	178.8	0	0	0	0	0	112.2	F120 R192 W197 S239	F120-G195 PolarHBondContact O-N 2.81Å; R192-G195 PolarHBondContact O-N 3.31Å; G195-W197 VanDerWaalsContact O-CD1 3.24Å; G195-W197 PolarHBondContact O-N 3.37Å; G195-S239 PolarHBondContact O-OG 3.38Å
196	L	97.5	Very high	97.4	Very high	48 Å²	48	39.4 Å²	39.4	25%	0.251	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	89	175.9	-59.4	179.4	0	0	0	109.4	G122 P123 A124 S239 A240 F242 P280 L282	G122-L196 PolarHBondContact O-N 3.17Å; P123-L196 CarbonylContact C-O 3.2Å; P123-L196 WeakPolarHBondContact CA-O 3.33Å; P123-L196 HydrophobicContact CB-CB 4.16Å; A124-L196 PolarHBondContact N-O 3.21Å; L196-S239 WeakPolarHBondContact CA-OG 3.4Å; L196-A240 HydrophobicContact CB-CB 3.76Å; L196-F242 WeakPolarHBondContact O-CZ 3Å; L196-P280 HydrophobicContact CD2-CG 4.01Å; L196-L282 HydrophobicContact CD1-CD1 4.28Å
197	W	98.7	Very high	97.3	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	134.6	-174	-68.2	91.1	0	0	0	112.2	F73 I112 L116 A124 L126 L185 G188 Q189 R192 G195 S239 A240	F73-W197 HydrophobicContact CE2-CH2 4.3Å; F73-W197 HydrophobicContact CE2-CZ3 4.23Å; I112-W197 HydrophobicContact CD1-CH2 3.55Å; I112-W197 HydrophobicContact CD1-CZ2 4.29Å; I112-W197 HydrophobicContact CD1-CZ3 4.22Å; I112-W197 HydrophobicContact CG1-CH2 3.92Å; L116-W197 HydrophobicContact CD1-CH2 4.04Å; L116-W197 HydrophobicContact CD1-CZ2 4.04Å; A124-W197 HydrophobicContact CB-CD2 3.54Å; A124-W197 HydrophobicContact CB-CE3 3.53Å; A124-W197 HydrophobicContact CB-CG 4.18Å; A124-W197 HydrophobicContact CB-CH2 3.87Å; A124-W197 HydrophobicContact CB-CZ2 3.89Å; A124-W197 HydrophobicContact CB-CZ3 3.71Å; A124-W197 WeakPolarHBondContact O-CA 3.38Å; L126-W197 HydrophobicContact CD1-CE3 3.87Å; L126-W197 HydrophobicContact CD1-CZ3 4.22Å; L185-W197 HydrophobicContact CD2-CB 4Å; G188-W197 VanDerWaalsContact C-NE1 3.35Å; G188-W197 WeakPolarHBondContact O-CZ2 3.45Å; G188-W197 PolarHBondContact O-NE1 3.09Å; Q189-W197 HydrophobicContact CG-CB 4.08Å; Q189-W197 VanDerWaalsContact CG-CD1 3.41Å; Q189-W197 HydrophobicContact CG-CG 3.91Å; R192-W197 HydrophobicContact CB-CZ2 4.08Å; R192-W197 HydrophobicContact CG-CZ2 4.25Å; R192-W197 PolarHBondContact O-NE1 3.15Å; G195-W197 VanDerWaalsContact O-CD1 3.24Å; G195-W197 PolarHBondContact O-N 3.37Å; W197-S239 PolarHBondContact N-OG 2.96Å; W197-S239 PolarHBondContact O-N 3.23Å; W197-A240 PolarHBondContact O-N 3.26Å; W197-A240 VanDerWaalsContact O-N 3.12Å
198	G	98.7	Very high	96.8	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	179.1	172.4	176.1	0	0	0	0	0	112.3	A124 V125 L126	A124-G198 PolarHBondContact O-N 3.42Å; V125-G198 WeakPolarHBondContact CA-O 3.42Å; L126-G198 PolarHBondContact N-O 3.48Å
199	F	98.8	Very high	96.3	Very high	5 Å²	5	35.7 Å²	35.7	2%	0.022	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	135.9	179.9	-72.2	-89.9	0	0	0	111.8	L126 W128 M181 L185 Y202 L234	L126-F199 HydrophobicContact CB-CD1 3.49Å; L126-F199 VanDerWaalsContact CB-CD1 3.49Å; L126-F199 HydrophobicContact CB-CE1 3.5Å; L126-F199 VanDerWaalsContact CB-CE1 3.5Å; L126-F199 HydrophobicContact CB-CG 4.22Å; L126-F199 HydrophobicContact CB-CZ 4.26Å; L126-F199 HydrophobicContact CD2-CE1 3.73Å; L126-F199 HydrophobicContact CD2-CZ 3.83Å; L126-F199 HydrophobicContact CG-CE1 4.18Å; L126-F199 WeakPolarHBondContact O-CA 3.3Å; W128-F199 HydrophobicContact CB-CD1 4.28Å; W128-F199 HydrophobicContact CB-CE1 4.23Å; W128-F199 AromaticContact CD2-CE1 3.84Å; W128-F199 HydrophobicContact CD2-CE1 3.84Å; W128-F199 AromaticContact CE3-CE1 3.48Å; W128-F199 HydrophobicContact CE3-CE1 3.48Å; W128-F199 VanDerWaalsContact CE3-CE1 3.48Å; W128-F199 HydrophobicContact CE3-CZ 4.06Å; W128-F199 HydrophobicContact CG-CE1 4.19Å; W128-F199 HydrophobicContact CZ3-CE1 4.03Å; W128-F199 HydrophobicContact CZ3-CZ 4.18Å; M181-F199 HydrophobicContact CB-CE2 3.88Å; M181-F199 HydrophobicContact CB-CZ 3.74Å; M181-F199 HydrophobicContact CE-CD1 3.79Å; M181-F199 HydrophobicContact CE-CD2 3.67Å; M181-F199 HydrophobicContact CE-CE1 3.77Å; M181-F199 HydrophobicContact CE-CE2 3.6Å; M181-F199 HydrophobicContact CE-CG 3.74Å; M181-F199 HydrophobicContact CE-CZ 3.67Å; M181-F199 HydrophobicContact CG-CE1 4.3Å; M181-F199 HydrophobicContact CG-CE2 4.27Å; M181-F199 HydrophobicContact CG-CZ 3.78Å; L185-F199 HydrophobicContact CD1-CD2 3.96Å; L185-F199 HydrophobicContact CD1-CE2 3.62Å; L185-F199 HydrophobicContact CD2-CD2 4.21Å; L185-F199 HydrophobicContact CD2-CE2 3.93Å; L185-F199 HydrophobicContact CG-CD2 4.27Å; L185-F199 HydrophobicContact CG-CE2 3.64Å; L185-F199 HydrophobicContact CG-CZ 4.46Å; F199-Y202 HydrophobicContact CB-CD2 3.67Å; F199-Y202 HydrophobicContact CB-CE2 4.33Å; F199-Y202 HydrophobicContact CB-CG 4.38Å; F199-Y202 PolarHBondContact O-N 2.9Å; F199-L234 HydrophobicContact CD2-CD1 3.66Å; F199-L234 HydrophobicContact CE2-CD1 3.78Å
200	Y	98.7	Very high	95.5	Very high	20 Å²	20	39.6 Å²	39.6	8%	0.078	23%	0.227	C	C	.	.	B	Isolated β-bridge	trans	-57.6	141.5	171	169.2	-114	0	0	0	111	L126 D127 E129 Y202 Y246 Y284	L126-Y200 PolarHBondContact O-N 2.91Å; D127-Y200 HydrophobicContact CB-CD1 4.45Å; D127-Y200 WeakPolarHBondContact OD1-CD1 3.22Å; E129-Y200 HydrophobicContact CG-CD1 4.27Å; E129-Y200 HydrophobicContact CG-CE1 4.42Å; Y200-Y202 VanDerWaalsContact C-N 3.26Å; Y200-Y202 WeakPolarHBondContact O-CD2 3.47Å; Y200-Y202 PolarHBondContact O-N 2.79Å; Y200-Y246 WeakPolarHBondContact OH-CE2 3.34Å; Y200-Y284 AromaticContact CD2-CD1 3.94Å; Y200-Y284 HydrophobicContact CD2-CD1 3.94Å; Y200-Y284 AromaticContact CD2-CD2 3.86Å; Y200-Y284 HydrophobicContact CD2-CD2 3.86Å; Y200-Y284 HydrophobicContact CD2-CE1 4.19Å; Y200-Y284 HydrophobicContact CD2-CE2 4.12Å; Y200-Y284 AromaticContact CD2-CG 3.74Å; Y200-Y284 HydrophobicContact CD2-CG 3.74Å; Y200-Y284 AromaticContact CE2-CD1 3.78Å; Y200-Y284 HydrophobicContact CE2-CD1 3.78Å; Y200-Y284 HydrophobicContact CE2-CD2 4.3Å; Y200-Y284 HydrophobicContact CE2-CE1 4.39Å; Y200-Y284 AromaticContact CE2-CG 3.71Å; Y200-Y284 HydrophobicContact CE2-CG 3.71Å
201	R	96.6	Very high	94	Very high	99 Å²	99	40 Å²	40	37%	0.374	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	70.7	3.8	-178.1	-60.9	175.7	69.8	-158.3	-3.9	116.6	E129 P203 F242	E129-R201 WeakPolarHBondContact OE2-CD 3.18Å; E129-R201 IonicContact OE2-CZ 2.71Å; E129-R201 IonicContact OE2-NE 2.75Å; E129-R201 IonicContact OE2-NH1 2.65Å; E129-R201 PolarHBondContact OE2-NH1 3.35Å; R201-P203 CarbonylContact O-C 3.34Å; R201-P203 VanDerWaalsContact O-C 3.25Å; R201-P203 VanDerWaalsContact O-O 3.08Å; R201-F242 WeakPolarHBondContact CA-O 3.39Å; R201-F242 PolarHBondContact N-O 2.82Å
202	Y	98.3	Very high	92.4	Very high	30 Å²	30	45.6 Å²	45.6	12%	0.118	25%	0.252	C	S	.	.	P	Polyproline II helix	trans	-102.6	135.9	177.3	-74.3	-91.5	0	0	0	112	P133 F199 Y200 L231 L234 W235 F242	P133-Y202 WeakPolarHBondContact CD-OH 3.33Å; F199-Y202 HydrophobicContact CB-CD2 3.67Å; F199-Y202 HydrophobicContact CB-CE2 4.33Å; F199-Y202 HydrophobicContact CB-CG 4.38Å; F199-Y202 PolarHBondContact O-N 2.9Å; Y200-Y202 VanDerWaalsContact C-N 3.26Å; Y200-Y202 WeakPolarHBondContact O-CD2 3.47Å; Y200-Y202 PolarHBondContact O-N 2.79Å; Y202-L231 HydrophobicContact CD1-CD1 4.25Å; Y202-L231 HydrophobicContact CE1-CD1 3.93Å; Y202-L234 HydrophobicContact CD1-CD2 3.78Å; Y202-L234 HydrophobicContact CE1-CD2 4.2Å; Y202-L234 HydrophobicContact CG-CD2 4.09Å; Y202-W235 AromaticContact CD1-CH2 3.93Å; Y202-W235 HydrophobicContact CD1-CH2 3.93Å; Y202-W235 HydrophobicContact CD1-CZ3 4.37Å; Y202-F242 CarbonylContact O-C 3.56Å; Y202-F242 PolarHBondContact O-N 3.21Å
203	P	98.4	Very high	91.1	Very high	2 Å²	2	47 Å²	47	1%	0.013	27%	0.265	C	S	.	.	S	Bend	cis	-73.5	159.5	-6	32.8	-36.9	0	0	0	113.2	R201 W235 E266 A267 V270	R201-P203 CarbonylContact O-C 3.34Å; R201-P203 VanDerWaalsContact O-C 3.25Å; R201-P203 VanDerWaalsContact O-O 3.08Å; P203-W235 HydrophobicContact CB-CH2 3.74Å; P203-W235 HydrophobicContact CB-CZ2 4.17Å; P203-W235 HydrophobicContact CB-CZ3 4.36Å; P203-E266 HydrophobicContact CB-CG 4.14Å; P203-E266 HydrophobicContact CG-CG 4.04Å; P203-A267 VanDerWaalsContact CG-CA 3.49Å; P203-A267 HydrophobicContact CG-CB 4Å; P203-V270 HydrophobicContact CB-CG2 4.12Å; P203-V270 HydrophobicContact CG-CG2 3.72Å
204	A	96.1	Very high	89.8	Confident	37 Å²	37	49 Å²	49	31%	0.306	28%	0.28	S	S	.	.	P	Polyproline II helix	trans	-88.8	154.4	171.6	0	0	0	0	0	110.9	T224 N228	A204-T224 HydrophobicContact CB-CG2 3.98Å; A204-T224 VanDerWaalsContact O-CG2 3.23Å; A204-T224 WeakPolarHBondContact O-CG2 3.39Å; A204-N228 PolarHBondContact O-ND2 3.3Å
205	C	97.1	Very high	89.3	Confident	1 Å²	1	51 Å²	51	1%	0.007	30%	0.295	C	S	.	.			trans	-112.2	-26.4	175.6	-179.3	0	0	0	0	112.8	N207 C220 H221 R263	C205-N207 PolarHBondContact O-N 2.71Å; C205-N207 PolarHBondContact SG-ND2 3.21Å; C205-N207 VanDerWaalsContact SG-ND2 3.45Å; C205-C220 VanDerWaalsContact CA-SG 3.58Å; C205-C220 HydrophobicContact CB-CB 4.02Å; C205-C220 WeakPolarHBondContact CB-SG 3.02Å; C205-C220 CarbonylContact O-C 3.59Å; C205-C220 WeakPolarHBondContact O-CA 3.24Å; C205-C220 VanDerWaalsContact O-CB 3.23Å; C205-C220 WeakPolarHBondContact O-CB 3.14Å; C205-C220 WeakPolarHBondContact SG-CA 3Å; C205-C220 WeakPolarHBondContact SG-CB 3.03Å; C205-C220 CovalentContact SG-SG 2.03Å; C205-C220 PolarHBondContact SG-SG 3.11Å; C205-H221 PolarHBondContact O-N 3.21Å; C205-R263 HydrophobicContact CB-CB 4.35Å; C205-R263 HydrophobicContact CB-CG 3.58Å
206	G	93.4	Very high	89.1	Confident	45 Å²	45	52.2 Å²	52.2	46%	0.464	30%	0.299	S	S	.	.			trans	69.1	15.3	-177.6	0	0	0	0	0	114.4	G208	G206-G208 VanDerWaalsContact C-N 3.27Å; G206-G208 PolarHBondContact O-N 3.29Å
207	N	95.1	Very high	88.8	Confident	6 Å²	6	53.7 Å²	53.7	3%	0.032	31%	0.311	C	S	.	.			trans	-88.4	39.8	179.7	66.6	-22.4	0	0	0	113.3	C205 Y216 G218 H219 F259 R263	C205-N207 PolarHBondContact O-N 2.71Å; C205-N207 PolarHBondContact SG-ND2 3.21Å; C205-N207 VanDerWaalsContact SG-ND2 3.45Å; N207-Y216 PolarHBondContact O-OH 2.87Å; N207-G218 VanDerWaalsContact CB-O 3.23Å; N207-G218 WeakPolarHBondContact CB-O 3.03Å; N207-G218 PolarHBondContact ND2-O 3.18Å; N207-H219 WeakPolarHBondContact CB-O 3.33Å; N207-F259 WeakPolarHBondContact ND2-CD2 3.36Å; N207-F259 PolarHBondContact ND2-O 2.91Å; N207-F259 WeakPolarHBondContact O-CD2 3.49Å; N207-F259 WeakPolarHBondContact OD1-CE2 3.36Å; N207-R263 WeakPolarHBondContact OD1-CD 3.13Å; N207-R263 WeakPolarHBondContact OD1-CG 3.09Å; N207-R263 PolarHBondContact OD1-NH1 2.97Å
208	G	89.5	Confident	88.6	Confident	31 Å²	31	53.8 Å²	53.8	32%	0.32	31%	0.312	S	S	.	.			trans	-63.1	152.5	180	0	0	0	0	0	112.8	G206 H210	G206-G208 VanDerWaalsContact C-N 3.27Å; G206-G208 PolarHBondContact O-N 3.29Å; G208-H210 PolarHBondContact O-CD2 2.87Å
209	W	86.9	Confident	88.4	Confident	47 Å²	47	59.1 Å²	59.1	18%	0.178	34%	0.336	C	S	.	.			trans	-79.2	125.9	172	179.8	-117.6	0	0	0	110.8	A213 Y216 P248 R250 L251 P252	W209-A213 HydrophobicContact CZ3-CB 4.48Å; W209-Y216 HydrophobicContact CE3-CD1 4.09Å; W209-Y216 AromaticContact CE3-CD2 3.92Å; W209-Y216 HydrophobicContact CE3-CD2 3.92Å; W209-Y216 HydrophobicContact CE3-CE2 4.37Å; W209-Y216 AromaticContact CE3-CG 3.76Å; W209-Y216 HydrophobicContact CE3-CG 3.76Å; W209-Y216 HydrophobicContact CZ3-CD1 4.13Å; W209-Y216 HydrophobicContact CZ3-CD2 4.26Å; W209-Y216 AromaticContact CZ3-CG 3.72Å; W209-Y216 HydrophobicContact CZ3-CG 3.72Å; W209-P248 HydrophobicContact CB-CB 3.75Å; W209-P248 HydrophobicContact CB-CG 4.22Å; W209-R250 PolarHBondContact NE1-O 2.63Å; W209-L251 HydrophobicContact CB-CB 4.21Å; W209-L251 HydrophobicContact CB-CD1 3.88Å; W209-L251 HydrophobicContact CD2-CD1 3.79Å; W209-L251 HydrophobicContact CE3-CD1 3.56Å; W209-L251 HydrophobicContact CG-CB 4.24Å; W209-L251 HydrophobicContact CG-CD1 3.93Å; W209-L251 HydrophobicContact CZ3-CD1 4.36Å; W209-P252 HydrophobicContact CH2-CG 4.09Å; W209-P252 HydrophobicContact CZ2-CG 4.04Å
210	H	81.2	Confident	88.3	Confident	135 Å²	135	59.9 Å²	59.9	63%	0.625	34%	0.342	S	S	*	.			trans	-122.5	120.1	170	-58.6	-74.3	0	0	0	106.7	G208 M212 A213	G208-H210 PolarHBondContact O-CD2 2.87Å; H210-M212 PolarHBondContact O-N 3.42Å; H210-A213 PolarHBondContact O-N 3.35Å
211	S	67.2	Low	88.2	Confident	92 Å²	92	64.3 Å²	64.3	64%	0.643	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	5	-166	55.2	0	0	0	0	117
212	M	63.4	Low	88.1	Confident	176 Å²	176	63.1 Å²	63.1	87%	0.867	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.9	5.3	179.3	-65.6	-180	-79.8	0	0	112.7	H210 S214	H210-M212 PolarHBondContact O-N 3.42Å; M212-S214 PolarHBondContact O-N 2.72Å
213	A	69.8	Low	88	Confident	39 Å²	39	63.7 Å²	63.7	32%	0.322	39%	0.385	S	S	.	.			trans	-85.7	92	-178.2	0	0	0	0	0	111.5	W209 H210 N215	W209-A213 HydrophobicContact CZ3-CB 4.48Å; H210-A213 PolarHBondContact O-N 3.35Å; A213-N215 PolarHBondContact O-N 3.06Å
214	S	70.3	Confident	87.9	Confident	114 Å²	114	64 Å²	64	80%	0.797	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-22.2	172.6	51.1	0	0	0	0	113.5	M212	M212-S214 PolarHBondContact O-N 2.72Å
215	N	83.6	Confident	88	Confident	143 Å²	143	65 Å²	65	77%	0.765	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.1	43.1	-177.2	-68.8	-14.4	0	0	0	112.5	A213 T217	A213-N215 PolarHBondContact O-N 3.06Å; N215-T217 PolarHBondContact O-N 3.3Å
216	Y	91.4	Very high	88	Confident	26 Å²	26	67.3 Å²	67.3	10%	0.102	41%	0.406	C	S	.	.			trans	-71.4	113.2	179.4	-176.4	-98.5	0	0	0	111.7	N207 W209 L251 H255 F259	N207-Y216 PolarHBondContact O-OH 2.87Å; W209-Y216 HydrophobicContact CE3-CD1 4.09Å; W209-Y216 AromaticContact CE3-CD2 3.92Å; W209-Y216 HydrophobicContact CE3-CD2 3.92Å; W209-Y216 HydrophobicContact CE3-CE2 4.37Å; W209-Y216 AromaticContact CE3-CG 3.76Å; W209-Y216 HydrophobicContact CE3-CG 3.76Å; W209-Y216 HydrophobicContact CZ3-CD1 4.13Å; W209-Y216 HydrophobicContact CZ3-CD2 4.26Å; W209-Y216 AromaticContact CZ3-CG 3.72Å; W209-Y216 HydrophobicContact CZ3-CG 3.72Å; Y216-L251 HydrophobicContact CD1-CD1 4.15Å; Y216-L251 HydrophobicContact CE1-CD1 3.69Å; Y216-H255 HydrophobicContact CD1-CB 3.76Å; Y216-H255 AromaticContact CD1-CD2 3.9Å; Y216-H255 AromaticContact CD1-CG 3.66Å; Y216-H255 HydrophobicContact CE1-CB 3.84Å; Y216-H255 PolarHBondContact O-CE1 3.07Å; Y216-F259 VanDerWaalsContact OH-CD2 3.3Å; Y216-F259 WeakPolarHBondContact OH-CD2 3.46Å
217	T	91.8	Very high	88.2	Confident	80 Å²	80	67.5 Å²	67.5	49%	0.491	39%	0.393	S	S	.	.			trans	-101.5	-9.2	-178.8	64	0	0	0	0	113.5	N215 H219 H262	N215-T217 PolarHBondContact O-N 3.3Å; T217-H219 VanDerWaalsContact CB-ND1 3.32Å; T217-H219 WeakPolarHBondContact CB-ND1 3.37Å; T217-H219 PolarHBondContact O-N 2.92Å; T217-H219 PolarHBondContact OG1-N 2.04Å; T217-H219 PolarHBondContact OG1-ND1 3.37Å; T217-H262 PolarHBondContact O-CE1 2.78Å
218	G	94	Very high	88.3	Confident	2 Å²	2	67.4 Å²	67.4	2%	0.021	39%	0.392	C	S	.	.			trans	76.9	-5.8	-173.4	0	0	0	0	0	115.5	N207 H262	N207-G218 VanDerWaalsContact CB-O 3.23Å; N207-G218 WeakPolarHBondContact CB-O 3.03Å; N207-G218 PolarHBondContact ND2-O 3.18Å; G218-H262 VanDerWaalsContact C-ND1 3.28Å; G218-H262 VanDerWaalsContact O-CB 3.25Å; G218-H262 WeakPolarHBondContact O-CB 3.37Å; G218-H262 PolarHBondContact O-ND1 3.15Å
219	H	95.5	Very high	88.7	Confident	112 Å²	112	69.7 Å²	69.7	52%	0.519	40%	0.4	S	S	.	.	P	Polyproline II helix	trans	-59.8	146.3	-179.2	-74.9	80.9	0	0	0	112.5	N207 T217 H262	N207-H219 WeakPolarHBondContact CB-O 3.33Å; T217-H219 VanDerWaalsContact CB-ND1 3.32Å; T217-H219 WeakPolarHBondContact CB-ND1 3.37Å; T217-H219 PolarHBondContact O-N 2.92Å; T217-H219 PolarHBondContact OG1-N 2.04Å; T217-H219 PolarHBondContact OG1-ND1 3.37Å; H219-H262 AromaticContact CD2-CD2 3.75Å; H219-H262 AromaticContact CD2-NE2 3.34Å; H219-H262 PolarHBondContact CD2-NE2 3.41Å; H219-H262 VanDerWaalsContact CD2-NE2 3.34Å; H219-H262 AromaticContact CE1-CE1 3.9Å; H219-H262 AromaticContact CE1-NE2 3.47Å; H219-H262 PolarHBondContact CE1-NE2 2.93Å; H219-H262 AromaticContact CG-CD2 3.95Å; H219-H262 AromaticContact CG-CE1 3.98Å; H219-H262 AromaticContact CG-NE2 3.5Å; H219-H262 AromaticContact ND1-CE1 3.76Å; H219-H262 AromaticContact ND1-NE2 3.56Å; H219-H262 AromaticContact NE2-NE2 3.34Å; H219-H262 PolarHBondContact NE2-NE2 3.01Å
220	C	97	Very high	89.3	Confident	21 Å²	21	72.6 Å²	72.6	14%	0.142	42%	0.416	C	S	.	.	P	Polyproline II helix	trans	-64.6	141	172	-58	0	0	0	0	111.2	C205 A222 L225 H262	C205-C220 VanDerWaalsContact CA-SG 3.58Å; C205-C220 HydrophobicContact CB-CB 4.02Å; C205-C220 WeakPolarHBondContact CB-SG 3.02Å; C205-C220 CarbonylContact O-C 3.59Å; C205-C220 WeakPolarHBondContact O-CA 3.24Å; C205-C220 VanDerWaalsContact O-CB 3.23Å; C205-C220 WeakPolarHBondContact O-CB 3.14Å; C205-C220 WeakPolarHBondContact SG-CA 3Å; C205-C220 WeakPolarHBondContact SG-CB 3.03Å; C205-C220 CovalentContact SG-SG 2.03Å; C205-C220 PolarHBondContact SG-SG 3.11Å; C220-A222 PolarHBondContact O-N 2.98Å; C220-L225 HydrophobicContact CB-CD1 4.31Å; C220-L225 HydrophobicContact CB-CD2 3.58Å; C220-L225 HydrophobicContact CB-CG 3.93Å; C220-H262 PolarHBondContact SG-O 3.14Å
221	H	95.3	Very high	90.1	Very high	113 Å²	113	66.3 Å²	66.3	52%	0.523	39%	0.387	S	S	.	.	P	Polyproline II helix	trans	-68.1	131.9	176.9	-171.3	-83.6	0	0	0	109.9	C205 A223 T224 L225	C205-H221 PolarHBondContact O-N 3.21Å; H221-A223 VanDerWaalsContact C-N 3.29Å; H221-A223 WeakPolarHBondContact ND1-CB 3.43Å; H221-A223 PolarHBondContact ND1-N 3.05Å; H221-A223 PolarHBondContact O-N 3.32Å; H221-T224 WeakPolarHBondContact O-CA 3.42Å; H221-T224 VanDerWaalsContact O-CB 3.27Å; H221-T224 WeakPolarHBondContact O-CB 3.2Å; H221-T224 PolarHBondContact O-N 3.37Å; H221-L225 PolarHBondContact O-N 3.14Å; H221-L225 VanDerWaalsContact O-N 3.14Å
222	A	95.9	Very high	91.6	Very high	74 Å²	74	66.5 Å²	66.5	61%	0.612	38%	0.377	S	S	*	.	H	α-helix	trans	-54.6	-41.7	-175.1	0	0	0	0	0	113.2	C220 T224 L225 A226	C220-A222 PolarHBondContact O-N 2.98Å; A222-T224 PolarHBondContact O-N 3.23Å; A222-L225 WeakPolarHBondContact O-CB 3.46Å; A222-L225 PolarHBondContact O-N 3.32Å; A222-L225 VanDerWaalsContact O-N 3.16Å; A222-A226 PolarHBondContact O-N 3.5Å
223	A	94.9	Very high	93.2	Very high	41 Å²	41	58.8 Å²	58.8	34%	0.339	34%	0.339	S	S	.	.	H	α-helix	trans	-62.8	-27.7	175.2	0	0	0	0	0	113.4	H221 R227	H221-A223 VanDerWaalsContact C-N 3.29Å; H221-A223 WeakPolarHBondContact ND1-CB 3.43Å; H221-A223 PolarHBondContact ND1-N 3.05Å; H221-A223 PolarHBondContact O-N 3.32Å; A223-R227 WeakPolarHBondContact O-CG 3.49Å; A223-R227 PolarHBondContact O-N 2.8Å; A223-R227 VanDerWaalsContact O-N 3.16Å
224	T	96.5	Very high	94.6	Very high	9 Å²	9	57 Å²	57	6%	0.055	32%	0.324	C	S	.	.	H	α-helix	trans	-73.9	-42.8	173.9	-53.9	0	0	0	0	110.9	A204 H221 A222 A226 R227 N228	A204-T224 HydrophobicContact CB-CG2 3.98Å; A204-T224 VanDerWaalsContact O-CG2 3.23Å; A204-T224 WeakPolarHBondContact O-CG2 3.39Å; H221-T224 WeakPolarHBondContact O-CA 3.42Å; H221-T224 VanDerWaalsContact O-CB 3.27Å; H221-T224 WeakPolarHBondContact O-CB 3.2Å; H221-T224 PolarHBondContact O-N 3.37Å; A222-T224 PolarHBondContact O-N 3.23Å; T224-A226 VanDerWaalsContact C-N 3.32Å; T224-A226 PolarHBondContact O-N 2.97Å; T224-R227 PolarHBondContact O-N 2.51Å; T224-R227 PolarHBondContact OG1-NH2 2.96Å; T224-N228 PolarHBondContact O-N 3.19Å; T224-N228 PolarHBondContact O-ND2 3.49Å
225	L	97.7	Very high	95.9	Very high	57 Å²	57	51.7 Å²	51.7	30%	0.298	29%	0.286	S	S	.	.	H	α-helix	trans	-58.6	-44.4	174.3	-60.5	-179.2	0	0	0	111.4	C220 H221 A222 R227 N228 T229 E266	C220-L225 HydrophobicContact CB-CD1 4.31Å; C220-L225 HydrophobicContact CB-CD2 3.58Å; C220-L225 HydrophobicContact CB-CG 3.93Å; H221-L225 PolarHBondContact O-N 3.14Å; H221-L225 VanDerWaalsContact O-N 3.14Å; A222-L225 WeakPolarHBondContact O-CB 3.46Å; A222-L225 PolarHBondContact O-N 3.32Å; A222-L225 VanDerWaalsContact O-N 3.16Å; L225-R227 PolarHBondContact O-N 3.49Å; L225-N228 PolarHBondContact O-N 3.32Å; L225-T229 PolarHBondContact O-N 3.03Å; L225-T229 PolarHBondContact O-OG1 3.1Å; L225-E266 HydrophobicContact CD2-CB 4.49Å; L225-E266 HydrophobicContact CD2-CG 3.98Å; L225-E266 WeakPolarHBondContact CD2-OE1 3.19Å; L225-E266 WeakPolarHBondContact CD2-OE2 3.41Å
226	A	97.4	Very high	96.6	Very high	50 Å²	50	47 Å²	47	41%	0.413	27%	0.267	S	S	.	.	H	α-helix	trans	-60.8	-43.5	176.2	0	0	0	0	0	112.4	A222 T224 T229 Q230	A222-A226 PolarHBondContact O-N 3.5Å; T224-A226 VanDerWaalsContact C-N 3.32Å; T224-A226 PolarHBondContact O-N 2.97Å; A226-T229 WeakPolarHBondContact O-CB 3.42Å; A226-T229 PolarHBondContact O-N 3.42Å; A226-Q230 PolarHBondContact O-N 3.1Å; A226-Q230 VanDerWaalsContact O-N 3.11Å
227	R	97.1	Very high	97	Very high	50 Å²	50	46 Å²	46	19%	0.189	26%	0.264	C	S	.	.	H	α-helix	trans	-61.9	-42.9	173.4	-77.9	-174.3	-63.7	-98.9	0.9	112.1	L134 A223 T224 L225 T229 Q230 L231	L134-R227 HydrophobicContact CD1-CB 3.84Å; L134-R227 HydrophobicContact CD1-CG 3.89Å; A223-R227 WeakPolarHBondContact O-CG 3.49Å; A223-R227 PolarHBondContact O-N 2.8Å; A223-R227 VanDerWaalsContact O-N 3.16Å; T224-R227 PolarHBondContact O-N 2.51Å; T224-R227 PolarHBondContact OG1-NH2 2.96Å; L225-R227 PolarHBondContact O-N 3.49Å; R227-T229 VanDerWaalsContact C-N 3.27Å; R227-T229 PolarHBondContact O-N 3.15Å; R227-Q230 WeakPolarHBondContact O-CB 3.21Å; R227-Q230 PolarHBondContact O-N 3.11Å; R227-Q230 VanDerWaalsContact O-N 3.1Å; R227-L231 WeakPolarHBondContact O-CG 3.38Å; R227-L231 PolarHBondContact O-N 3.46Å; R227-L231 VanDerWaalsContact O-N 3.09Å
228	N	98.3	Very high	97.3	Very high	4 Å²	4	42.3 Å²	42.3	2%	0.021	24%	0.242	C	C	.	.	H	α-helix	trans	-63.1	-35.6	177.1	-68.1	-22.9	0	0	0	111.6	A204 T224 L225 Q230 L231 W235 E266 V270	A204-N228 PolarHBondContact O-ND2 3.3Å; T224-N228 PolarHBondContact O-N 3.19Å; T224-N228 PolarHBondContact O-ND2 3.49Å; L225-N228 PolarHBondContact O-N 3.32Å; N228-Q230 VanDerWaalsContact C-N 3.34Å; N228-L231 PolarHBondContact O-N 3.02Å; N228-W235 HydrophobicContact CB-CZ2 3.99Å; N228-W235 PolarHBondContact O-NE1 3.12Å; N228-E266 VanDerWaalsContact CB-OE1 3.24Å; N228-E266 WeakPolarHBondContact CB-OE1 3.49Å; N228-E266 WeakPolarHBondContact ND2-CG 3.4Å; N228-E266 PolarHBondContact ND2-OE1 2.81Å; N228-V270 HydrophobicContact CB-CG1 4.34Å
229	T	98.1	Very high	97.5	Very high	79 Å²	79	43.2 Å²	43.2	49%	0.485	25%	0.248	S	C	.	.	H	α-helix	trans	-63.7	-38.5	172.4	-61.5	0	0	0	0	112.2	L225 A226 R227 L231 H232 R269	L225-T229 PolarHBondContact O-N 3.03Å; L225-T229 PolarHBondContact O-OG1 3.1Å; A226-T229 WeakPolarHBondContact O-CB 3.42Å; A226-T229 PolarHBondContact O-N 3.42Å; R227-T229 VanDerWaalsContact C-N 3.27Å; R227-T229 PolarHBondContact O-N 3.15Å; T229-L231 PolarHBondContact O-N 2.91Å; T229-H232 PolarHBondContact O-N 2.96Å; T229-R269 PolarHBondContact OG1-NH1 3.28Å
230	Q	98.1	Very high	97.6	Very high	108 Å²	108	37.9 Å²	37.9	51%	0.505	22%	0.223	S	C	.	.	H	α-helix	trans	-65	-29.3	174.5	-67.1	176	27.9	0	0	112.8	L134 A226 R227 N228 H232	L134-Q230 HydrophobicContact CD1-CB 4.03Å; A226-Q230 PolarHBondContact O-N 3.1Å; A226-Q230 VanDerWaalsContact O-N 3.11Å; R227-Q230 WeakPolarHBondContact O-CB 3.21Å; R227-Q230 PolarHBondContact O-N 3.11Å; R227-Q230 VanDerWaalsContact O-N 3.1Å; N228-Q230 VanDerWaalsContact C-N 3.34Å; Q230-H232 PolarHBondContact O-N 2.76Å; Q230-H232 VanDerWaalsContact O-N 3.15Å; Q230-H232 PolarHBondContact O-ND1 3.36Å; Q230-H232 VanDerWaalsContact O-ND1 3.09Å
231	L	98.6	Very high	97.7	Very high	3 Å²	3	37 Å²	37	2%	0.016	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.7	21.2	176.2	-66.1	175.8	0	0	0	114.4	P133 L134 Y202 R227 N228 T229 W233 L234 W235	P133-L231 HydrophobicContact CB-CD2 4.38Å; P133-L231 HydrophobicContact CG-CD2 3.79Å; L134-L231 HydrophobicContact CD1-CD2 4.23Å; L134-L231 HydrophobicContact CD1-CG 4.1Å; L134-L231 HydrophobicContact CD2-CD2 4.05Å; L134-L231 HydrophobicContact CG-CD2 3.91Å; L134-L231 HydrophobicContact CG-CG 4.32Å; Y202-L231 HydrophobicContact CD1-CD1 4.25Å; Y202-L231 HydrophobicContact CE1-CD1 3.93Å; R227-L231 WeakPolarHBondContact O-CG 3.38Å; R227-L231 PolarHBondContact O-N 3.46Å; R227-L231 VanDerWaalsContact O-N 3.09Å; N228-L231 PolarHBondContact O-N 3.02Å; T229-L231 PolarHBondContact O-N 2.91Å; L231-W233 HydrophobicContact CD2-CH2 4.36Å; L231-W233 HydrophobicContact CD2-CZ2 3.49Å; L231-W233 VanDerWaalsContact CD2-CZ2 3.49Å; L231-W233 PolarHBondContact O-N 3.28Å; L231-L234 HydrophobicContact CB-CB 4.29Å; L231-L234 VanDerWaalsContact O-CB 3.3Å; L231-L234 WeakPolarHBondContact O-CB 3.46Å; L231-L234 PolarHBondContact O-N 3.17Å; L231-W235 HydrophobicContact CB-CH2 4.29Å; L231-W235 HydrophobicContact CB-CZ2 3.58Å; L231-W235 HydrophobicContact CD1-CH2 4.31Å; L231-W235 HydrophobicContact CD1-CZ2 4.17Å; L231-W235 PolarHBondContact O-N 3.49Å; L231-W235 PolarHBondContact O-NE1 3.4Å
232	H	98.2	Very high	97.9	Very high	96 Å²	96	31.7 Å²	31.7	44%	0.444	19%	0.192	S	C	.	.	H	α-helix	trans	-48.2	-36.6	177.4	68.7	-78.2	0	0	0	114	T229 Q230 L234 W235 A236 V273	T229-H232 PolarHBondContact O-N 2.96Å; Q230-H232 PolarHBondContact O-N 2.76Å; Q230-H232 VanDerWaalsContact O-N 3.15Å; Q230-H232 PolarHBondContact O-ND1 3.36Å; Q230-H232 VanDerWaalsContact O-ND1 3.09Å; H232-L234 VanDerWaalsContact C-N 3.3Å; H232-L234 PolarHBondContact O-N 3.23Å; H232-W235 PolarHBondContact O-N 3.14Å; H232-A236 WeakPolarHBondContact O-CB 3.38Å; H232-A236 PolarHBondContact O-N 3.23Å; H232-V273 HydrophobicContact CB-CG1 3.71Å
233	W	98.4	Very high	98	Very high	14 Å²	14	28.1 Å²	28.1	5%	0.053	16%	0.163	C	C	.	.	H	α-helix	trans	-63.1	-33.6	176.6	58.8	-97.5	0	0	0	113	P133 R178 M181 E182 L231 A237	P133-W233 HydrophobicContact CB-CH2 4.07Å; P133-W233 HydrophobicContact CB-CZ2 3.98Å; P133-W233 HydrophobicContact CG-CH2 4.46Å; P133-W233 HydrophobicContact CG-CZ2 4.41Å; R178-W233 HydrophobicContact CB-CD2 4.35Å; R178-W233 HydrophobicContact CB-CH2 4.17Å; R178-W233 HydrophobicContact CB-CZ2 3.96Å; R178-W233 HydrophobicContact CB-CZ3 4.42Å; R178-W233 HydrophobicContact CG-CD2 3.65Å; R178-W233 HydrophobicContact CG-CE3 3.8Å; R178-W233 HydrophobicContact CG-CG 4.12Å; R178-W233 HydrophobicContact CG-CH2 4.34Å; R178-W233 HydrophobicContact CG-CZ2 4.19Å; R178-W233 HydrophobicContact CG-CZ3 4.15Å; R178-W233 VanDerWaalsContact CZ-CB 3.48Å; M181-W233 HydrophobicContact CB-CH2 4.03Å; M181-W233 HydrophobicContact CB-CZ3 3.89Å; M181-W233 HydrophobicContact SD-CH2 4.18Å; E182-W233 HydrophobicContact CB-CE3 3.98Å; E182-W233 HydrophobicContact CB-CZ3 4.18Å; L231-W233 HydrophobicContact CD2-CH2 4.36Å; L231-W233 HydrophobicContact CD2-CZ2 3.49Å; L231-W233 VanDerWaalsContact CD2-CZ2 3.49Å; L231-W233 PolarHBondContact O-N 3.28Å; W233-A237 VanDerWaalsContact O-CB 3.24Å; W233-A237 WeakPolarHBondContact O-CB 3.17Å; W233-A237 PolarHBondContact O-N 3.34Å
234	L	98.8	Very high	98.2	Very high	1 Å²	1	26.6 Å²	26.6	1%	0.005	15%	0.15	C	C	.	.	H	α-helix	trans	-70.3	-41.3	179	-176	63.1	0	0	0	110.5	M181 L185 F199 Y202 L231 H232 A237 S238	M181-L234 HydrophobicContact CE-CD1 3.99Å; M181-L234 HydrophobicContact CE-CD2 4.24Å; L185-L234 HydrophobicContact CD1-CD1 3.85Å; F199-L234 HydrophobicContact CD2-CD1 3.66Å; F199-L234 HydrophobicContact CE2-CD1 3.78Å; Y202-L234 HydrophobicContact CD1-CD2 3.78Å; Y202-L234 HydrophobicContact CE1-CD2 4.2Å; Y202-L234 HydrophobicContact CG-CD2 4.09Å; L231-L234 HydrophobicContact CB-CB 4.29Å; L231-L234 VanDerWaalsContact O-CB 3.3Å; L231-L234 WeakPolarHBondContact O-CB 3.46Å; L231-L234 PolarHBondContact O-N 3.17Å; H232-L234 VanDerWaalsContact C-N 3.3Å; H232-L234 PolarHBondContact O-N 3.23Å; L234-A237 PolarHBondContact O-N 2.95Å; L234-S238 WeakPolarHBondContact O-CB 3.48Å; L234-S238 PolarHBondContact O-N 3.4Å; L234-S238 VanDerWaalsContact O-N 3.08Å; L234-S238 PolarHBondContact O-OG 2.89Å
235	W	98.4	Very high	98.3	Very high	2 Å²	2	26.2 Å²	26.2	1%	0.008	15%	0.148	C	C	.	.	H	α-helix	trans	-66.9	-46.4	177.8	-38.7	138.8	0	0	0	110.9	Y202 P203 N228 L231 H232 A237 S238 L241 V270 V273 H275	Y202-W235 AromaticContact CD1-CH2 3.93Å; Y202-W235 HydrophobicContact CD1-CH2 3.93Å; Y202-W235 HydrophobicContact CD1-CZ3 4.37Å; P203-W235 HydrophobicContact CB-CH2 3.74Å; P203-W235 HydrophobicContact CB-CZ2 4.17Å; P203-W235 HydrophobicContact CB-CZ3 4.36Å; N228-W235 HydrophobicContact CB-CZ2 3.99Å; N228-W235 PolarHBondContact O-NE1 3.12Å; L231-W235 HydrophobicContact CB-CH2 4.29Å; L231-W235 HydrophobicContact CB-CZ2 3.58Å; L231-W235 HydrophobicContact CD1-CH2 4.31Å; L231-W235 HydrophobicContact CD1-CZ2 4.17Å; L231-W235 PolarHBondContact O-N 3.49Å; L231-W235 PolarHBondContact O-NE1 3.4Å; H232-W235 PolarHBondContact O-N 3.14Å; W235-A237 PolarHBondContact O-N 2.83Å; W235-S238 PolarHBondContact O-N 2.86Å; W235-S238 VanDerWaalsContact O-N 3.09Å; W235-L241 HydrophobicContact CE3-CD2 3.92Å; W235-L241 HydrophobicContact CZ3-CD2 4.3Å; W235-V270 HydrophobicContact CD2-CB 4.11Å; W235-V270 HydrophobicContact CD2-CG2 4.03Å; W235-V270 HydrophobicContact CE3-CG2 4.3Å; W235-V270 HydrophobicContact CG-CB 4.02Å; W235-V270 HydrophobicContact CG-CG2 4.34Å; W235-V273 HydrophobicContact CB-CB 4.03Å; W235-V273 HydrophobicContact CB-CG1 4.36Å; W235-V273 HydrophobicContact CG-CB 4.39Å; W235-H275 PolarHBondContact O-NE2 3.47Å
236	A	98.3	Very high	98.3	Very high	45 Å²	45	24.8 Å²	24.8	37%	0.372	14%	0.138	S	C	.	.	H	α-helix	trans	-61	-34.4	177.7	0	0	0	0	0	112.3	H232 V273	H232-A236 WeakPolarHBondContact O-CB 3.38Å; H232-A236 PolarHBondContact O-N 3.23Å; A236-V273 PolarHBondContact N-O 2.75Å
237	A	98.4	Very high	98.2	Very high	5 Å²	5	23 Å²	23	4%	0.041	12%	0.122	C	C	.	.	H	α-helix	trans	-84.5	-9.1	177.4	0	0	0	0	0	114.3	E182 L185 Q189 W233 L234 W235	E182-A237 HydrophobicContact CG-CB 3.88Å; L185-A237 HydrophobicContact CB-CB 4.43Å; L185-A237 WeakPolarHBondContact CB-O 3.45Å; L185-A237 HydrophobicContact CD1-CB 4.15Å; Q189-A237 PolarHBondContact NE2-O 2.68Å; W233-A237 VanDerWaalsContact O-CB 3.24Å; W233-A237 WeakPolarHBondContact O-CB 3.17Å; W233-A237 PolarHBondContact O-N 3.34Å; L234-A237 PolarHBondContact O-N 2.95Å; W235-A237 PolarHBondContact O-N 2.83Å
238	S	98.7	Very high	98	Very high	2 Å²	2	21.6 Å²	21.6	1%	0.014	12%	0.119	C	C	.	.			trans	-89.5	153.4	179.5	-61.6	0	0	0	0	111.4	L234 W235 H275 L279	L234-S238 WeakPolarHBondContact O-CB 3.48Å; L234-S238 PolarHBondContact O-N 3.4Å; L234-S238 VanDerWaalsContact O-N 3.08Å; L234-S238 PolarHBondContact O-OG 2.89Å; W235-S238 PolarHBondContact O-N 2.86Å; W235-S238 VanDerWaalsContact O-N 3.09Å; S238-H275 PolarHBondContact O-CE1 2.73Å; S238-H275 PolarHBondContact O-NE2 3.08Å; S238-L279 WeakPolarHBondContact O-CD2 3.25Å
239	S	97.8	Very high	97.6	Very high	21 Å²	21	23.3 Å²	23.3	15%	0.147	13%	0.13	C	C	.	.	S	Bend	trans	-110.4	-2.8	167.5	65.8	0	0	0	0	113.4	G195 L196 W197 P280	G195-S239 PolarHBondContact O-OG 3.38Å; L196-S239 WeakPolarHBondContact CA-OG 3.4Å; W197-S239 PolarHBondContact N-OG 2.96Å; W197-S239 PolarHBondContact O-N 3.23Å; S239-P280 VanDerWaalsContact O-CD 3.32Å; S239-P280 WeakPolarHBondContact O-CD 3.39Å; S239-P280 WeakPolarHBondContact O-CG 3.43Å
240	A	98.3	Very high	97.2	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	14%	0.142	C	C	.	.	S	Bend	trans	-157	161.7	167.8	0	0	0	0	0	112	L196 W197 F242 P280 L282	L196-A240 HydrophobicContact CB-CB 3.76Å; W197-A240 PolarHBondContact O-N 3.26Å; W197-A240 VanDerWaalsContact O-N 3.12Å; A240-F242 HydrophobicContact CB-CE1 4.32Å; A240-F242 HydrophobicContact CB-CE2 3.76Å; A240-F242 HydrophobicContact CB-CZ 3.53Å; A240-P280 WeakPolarHBondContact CA-O 3.24Å; A240-P280 HydrophobicContact CB-CG 3.94Å; A240-L282 HydrophobicContact CB-CD1 4.13Å
241	L	98.9	Very high	96.9	Very high	4 Å²	4	23.9 Å²	23.9	2%	0.021	12%	0.12	C	C	.	.	B	Isolated β-bridge	trans	-114.1	138.2	176.4	-60.2	178.2	0	0	0	111.4	W235 P243 A267 V270 A271 L279 P280 V281 L282	W235-L241 HydrophobicContact CE3-CD2 3.92Å; W235-L241 HydrophobicContact CZ3-CD2 4.3Å; L241-P243 VanDerWaalsContact C-CD 3.44Å; L241-P243 WeakPolarHBondContact O-CD 3.44Å; L241-A267 HydrophobicContact CD1-CB 4.4Å; L241-A267 WeakPolarHBondContact CD1-O 3.5Å; L241-V270 HydrophobicContact CD1-CG2 3.73Å; L241-A271 HydrophobicContact CD1-CB 3.86Å; L241-L279 HydrophobicContact CD2-CD1 4.12Å; L241-L279 HydrophobicContact CG-CB 4.31Å; L241-L279 HydrophobicContact CG-CD1 4.13Å; L241-P280 PolarHBondContact N-O 3.43Å; L241-V281 HydrophobicContact CB-CG2 4.37Å; L241-V281 HydrophobicContact CD1-CG2 4.38Å; L241-L282 PolarHBondContact O-N 2.86Å
242	F	98.8	Very high	96.6	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	13%	0.133	C	C	.	.	B	Isolated β-bridge	trans	-126.3	61.2	-173.5	-57.6	-75.4	0	0	0	112.5	P123 V125 L196 R201 Y202 A240 S244 L282 Y284	P123-F242 HydrophobicContact CB-CE1 3.61Å; P123-F242 HydrophobicContact CB-CZ 3.63Å; P123-F242 HydrophobicContact CG-CE1 4.46Å; V125-F242 HydrophobicContact CG1-CD2 4.44Å; V125-F242 HydrophobicContact CG1-CG 4.41Å; V125-F242 HydrophobicContact CG2-CD1 3.7Å; V125-F242 HydrophobicContact CG2-CD2 3.83Å; V125-F242 HydrophobicContact CG2-CE1 3.58Å; V125-F242 HydrophobicContact CG2-CE2 3.73Å; V125-F242 HydrophobicContact CG2-CG 3.82Å; V125-F242 HydrophobicContact CG2-CZ 3.61Å; L196-F242 WeakPolarHBondContact O-CZ 3Å; R201-F242 WeakPolarHBondContact CA-O 3.39Å; R201-F242 PolarHBondContact N-O 2.82Å; Y202-F242 CarbonylContact O-C 3.56Å; Y202-F242 PolarHBondContact O-N 3.21Å; A240-F242 HydrophobicContact CB-CE1 4.32Å; A240-F242 HydrophobicContact CB-CE2 3.76Å; A240-F242 HydrophobicContact CB-CZ 3.53Å; F242-S244 PolarHBondContact O-N 2.9Å; F242-L282 WeakPolarHBondContact CA-O 3.44Å; F242-L282 HydrophobicContact CD1-CB 3.91Å; F242-L282 HydrophobicContact CE1-CB 3.87Å; F242-L282 HydrophobicContact CE1-CD1 3.94Å; F242-L282 HydrophobicContact CE1-CG 4.38Å; F242-L282 HydrophobicContact CZ-CD1 4.48Å; F242-Y284 HydrophobicContact CB-CD2 4.03Å; F242-Y284 HydrophobicContact CB-CE2 4.02Å; F242-Y284 HydrophobicContact CD1-CD2 4.42Å; F242-Y284 AromaticContact CD1-CE2 3.97Å; F242-Y284 HydrophobicContact CD1-CE2 3.97Å; F242-Y284 HydrophobicContact CG-CE2 4.27Å
243	P	98.7	Very high	96.4	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	14%	0.138	C	C	.	.			trans	-64.3	132.3	177.2	30.1	-35.7	0	0	0	109.9	L241 L264 A267 V281 A283 Y284	L241-P243 VanDerWaalsContact C-CD 3.44Å; L241-P243 WeakPolarHBondContact O-CD 3.44Å; P243-L264 HydrophobicContact CG-CD2 4.22Å; P243-A267 HydrophobicContact CB-CB 4.41Å; P243-A267 HydrophobicContact CG-CB 3.9Å; P243-V281 HydrophobicContact CG-CG1 3.87Å; P243-A283 HydrophobicContact CG-CB 4.44Å; P243-A283 WeakPolarHBondContact O-CA 3.18Å; P243-Y284 PolarHBondContact O-N 2.76Å
244	S	98.4	Very high	96.2	Very high	9 Å²	9	28.8 Å²	28.8	6%	0.063	17%	0.169	C	C	.	.	B	Isolated β-bridge	trans	-77.7	130.7	167.7	170.5	0	0	0	0	108.8	F242 Y246 R263	F242-S244 PolarHBondContact O-N 2.9Å; S244-Y246 WeakPolarHBondContact OG-CD1 3.23Å; S244-Y246 VanDerWaalsContact OG-CG 3.3Å; S244-R263 PolarHBondContact O-NE 3.1Å; S244-R263 PolarHBondContact O-NH2 3.11Å
245	I	98.3	Very high	96	Very high	1 Å²	1	31.3 Å²	31.3	1%	0.005	18%	0.181	C	C	.	.			trans	-118.1	29	175.4	58.3	166.7	0	0	0	111.3	L247 V260 R263 L264 A283 Y284 V285 S308	I245-L247 PolarHBondContact O-N 2.78Å; I245-V260 HydrophobicContact CB-CG1 4.2Å; I245-V260 HydrophobicContact CB-CG2 4.25Å; I245-V260 HydrophobicContact CD1-CG1 3.65Å; I245-V260 HydrophobicContact CG2-CG1 4.23Å; I245-R263 HydrophobicContact CG2-CB 3.98Å; I245-L264 HydrophobicContact CG2-CD2 4.38Å; I245-L264 HydrophobicContact CG2-CG 4.45Å; I245-A283 HydrophobicContact CD1-CB 3.71Å; I245-A283 HydrophobicContact CG1-CB 3.97Å; I245-A283 HydrophobicContact CG2-CB 4.38Å; I245-Y284 VanDerWaalsContact CG1-O 3.23Å; I245-Y284 WeakPolarHBondContact CG1-O 3.44Å; I245-Y284 PolarHBondContact N-O 2.67Å; I245-V285 HydrophobicContact CD1-CG2 3.59Å; I245-V285 HydrophobicContact CG1-CG2 3.78Å; I245-S308 WeakPolarHBondContact CD1-OG 3.33Å
246	Y	97.6	Very high	95.9	Very high	27 Å²	27	31.4 Å²	31.4	11%	0.106	18%	0.181	C	C	.	.	P	Polyproline II helix	trans	-60.7	124.4	178.6	-62.1	-3.5	0	0	0	110.2	Y200 S244 P248 F259 Y284 V285 R286 W319	Y200-Y246 WeakPolarHBondContact OH-CE2 3.34Å; S244-Y246 WeakPolarHBondContact OG-CD1 3.23Å; S244-Y246 VanDerWaalsContact OG-CG 3.3Å; Y246-P248 WeakPolarHBondContact O-CD 3.42Å; Y246-F259 WeakPolarHBondContact O-CE1 3.48Å; Y246-F259 WeakPolarHBondContact O-CZ 3.46Å; Y246-Y284 VanDerWaalsContact CD1-O 3.26Å; Y246-Y284 WeakPolarHBondContact CD1-O 3.34Å; Y246-Y284 VanDerWaalsContact CE1-C 3.46Å; Y246-Y284 VanDerWaalsContact CE1-O 3.27Å; Y246-Y284 WeakPolarHBondContact CE1-O 3.42Å; Y246-Y284 WeakPolarHBondContact OH-CD1 3.06Å; Y246-V285 VanDerWaalsContact CE1-C 3.42Å; Y246-R286 HydrophobicContact CD1-CB 3.57Å; Y246-R286 HydrophobicContact CD2-CB 4.04Å; Y246-R286 HydrophobicContact CE1-CB 3.75Å; Y246-R286 HydrophobicContact CE2-CB 4.2Å; Y246-R286 HydrophobicContact CG-CB 3.73Å; Y246-W319 HydrophobicContact CE2-CE3 4.09Å; Y246-W319 HydrophobicContact CE2-CZ3 4.5Å; Y246-W319 AromaticContact CZ-CE3 3.98Å; Y246-W319 VanDerWaalsContact OH-CB 3.24Å; Y246-W319 WeakPolarHBondContact OH-CB 3.24Å; Y246-W319 VanDerWaalsContact OH-CG 3.23Å
247	L	96.4	Very high	95.8	Very high	11 Å²	11	30.3 Å²	30.3	6%	0.058	17%	0.169	C	C	.	.	P	Polyproline II helix	trans	-60.3	124.7	180	-63.6	176.4	0	0	0	110.2	I245 H256 F259 V260 L296 D300 T304	I245-L247 PolarHBondContact O-N 2.78Å; L247-H256 WeakPolarHBondContact CD1-ND1 3.27Å; L247-H256 HydrophobicContact CD2-CB 3.81Å; L247-F259 HydrophobicContact CD2-CD1 4.14Å; L247-V260 HydrophobicContact CD2-CG2 4.21Å; L247-L296 HydrophobicContact CD1-CD2 4.09Å; L247-D300 HydrophobicContact CD1-CB 4.17Å; L247-T304 HydrophobicContact CD1-CG2 4.02Å; L247-T304 HydrophobicContact CD2-CG2 3.96Å; L247-T304 HydrophobicContact CG-CG2 3.91Å
248	P	93.3	Very high	95.6	Very high	21 Å²	21	30.7 Å²	30.7	14%	0.136	17%	0.172	C	C	.	.	P	Polyproline II helix	trans	-61.9	144.2	176.5	-22.4	32.9	0	0	0	111.2	W209 Y246 R250 L251 F259	W209-P248 HydrophobicContact CB-CB 3.75Å; W209-P248 HydrophobicContact CB-CG 4.22Å; Y246-P248 WeakPolarHBondContact O-CD 3.42Å; P248-R250 PolarHBondContact O-N 2.86Å; P248-L251 HydrophobicContact CB-CB 4.24Å; P248-L251 HydrophobicContact CG-CB 4.48Å; P248-L251 HydrophobicContact CG-CD2 4.32Å; P248-L251 WeakPolarHBondContact O-CB 3.26Å; P248-L251 PolarHBondContact O-N 2.84Å; P248-L251 VanDerWaalsContact O-N 3.16Å; P248-F259 HydrophobicContact CG-CD2 4.11Å; P248-F259 HydrophobicContact CG-CE1 4.29Å; P248-F259 HydrophobicContact CG-CE2 3.65Å; P248-F259 HydrophobicContact CG-CZ 3.75Å
249	P	89.8	Confident	95.6	Very high	40 Å²	40	30.8 Å²	30.8	26%	0.26	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.6	134.2	174.1	-23.5	32.9	0	0	0	111.5	L251 R290 R291	P249-L251 PolarHBondContact O-N 3.42Å; P249-R290 HydrophobicContact CG-CB 4.38Å; P249-R291 HydrophobicContact CB-CB 4.41Å; P249-R291 HydrophobicContact CB-CG 3.85Å; P249-R291 HydrophobicContact CG-CG 3.93Å
250	R	88.8	Confident	95.6	Very high	191 Å²	191	29.8 Å²	29.8	72%	0.721	17%	0.165	S	C	*	.	T	Hydrogen-bonded Turn	trans	63.8	14	179	-50.5	176.1	175	171.4	-4.7	114.9	W209 P248 P252	W209-R250 PolarHBondContact NE1-O 2.63Å; P248-R250 PolarHBondContact O-N 2.86Å; R250-P252 WeakPolarHBondContact O-CD 3.42Å
251	L	92.4	Very high	95.5	Very high	8 Å²	8	31.5 Å²	31.5	4%	0.042	17%	0.171	C	C	.	.			trans	-65	123.4	167.7	-179.5	69.1	0	0	0	108.3	W209 Y216 P248 P249 H255 H256 F259	W209-L251 HydrophobicContact CB-CB 4.21Å; W209-L251 HydrophobicContact CB-CD1 3.88Å; W209-L251 HydrophobicContact CD2-CD1 3.79Å; W209-L251 HydrophobicContact CE3-CD1 3.56Å; W209-L251 HydrophobicContact CG-CB 4.24Å; W209-L251 HydrophobicContact CG-CD1 3.93Å; W209-L251 HydrophobicContact CZ3-CD1 4.36Å; Y216-L251 HydrophobicContact CD1-CD1 4.15Å; Y216-L251 HydrophobicContact CE1-CD1 3.69Å; P248-L251 HydrophobicContact CB-CB 4.24Å; P248-L251 HydrophobicContact CG-CB 4.48Å; P248-L251 HydrophobicContact CG-CD2 4.32Å; P248-L251 WeakPolarHBondContact O-CB 3.26Å; P248-L251 PolarHBondContact O-N 2.84Å; P248-L251 VanDerWaalsContact O-N 3.16Å; P249-L251 PolarHBondContact O-N 3.42Å; L251-H255 HydrophobicContact CD1-CB 3.69Å; L251-H255 HydrophobicContact CG-CB 4.13Å; L251-H256 PolarHBondContact O-NE2 2.94Å; L251-F259 HydrophobicContact CD2-CB 3.75Å; L251-F259 HydrophobicContact CD2-CD1 4.38Å; L251-F259 HydrophobicContact CD2-CG 4.01Å
252	P	92.6	Very high	95.5	Very high	46 Å²	46	31.7 Å²	31.7	30%	0.299	17%	0.172	S	C	.	.			trans	-59	140.4	176.7	-25.6	35.3	0	0	0	111.9	W209 R250 A254 H255 H256	W209-P252 HydrophobicContact CH2-CG 4.09Å; W209-P252 HydrophobicContact CZ2-CG 4.04Å; R250-P252 WeakPolarHBondContact O-CD 3.42Å; P252-A254 PolarHBondContact O-N 2.88Å; P252-A254 VanDerWaalsContact O-N 3.11Å; P252-H255 PolarHBondContact O-N 2.87Å; P252-H256 PolarHBondContact O-CD2 2.83Å
253	P	93.6	Very high	95.5	Very high	83 Å²	83	32.9 Å²	32.9	54%	0.539	18%	0.177	S	C	.	.	G	3₁₀ helix	trans	-51.4	-34.7	178.5	-30.3	36.8	0	0	0	114.5	H255 H256 Q303	P253-H255 PolarHBondContact O-N 3.37Å; P253-H256 PolarHBondContact O-N 3.16Å; P253-Q303 PolarHBondContact O-NE2 3.41Å; P253-Q303 PolarHBondContact O-OE1 3.38Å
254	A	93.1	Very high	95.4	Very high	87 Å²	87	32.9 Å²	32.9	72%	0.719	18%	0.177	S	C	*	.	G	3₁₀ helix	trans	-59.7	-15.4	176.4	0	0	0	0	0	114.5	P252	P252-A254 PolarHBondContact O-N 2.88Å; P252-A254 VanDerWaalsContact O-N 3.11Å
255	H	94.6	Very high	95.4	Very high	54 Å²	54	34.9 Å²	34.9	25%	0.25	19%	0.185	C	C	.	.	G	3₁₀ helix	trans	-112	-3.6	-178.1	-65	-44.5	0	0	0	113.8	Y216 L251 P252 P253 A258 F259	Y216-H255 HydrophobicContact CD1-CB 3.76Å; Y216-H255 AromaticContact CD1-CD2 3.9Å; Y216-H255 AromaticContact CD1-CG 3.66Å; Y216-H255 HydrophobicContact CE1-CB 3.84Å; Y216-H255 PolarHBondContact O-CE1 3.07Å; L251-H255 HydrophobicContact CD1-CB 3.69Å; L251-H255 HydrophobicContact CG-CB 4.13Å; P252-H255 PolarHBondContact O-N 2.87Å; P253-H255 PolarHBondContact O-N 3.37Å; H255-A258 PolarHBondContact O-N 2.89Å; H255-F259 WeakPolarHBondContact O-CB 3.23Å; H255-F259 PolarHBondContact O-N 3.46Å
256	H	96.3	Very high	95.4	Very high	4 Å²	4	35.2 Å²	35.2	2%	0.019	19%	0.186	C	C	.	.	H	α-helix	trans	-62	-49	-177.2	-68.1	-177.1	0	0	0	111	L247 L251 P252 P253 A258 F259 V260 D300 Q303	L247-H256 WeakPolarHBondContact CD1-ND1 3.27Å; L247-H256 HydrophobicContact CD2-CB 3.81Å; L251-H256 PolarHBondContact O-NE2 2.94Å; P252-H256 PolarHBondContact O-CD2 2.83Å; P253-H256 PolarHBondContact O-N 3.16Å; H256-A258 PolarHBondContact O-N 3.22Å; H256-F259 WeakPolarHBondContact O-CB 3.33Å; H256-F259 PolarHBondContact O-N 3.06Å; H256-V260 WeakPolarHBondContact O-CG2 3.4Å; H256-V260 PolarHBondContact O-N 2.84Å; H256-D300 IonicContact CE1-OD1 3.19Å; H256-D300 PolarHBondContact CE1-OD1 2.9Å; H256-D300 IonicContact ND1-OD1 2.74Å; H256-D300 PolarHBondContact ND1-OD1 3.03Å; H256-Q303 HydrophobicContact CB-CB 3.78Å; H256-Q303 HydrophobicContact CB-CG 4.41Å
257	Q	96.2	Very high	95.4	Very high	23 Å²	23	33.9 Å²	33.9	11%	0.107	18%	0.181	C	C	.	.	H	α-helix	trans	-58.8	-45.9	178	179.1	171.5	25.4	0	0	112.3	F259 V260 R261 Q303 V307 M375	Q257-F259 VanDerWaalsContact C-N 3.33Å; Q257-F259 PolarHBondContact O-N 3.1Å; Q257-V260 PolarHBondContact O-N 3.17Å; Q257-R261 WeakPolarHBondContact O-CB 3.37Å; Q257-R261 PolarHBondContact O-N 2.7Å; Q257-Q303 HydrophobicContact CB-CB 4.45Å; Q257-Q303 HydrophobicContact CB-CG 4.25Å; Q257-V307 HydrophobicContact CB-CG2 4.33Å; Q257-V307 HydrophobicContact CG-CG2 3.76Å; Q257-M375 HydrophobicContact CB-CE 4.26Å; Q257-M375 HydrophobicContact CG-CE 3.78Å; Q257-M375 PolarHBondContact NE2-O 3.44Å
258	A	95.5	Very high	95.5	Very high	12 Å²	12	35.8 Å²	35.8	10%	0.099	19%	0.189	C	C	.	.	H	α-helix	trans	-64.1	-38.4	179	0	0	0	0	0	112	H255 H256 H262	H255-A258 PolarHBondContact O-N 2.89Å; H256-A258 PolarHBondContact O-N 3.22Å; A258-H262 PolarHBondContact O-N 2.87Å; A258-H262 PolarHBondContact O-ND1 3.34Å
259	F	97.3	Very high	95.7	Very high	5 Å²	5	40 Å²	40	2%	0.022	20%	0.203	C	C	.	.	H	α-helix	trans	-61.7	-47.3	174.7	167.9	-99.9	0	0	0	111.9	N207 Y216 Y246 L247 P248 L251 H255 H256 Q257 R263	N207-F259 WeakPolarHBondContact ND2-CD2 3.36Å; N207-F259 PolarHBondContact ND2-O 2.91Å; N207-F259 WeakPolarHBondContact O-CD2 3.49Å; N207-F259 WeakPolarHBondContact OD1-CE2 3.36Å; Y216-F259 VanDerWaalsContact OH-CD2 3.3Å; Y216-F259 WeakPolarHBondContact OH-CD2 3.46Å; Y246-F259 WeakPolarHBondContact O-CE1 3.48Å; Y246-F259 WeakPolarHBondContact O-CZ 3.46Å; L247-F259 HydrophobicContact CD2-CD1 4.14Å; P248-F259 HydrophobicContact CG-CD2 4.11Å; P248-F259 HydrophobicContact CG-CE1 4.29Å; P248-F259 HydrophobicContact CG-CE2 3.65Å; P248-F259 HydrophobicContact CG-CZ 3.75Å; L251-F259 HydrophobicContact CD2-CB 3.75Å; L251-F259 HydrophobicContact CD2-CD1 4.38Å; L251-F259 HydrophobicContact CD2-CG 4.01Å; H255-F259 WeakPolarHBondContact O-CB 3.23Å; H255-F259 PolarHBondContact O-N 3.46Å; H256-F259 WeakPolarHBondContact O-CB 3.33Å; H256-F259 PolarHBondContact O-N 3.06Å; Q257-F259 VanDerWaalsContact C-N 3.33Å; Q257-F259 PolarHBondContact O-N 3.1Å; F259-R263 VanDerWaalsContact CZ-CD 3.45Å; F259-R263 WeakPolarHBondContact O-CD 3.25Å; F259-R263 VanDerWaalsContact O-CG 3.24Å; F259-R263 WeakPolarHBondContact O-CG 3.36Å
260	V	98.1	Very high	96.1	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-70.5	-45.8	-178.5	174.9	0	0	0	0	111	I245 L247 H256 Q257 H262 R263 L264 Q303 T304 V307	I245-V260 HydrophobicContact CB-CG1 4.2Å; I245-V260 HydrophobicContact CB-CG2 4.25Å; I245-V260 HydrophobicContact CD1-CG1 3.65Å; I245-V260 HydrophobicContact CG2-CG1 4.23Å; L247-V260 HydrophobicContact CD2-CG2 4.21Å; H256-V260 WeakPolarHBondContact O-CG2 3.4Å; H256-V260 PolarHBondContact O-N 2.84Å; Q257-V260 PolarHBondContact O-N 3.17Å; V260-H262 PolarHBondContact O-N 3.47Å; V260-R263 PolarHBondContact O-N 3.12Å; V260-L264 HydrophobicContact CG1-CD1 3.79Å; V260-L264 HydrophobicContact CG1-CG 4.38Å; V260-L264 WeakPolarHBondContact O-CG 3.45Å; V260-L264 PolarHBondContact O-N 2.85Å; V260-L264 VanDerWaalsContact O-N 3.15Å; V260-Q303 VanDerWaalsContact CG2-O 3.3Å; V260-Q303 WeakPolarHBondContact CG2-O 3.27Å; V260-T304 HydrophobicContact CG2-CG2 4.08Å; V260-V307 HydrophobicContact CB-CG1 4.33Å; V260-V307 HydrophobicContact CG1-CB 3.92Å; V260-V307 HydrophobicContact CG1-CG1 3.85Å
261	R	97.4	Very high	96.5	Very high	35 Å²	35	29.1 Å²	29.1	13%	0.132	16%	0.156	C	C	.	.	H	α-helix	trans	-52.4	-55.9	-178.9	175.4	173.5	70.2	78	-3.3	111.9	Q257 R263 L264 E265 V307 L311	Q257-R261 WeakPolarHBondContact O-CB 3.37Å; Q257-R261 PolarHBondContact O-N 2.7Å; R261-R263 VanDerWaalsContact C-N 3.25Å; R261-R263 PolarHBondContact O-N 3.27Å; R261-L264 PolarHBondContact O-N 3.44Å; R261-L264 VanDerWaalsContact O-N 3.09Å; R261-E265 VanDerWaalsContact CD-OE1 3.31Å; R261-E265 WeakPolarHBondContact CD-OE1 3.3Å; R261-E265 HydrophobicContact CG-CG 4.2Å; R261-E265 WeakPolarHBondContact CG-OE1 3.41Å; R261-E265 IonicContact CZ-OE1 3.93Å; R261-E265 IonicContact NE-OE1 2.99Å; R261-E265 IonicContact NH1-OE1 3.71Å; R261-E265 PolarHBondContact NH1-OE1 2.94Å; R261-E265 IonicContact NH1-OE2 2.7Å; R261-E265 PolarHBondContact NH1-OE2 3.45Å; R261-E265 WeakPolarHBondContact O-CG 3.37Å; R261-E265 PolarHBondContact O-N 3.13Å; R261-V307 HydrophobicContact CB-CG1 4.18Å; R261-L311 HydrophobicContact CB-CD1 4.43Å; R261-L311 HydrophobicContact CG-CD1 4.13Å
262	H	97.8	Very high	96.5	Very high	8 Å²	8	33 Å²	33	4%	0.037	18%	0.177	C	C	.	.	H	α-helix	trans	-66.3	-26.9	-176.1	-67.4	101.7	0	0	0	113.4	T217 G218 H219 C220 A258 V260 E265 E266	T217-H262 PolarHBondContact O-CE1 2.78Å; G218-H262 VanDerWaalsContact C-ND1 3.28Å; G218-H262 VanDerWaalsContact O-CB 3.25Å; G218-H262 WeakPolarHBondContact O-CB 3.37Å; G218-H262 PolarHBondContact O-ND1 3.15Å; H219-H262 AromaticContact CD2-CD2 3.75Å; H219-H262 AromaticContact CD2-NE2 3.34Å; H219-H262 PolarHBondContact CD2-NE2 3.41Å; H219-H262 VanDerWaalsContact CD2-NE2 3.34Å; H219-H262 AromaticContact CE1-CE1 3.9Å; H219-H262 AromaticContact CE1-NE2 3.47Å; H219-H262 PolarHBondContact CE1-NE2 2.93Å; H219-H262 AromaticContact CG-CD2 3.95Å; H219-H262 AromaticContact CG-CE1 3.98Å; H219-H262 AromaticContact CG-NE2 3.5Å; H219-H262 AromaticContact ND1-CE1 3.76Å; H219-H262 AromaticContact ND1-NE2 3.56Å; H219-H262 AromaticContact NE2-NE2 3.34Å; H219-H262 PolarHBondContact NE2-NE2 3.01Å; C220-H262 PolarHBondContact SG-O 3.14Å; A258-H262 PolarHBondContact O-N 2.87Å; A258-H262 PolarHBondContact O-ND1 3.34Å; V260-H262 PolarHBondContact O-N 3.47Å; H262-E265 IonicContact CD2-OE2 3.33Å; H262-E265 PolarHBondContact CD2-OE2 3.41Å; H262-E265 IonicContact CG-OE2 3.91Å; H262-E266 WeakPolarHBondContact O-CB 3.47Å; H262-E266 PolarHBondContact O-N 3.5Å
263	R	98.6	Very high	96.6	Very high	25 Å²	25	33.2 Å²	33.2	9%	0.094	18%	0.177	C	C	.	.	H	α-helix	trans	-69.6	-37.4	174.7	-66.9	178.1	76.6	83.4	4.6	111.7	C205 N207 S244 I245 F259 V260 R261 A267	C205-R263 HydrophobicContact CB-CB 4.35Å; C205-R263 HydrophobicContact CB-CG 3.58Å; N207-R263 WeakPolarHBondContact OD1-CD 3.13Å; N207-R263 WeakPolarHBondContact OD1-CG 3.09Å; N207-R263 PolarHBondContact OD1-NH1 2.97Å; S244-R263 PolarHBondContact O-NE 3.1Å; S244-R263 PolarHBondContact O-NH2 3.11Å; I245-R263 HydrophobicContact CG2-CB 3.98Å; F259-R263 VanDerWaalsContact CZ-CD 3.45Å; F259-R263 WeakPolarHBondContact O-CD 3.25Å; F259-R263 VanDerWaalsContact O-CG 3.24Å; F259-R263 WeakPolarHBondContact O-CG 3.36Å; V260-R263 PolarHBondContact O-N 3.12Å; R261-R263 VanDerWaalsContact C-N 3.25Å; R261-R263 PolarHBondContact O-N 3.27Å; R263-A267 PolarHBondContact O-N 3.32Å
264	L	98.3	Very high	96.5	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-75.5	-41.8	176.5	-65.6	172.3	0	0	0	111.6	P243 I245 V260 R261 E266 A267 F268 V281 A283 V307 L311	P243-L264 HydrophobicContact CG-CD2 4.22Å; I245-L264 HydrophobicContact CG2-CD2 4.38Å; I245-L264 HydrophobicContact CG2-CG 4.45Å; V260-L264 HydrophobicContact CG1-CD1 3.79Å; V260-L264 HydrophobicContact CG1-CG 4.38Å; V260-L264 WeakPolarHBondContact O-CG 3.45Å; V260-L264 PolarHBondContact O-N 2.85Å; V260-L264 VanDerWaalsContact O-N 3.15Å; R261-L264 PolarHBondContact O-N 3.44Å; R261-L264 VanDerWaalsContact O-N 3.09Å; L264-E266 PolarHBondContact O-N 2.74Å; L264-A267 CarbonylContact O-C 3.49Å; L264-A267 WeakPolarHBondContact O-CA 3.35Å; L264-A267 WeakPolarHBondContact O-CB 3.38Å; L264-A267 PolarHBondContact O-N 3.01Å; L264-F268 HydrophobicContact CB-CD2 4.46Å; L264-F268 HydrophobicContact CB-CE2 4.13Å; L264-F268 WeakPolarHBondContact O-CD2 3.1Å; L264-F268 PolarHBondContact O-N 3.38Å; L264-V281 HydrophobicContact CD2-CG1 4.15Å; L264-A283 HydrophobicContact CD2-CB 3.7Å; L264-V307 HydrophobicContact CD1-CG1 4.17Å; L264-L311 HydrophobicContact CB-CD1 3.75Å; L264-L311 HydrophobicContact CD1-CD1 3.85Å; L264-L311 HydrophobicContact CG-CD1 4.47Å
265	E	97.3	Very high	96.3	Very high	52 Å²	52	30.8 Å²	30.8	24%	0.243	16%	0.16	C	C	.	.	H	α-helix	trans	-56.6	-41	173.1	-73.5	171.4	175	0	0	111.4	R261 H262 F268 R269	R261-E265 VanDerWaalsContact CD-OE1 3.31Å; R261-E265 WeakPolarHBondContact CD-OE1 3.3Å; R261-E265 HydrophobicContact CG-CG 4.2Å; R261-E265 WeakPolarHBondContact CG-OE1 3.41Å; R261-E265 IonicContact CZ-OE1 3.93Å; R261-E265 IonicContact NE-OE1 2.99Å; R261-E265 IonicContact NH1-OE1 3.71Å; R261-E265 PolarHBondContact NH1-OE1 2.94Å; R261-E265 IonicContact NH1-OE2 2.7Å; R261-E265 PolarHBondContact NH1-OE2 3.45Å; R261-E265 WeakPolarHBondContact O-CG 3.37Å; R261-E265 PolarHBondContact O-N 3.13Å; H262-E265 IonicContact CD2-OE2 3.33Å; H262-E265 PolarHBondContact CD2-OE2 3.41Å; H262-E265 IonicContact CG-OE2 3.91Å; E265-F268 PolarHBondContact O-N 3.25Å; E265-R269 WeakPolarHBondContact O-CB 3.35Å; E265-R269 PolarHBondContact O-N 2.85Å
266	E	98.6	Very high	96	Very high	7 Å²	7	38 Å²	38	3%	0.033	19%	0.185	C	C	.	.	H	α-helix	trans	-66.9	-36.4	174.4	178.1	56.8	-178.5	0	0	112.9	P203 L225 N228 H262 L264 R269 V270	P203-E266 HydrophobicContact CB-CG 4.14Å; P203-E266 HydrophobicContact CG-CG 4.04Å; L225-E266 HydrophobicContact CD2-CB 4.49Å; L225-E266 HydrophobicContact CD2-CG 3.98Å; L225-E266 WeakPolarHBondContact CD2-OE1 3.19Å; L225-E266 WeakPolarHBondContact CD2-OE2 3.41Å; N228-E266 VanDerWaalsContact CB-OE1 3.24Å; N228-E266 WeakPolarHBondContact CB-OE1 3.49Å; N228-E266 WeakPolarHBondContact ND2-CG 3.4Å; N228-E266 PolarHBondContact ND2-OE1 2.81Å; H262-E266 WeakPolarHBondContact O-CB 3.47Å; H262-E266 PolarHBondContact O-N 3.5Å; L264-E266 PolarHBondContact O-N 2.74Å; E266-R269 PolarHBondContact O-N 3.41Å; E266-R269 IonicContact OE1-CZ 2.72Å; E266-R269 IonicContact OE1-NE 3.51Å; E266-R269 PolarHBondContact OE1-NE 3.43Å; E266-R269 IonicContact OE1-NH2 3.71Å; E266-R269 PolarHBondContact OE1-NH2 2.68Å; E266-R269 IonicContact OE2-CZ 3.6Å; E266-R269 IonicContact OE2-NE 2.76Å; E266-R269 PolarHBondContact OE2-NE 2.85Å; E266-R269 IonicContact OE2-NH2 3.47Å; E266-V270 PolarHBondContact O-N 2.89Å
267	A	98.6	Very high	95.5	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-61.3	-46.8	171.6	0	0	0	0	0	111.7	P203 L241 P243 R263 L264 R269 V270 A271 V281	P203-A267 VanDerWaalsContact CG-CA 3.49Å; P203-A267 HydrophobicContact CG-CB 4Å; L241-A267 HydrophobicContact CD1-CB 4.4Å; L241-A267 WeakPolarHBondContact CD1-O 3.5Å; P243-A267 HydrophobicContact CB-CB 4.41Å; P243-A267 HydrophobicContact CG-CB 3.9Å; R263-A267 PolarHBondContact O-N 3.32Å; L264-A267 CarbonylContact O-C 3.49Å; L264-A267 WeakPolarHBondContact O-CA 3.35Å; L264-A267 WeakPolarHBondContact O-CB 3.38Å; L264-A267 PolarHBondContact O-N 3.01Å; A267-R269 VanDerWaalsContact C-N 3.35Å; A267-R269 PolarHBondContact O-N 3.36Å; A267-V270 WeakPolarHBondContact O-CG2 3.2Å; A267-V270 PolarHBondContact O-N 3.47Å; A267-A271 WeakPolarHBondContact O-CB 3.12Å; A267-A271 PolarHBondContact O-N 3.29Å; A267-V281 HydrophobicContact CB-CG1 3.84Å; A267-V281 HydrophobicContact CB-CG2 4.01Å
268	F	97.3	Very high	95.3	Very high	51 Å²	51	42.9 Å²	42.9	22%	0.224	21%	0.214	C	C	.	.	H	α-helix	trans	-65.4	-36.5	176.8	-67.3	-59.9	0	0	0	112.9	L264 E265 V270 A271 V281 L311 A313	L264-F268 HydrophobicContact CB-CD2 4.46Å; L264-F268 HydrophobicContact CB-CE2 4.13Å; L264-F268 WeakPolarHBondContact O-CD2 3.1Å; L264-F268 PolarHBondContact O-N 3.38Å; E265-F268 PolarHBondContact O-N 3.25Å; F268-V270 VanDerWaalsContact C-N 3.31Å; F268-V270 PolarHBondContact O-N 3.02Å; F268-A271 PolarHBondContact O-N 3.2Å; F268-V281 HydrophobicContact CD1-CG2 3.77Å; F268-V281 HydrophobicContact CE1-CB 4Å; F268-V281 HydrophobicContact CE1-CG2 3.64Å; F268-V281 HydrophobicContact CZ-CB 4.28Å; F268-V281 HydrophobicContact CZ-CG2 4.3Å; F268-L311 HydrophobicContact CE2-CB 3.78Å; F268-L311 WeakPolarHBondContact CE2-O 3.31Å; F268-L311 HydrophobicContact CZ-CB 4.48Å; F268-L311 WeakPolarHBondContact CZ-O 3.24Å; F268-A313 HydrophobicContact CZ-CB 4.17Å
269	R	97.1	Very high	95.3	Very high	110 Å²	110	43 Å²	43	42%	0.415	21%	0.213	S	C	.	.	H	α-helix	trans	-58.8	-42.2	176.7	-169.3	-166.6	66.6	84.5	-3.9	111.8	T229 E265 E266 A267	T229-R269 PolarHBondContact OG1-NH1 3.28Å; E265-R269 WeakPolarHBondContact O-CB 3.35Å; E265-R269 PolarHBondContact O-N 2.85Å; E266-R269 PolarHBondContact O-N 3.41Å; E266-R269 IonicContact OE1-CZ 2.72Å; E266-R269 IonicContact OE1-NE 3.51Å; E266-R269 PolarHBondContact OE1-NE 3.43Å; E266-R269 IonicContact OE1-NH2 3.71Å; E266-R269 PolarHBondContact OE1-NH2 2.68Å; E266-R269 IonicContact OE2-CZ 3.6Å; E266-R269 IonicContact OE2-NE 2.76Å; E266-R269 PolarHBondContact OE2-NE 2.85Å; E266-R269 IonicContact OE2-NH2 3.47Å; A267-R269 VanDerWaalsContact C-N 3.35Å; A267-R269 PolarHBondContact O-N 3.36Å
270	V	98.4	Very high	95.3	Very high	1 Å²	1	44.4 Å²	44.4	1%	0.006	22%	0.223	C	C	.	.	H	α-helix	trans	-87.4	-14.8	-179.5	-54.6	0	0	0	0	113.7	P203 N228 W235 L241 E266 A267 F268 L272 V273	P203-V270 HydrophobicContact CB-CG2 4.12Å; P203-V270 HydrophobicContact CG-CG2 3.72Å; N228-V270 HydrophobicContact CB-CG1 4.34Å; W235-V270 HydrophobicContact CD2-CB 4.11Å; W235-V270 HydrophobicContact CD2-CG2 4.03Å; W235-V270 HydrophobicContact CE3-CG2 4.3Å; W235-V270 HydrophobicContact CG-CB 4.02Å; W235-V270 HydrophobicContact CG-CG2 4.34Å; L241-V270 HydrophobicContact CD1-CG2 3.73Å; E266-V270 PolarHBondContact O-N 2.89Å; A267-V270 WeakPolarHBondContact O-CG2 3.2Å; A267-V270 PolarHBondContact O-N 3.47Å; F268-V270 VanDerWaalsContact C-N 3.31Å; F268-V270 PolarHBondContact O-N 3.02Å; V270-L272 PolarHBondContact O-N 3.34Å; V270-L272 VanDerWaalsContact O-N 3.13Å; V270-V273 WeakPolarHBondContact O-CB 3.13Å; V270-V273 WeakPolarHBondContact O-CG2 3.36Å; V270-V273 PolarHBondContact O-N 2.71Å
271	A	97	Very high	95.3	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-21.7	-175.6	0	0	0	0	0	114.8	L241 A267 F268 P278 L279	L241-A271 HydrophobicContact CD1-CB 3.86Å; A267-A271 WeakPolarHBondContact O-CB 3.12Å; A267-A271 PolarHBondContact O-N 3.29Å; F268-A271 PolarHBondContact O-N 3.2Å; A271-P278 HydrophobicContact CB-CB 4.12Å; A271-P278 WeakPolarHBondContact O-CA 3.35Å; A271-L279 HydrophobicContact CB-CB 4.18Å; A271-L279 WeakPolarHBondContact O-CG 3.34Å; A271-L279 PolarHBondContact O-N 2.94Å
272	L	93.8	Very high	95.4	Very high	91 Å²	91	43 Å²	43	48%	0.476	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.5	-8.1	177	-82.3	166.6	0	0	0	113.7	V270 G274 H275 P278	V270-L272 PolarHBondContact O-N 3.34Å; V270-L272 VanDerWaalsContact O-N 3.13Å; L272-G274 PolarHBondContact O-N 3.47Å; L272-G274 VanDerWaalsContact O-N 3.1Å; L272-H275 PolarHBondContact O-N 2.71Å; L272-H275 VanDerWaalsContact O-N 3.15Å; L272-P278 HydrophobicContact CD1-CG 4.32Å; L272-P278 HydrophobicContact CD2-CB 4.28Å; L272-P278 HydrophobicContact CD2-CG 3.73Å; L272-P278 HydrophobicContact CG-CB 4.17Å; L272-P278 HydrophobicContact CG-CG 3.88Å
273	V	94.4	Very high	95.4	Very high	49 Å²	49	42.7 Å²	42.7	30%	0.297	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.2	111	-174.7	178.6	0	0	0	0	109.9	H232 W235 A236 V270 H275	H232-V273 HydrophobicContact CB-CG1 3.71Å; W235-V273 HydrophobicContact CB-CB 4.03Å; W235-V273 HydrophobicContact CB-CG1 4.36Å; W235-V273 HydrophobicContact CG-CB 4.39Å; A236-V273 PolarHBondContact N-O 2.75Å; V270-V273 WeakPolarHBondContact O-CB 3.13Å; V270-V273 WeakPolarHBondContact O-CG2 3.36Å; V270-V273 PolarHBondContact O-N 2.71Å; V273-H275 PolarHBondContact O-CD2 3.47Å; V273-H275 VanDerWaalsContact O-CD2 3.26Å
274	G	89.9	Confident	95.4	Very high	63 Å²	63	41.5 Å²	41.5	65%	0.649	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	86.4	5.3	-177.6	0	0	0	0	0	114.8	L272	L272-G274 PolarHBondContact O-N 3.47Å; L272-G274 VanDerWaalsContact O-N 3.1Å
275	H	90.6	Very high	95.4	Very high	56 Å²	56	41.6 Å²	41.6	26%	0.259	21%	0.213	S	C	.	.			trans	-130.3	145.7	-173.8	-61.6	-76.5	0	0	0	112.6	W235 S238 L272 V273 H277	W235-H275 PolarHBondContact O-NE2 3.47Å; S238-H275 PolarHBondContact O-CE1 2.73Å; S238-H275 PolarHBondContact O-NE2 3.08Å; L272-H275 PolarHBondContact O-N 2.71Å; L272-H275 VanDerWaalsContact O-N 3.15Å; V273-H275 PolarHBondContact O-CD2 3.47Å; V273-H275 VanDerWaalsContact O-CD2 3.26Å; H275-H277 VanDerWaalsContact C-N 3.32Å; H275-H277 WeakPolarHBondContact CB-O 3.43Å
276	R	86.9	Confident	95.4	Very high	205 Å²	205	40.7 Å²	40.7	77%	0.774	21%	0.207	S	C	*	.	S	Bend	trans	-75.4	-23.3	174.5	-67.4	-175.2	179.8	174	0.8	113.1
277	H	87.2	Confident	95.3	Very high	54 Å²	54	40.4 Å²	40.4	25%	0.25	21%	0.206	C	C	.	.	S	Bend	trans	-131	146.9	177.5	-62.2	96.3	0	0	0	108.4	H275 L279 C399 R410	H275-H277 VanDerWaalsContact C-N 3.32Å; H275-H277 WeakPolarHBondContact CB-O 3.43Å; H277-L279 PolarHBondContact O-N 3.23Å; H277-C399 VanDerWaalsContact CE1-SG 3.59Å; H277-C399 PolarHBondContact ND1-SG 2.75Å; H277-R410 PolarHBondContact NE2-NH1 3.31Å; H277-R410 VanDerWaalsContact NE2-NH1 3.12Å
278	P	92	Very high	95.2	Very high	76 Å²	76	40.7 Å²	40.7	49%	0.494	21%	0.208	S	C	.	.	P	Polyproline II helix	trans	-60.1	136	-179.8	-17.8	28.4	0	0	0	111.2	A271 L272	A271-P278 HydrophobicContact CB-CB 4.12Å; A271-P278 WeakPolarHBondContact O-CA 3.35Å; L272-P278 HydrophobicContact CD1-CG 4.32Å; L272-P278 HydrophobicContact CD2-CB 4.28Å; L272-P278 HydrophobicContact CD2-CG 3.73Å; L272-P278 HydrophobicContact CG-CB 4.17Å; L272-P278 HydrophobicContact CG-CG 3.88Å
279	L	95.5	Very high	95	Very high	14 Å²	14	39.5 Å²	39.5	7%	0.073	20%	0.203	C	C	.	.	P	Polyproline II helix	trans	-57.2	143.5	169.6	-68.5	-178.5	0	0	0	111.5	S238 L241 A271 H277 V281	S238-L279 WeakPolarHBondContact O-CD2 3.25Å; L241-L279 HydrophobicContact CD2-CD1 4.12Å; L241-L279 HydrophobicContact CG-CB 4.31Å; L241-L279 HydrophobicContact CG-CD1 4.13Å; A271-L279 HydrophobicContact CB-CB 4.18Å; A271-L279 WeakPolarHBondContact O-CG 3.34Å; A271-L279 PolarHBondContact O-N 2.94Å; H277-L279 PolarHBondContact O-N 3.23Å; L279-V281 PolarHBondContact O-N 2.76Å
280	P	96.6	Very high	94.2	Very high	35 Å²	35	42 Å²	42	23%	0.227	21%	0.212	C	C	.	.	P	Polyproline II helix	trans	-63.4	131.8	171	26.9	-32.8	0	0	0	110.6	L196 S239 A240 L241 L282 A314	L196-P280 HydrophobicContact CD2-CG 4.01Å; S239-P280 VanDerWaalsContact O-CD 3.32Å; S239-P280 WeakPolarHBondContact O-CD 3.39Å; S239-P280 WeakPolarHBondContact O-CG 3.43Å; A240-P280 WeakPolarHBondContact CA-O 3.24Å; A240-P280 HydrophobicContact CB-CG 3.94Å; L241-P280 PolarHBondContact N-O 3.43Å; P280-L282 HydrophobicContact CB-CD1 4.24Å; P280-A314 HydrophobicContact CB-CB 3.76Å
281	V	98.5	Very high	93.3	Very high	1 Å²	1	50.8 Å²	50.8	1%	0.006	25%	0.245	C	C	.	.	B	Isolated β-bridge	trans	-100.1	120.8	175	179.4	0	0	0	0	109.1	L241 P243 L264 A267 F268 L279 A314 G315	L241-V281 HydrophobicContact CB-CG2 4.37Å; L241-V281 HydrophobicContact CD1-CG2 4.38Å; P243-V281 HydrophobicContact CG-CG1 3.87Å; L264-V281 HydrophobicContact CD2-CG1 4.15Å; A267-V281 HydrophobicContact CB-CG1 3.84Å; A267-V281 HydrophobicContact CB-CG2 4.01Å; F268-V281 HydrophobicContact CD1-CG2 3.77Å; F268-V281 HydrophobicContact CE1-CB 4Å; F268-V281 HydrophobicContact CE1-CG2 3.64Å; F268-V281 HydrophobicContact CZ-CB 4.28Å; F268-V281 HydrophobicContact CZ-CG2 4.3Å; L279-V281 PolarHBondContact O-N 2.76Å; V281-A314 WeakPolarHBondContact O-CB 3.4Å; V281-A314 PolarHBondContact O-N 2.95Å; V281-G315 PolarHBondContact O-N 2.95Å
282	L	98.6	Very high	92.7	Very high	6 Å²	6	54.6 Å²	54.6	3%	0.031	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	104.2	174.1	-64.7	98.2	0	0	0	109.7	L34 P123 L196 A240 L241 F242 P280 A314 G315 V317	L34-L282 HydrophobicContact CD1-CD2 3.51Å; P123-L282 HydrophobicContact CG-CD2 3.98Å; L196-L282 HydrophobicContact CD1-CD1 4.28Å; A240-L282 HydrophobicContact CB-CD1 4.13Å; L241-L282 PolarHBondContact O-N 2.86Å; F242-L282 WeakPolarHBondContact CA-O 3.44Å; F242-L282 HydrophobicContact CD1-CB 3.91Å; F242-L282 HydrophobicContact CE1-CB 3.87Å; F242-L282 HydrophobicContact CE1-CD1 3.94Å; F242-L282 HydrophobicContact CE1-CG 4.38Å; F242-L282 HydrophobicContact CZ-CD1 4.48Å; P280-L282 HydrophobicContact CB-CD1 4.24Å; L282-A314 HydrophobicContact CD1-CB 4.29Å; L282-A314 HydrophobicContact CG-CB 4.16Å; L282-G315 WeakPolarHBondContact CA-O 2.88Å; L282-V317 HydrophobicContact CB-CG2 4.28Å
283	A	98.7	Very high	92.4	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	130.2	-172.1	0	0	0	0	0	111.6	P243 I245 L264 V285 G315 V316 V317	P243-A283 HydrophobicContact CG-CB 4.44Å; P243-A283 WeakPolarHBondContact O-CA 3.18Å; I245-A283 HydrophobicContact CD1-CB 3.71Å; I245-A283 HydrophobicContact CG1-CB 3.97Å; I245-A283 HydrophobicContact CG2-CB 4.38Å; L264-A283 HydrophobicContact CD2-CB 3.7Å; A283-V285 PolarHBondContact O-N 3.33Å; A283-G315 PolarHBondContact N-O 3.32Å; A283-G315 VanDerWaalsContact N-O 3.08Å; A283-V316 HydrophobicContact CB-CG1 4.31Å; A283-V316 CarbonylContact O-C 3.51Å; A283-V316 WeakPolarHBondContact O-CA 3.23Å; A283-V316 WeakPolarHBondContact O-CB 3.47Å; A283-V317 PolarHBondContact O-N 3.08Å
284	Y	98.8	Very high	92.3	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	119.5	174.3	-95.9	-101.1	0	0	0	110.3	M70 I72 V125 Y200 F242 P243 I245 Y246 V317 W319	M70-Y284 WeakPolarHBondContact CE-OH 3.3Å; I72-Y284 HydrophobicContact CD1-CE1 4.39Å; V125-Y284 HydrophobicContact CG1-CE2 4.1Å; V125-Y284 HydrophobicContact CG2-CE2 4.18Å; Y200-Y284 AromaticContact CD2-CD1 3.94Å; Y200-Y284 HydrophobicContact CD2-CD1 3.94Å; Y200-Y284 AromaticContact CD2-CD2 3.86Å; Y200-Y284 HydrophobicContact CD2-CD2 3.86Å; Y200-Y284 HydrophobicContact CD2-CE1 4.19Å; Y200-Y284 HydrophobicContact CD2-CE2 4.12Å; Y200-Y284 AromaticContact CD2-CG 3.74Å; Y200-Y284 HydrophobicContact CD2-CG 3.74Å; Y200-Y284 AromaticContact CE2-CD1 3.78Å; Y200-Y284 HydrophobicContact CE2-CD1 3.78Å; Y200-Y284 HydrophobicContact CE2-CD2 4.3Å; Y200-Y284 HydrophobicContact CE2-CE1 4.39Å; Y200-Y284 AromaticContact CE2-CG 3.71Å; Y200-Y284 HydrophobicContact CE2-CG 3.71Å; F242-Y284 HydrophobicContact CB-CD2 4.03Å; F242-Y284 HydrophobicContact CB-CE2 4.02Å; F242-Y284 HydrophobicContact CD1-CD2 4.42Å; F242-Y284 AromaticContact CD1-CE2 3.97Å; F242-Y284 HydrophobicContact CD1-CE2 3.97Å; F242-Y284 HydrophobicContact CG-CE2 4.27Å; P243-Y284 PolarHBondContact O-N 2.76Å; I245-Y284 VanDerWaalsContact CG1-O 3.23Å; I245-Y284 WeakPolarHBondContact CG1-O 3.44Å; I245-Y284 PolarHBondContact N-O 2.67Å; Y246-Y284 VanDerWaalsContact CD1-O 3.26Å; Y246-Y284 WeakPolarHBondContact CD1-O 3.34Å; Y246-Y284 VanDerWaalsContact CE1-C 3.46Å; Y246-Y284 VanDerWaalsContact CE1-O 3.27Å; Y246-Y284 WeakPolarHBondContact CE1-O 3.42Å; Y246-Y284 WeakPolarHBondContact OH-CD1 3.06Å; Y284-V317 WeakPolarHBondContact CA-O 3.03Å; Y284-V317 HydrophobicContact CD1-CB 4.12Å; Y284-V317 HydrophobicContact CD1-CG1 4.03Å; Y284-V317 HydrophobicContact CD2-CB 3.97Å; Y284-V317 HydrophobicContact CD2-CG1 4.5Å; Y284-V317 HydrophobicContact CD2-CG2 4.25Å; Y284-V317 HydrophobicContact CE1-CB 4.07Å; Y284-V317 HydrophobicContact CE1-CG1 3.57Å; Y284-V317 HydrophobicContact CE2-CB 3.91Å; Y284-V317 HydrophobicContact CE2-CG1 4.08Å; Y284-V317 HydrophobicContact CE2-CG2 3.95Å; Y284-V317 HydrophobicContact CG-CB 4.09Å; Y284-V317 HydrophobicContact CG-CG1 4.49Å; Y284-W319 HydrophobicContact CD1-CB 3.99Å; Y284-W319 HydrophobicContact CD1-CG 4.4Å; Y284-W319 HydrophobicContact CE1-CB 4.29Å; Y284-W319 HydrophobicContact CE1-CG 4.45Å
285	V	98.3	Very high	92.7	Very high	2 Å²	2	56.4 Å²	56.4	1%	0.012	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	129.5	177.9	-179.1	0	0	0	0	109	I245 Y246 A283 L296 I305 V316 V317 L318 W319	I245-V285 HydrophobicContact CD1-CG2 3.59Å; I245-V285 HydrophobicContact CG1-CG2 3.78Å; Y246-V285 VanDerWaalsContact CE1-C 3.42Å; A283-V285 PolarHBondContact O-N 3.33Å; V285-L296 HydrophobicContact CG1-CD1 4.1Å; V285-I305 HydrophobicContact CG1-CG1 4.37Å; V285-I305 HydrophobicContact CG2-CG1 4.28Å; V285-V316 HydrophobicContact CG2-CB 4.02Å; V285-V316 HydrophobicContact CG2-CG1 3.92Å; V285-V317 PolarHBondContact N-O 3.38Å; V285-L318 HydrophobicContact CB-CD2 4.33Å; V285-L318 WeakPolarHBondContact O-CA 3.17Å; V285-W319 PolarHBondContact O-N 2.98Å
286	R	96.8	Very high	93	Very high	33 Å²	33	54 Å²	54	13%	0.125	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	135.5	174.3	-174.1	177.6	172.7	121.3	7.2	108.7	Y246 T288 L296 W319 D321	Y246-R286 HydrophobicContact CD1-CB 3.57Å; Y246-R286 HydrophobicContact CD2-CB 4.04Å; Y246-R286 HydrophobicContact CE1-CB 3.75Å; Y246-R286 HydrophobicContact CE2-CB 4.2Å; Y246-R286 HydrophobicContact CG-CB 3.73Å; R286-T288 WeakPolarHBondContact CD-O 3.46Å; R286-T288 VanDerWaalsContact CG-O 3.25Å; R286-T288 WeakPolarHBondContact CG-O 3.48Å; R286-T288 PolarHBondContact NE-O 3.14Å; R286-T288 PolarHBondContact NE-OG1 3.19Å; R286-T288 PolarHBondContact O-N 2.94Å; R286-L296 WeakPolarHBondContact O-CD1 3.44Å; R286-W319 WeakPolarHBondContact CA-O 3.21Å; R286-W319 HydrophobicContact CG-CE3 4.07Å; R286-W319 HydrophobicContact CG-CZ3 4.28Å; R286-W319 VanDerWaalsContact NH1-CZ3 3.29Å; R286-D321 IonicContact CZ-OD2 3.47Å; R286-D321 IonicContact NH1-OD2 2.78Å; R286-D321 IonicContact NH2-OD2 3.24Å; R286-D321 PolarHBondContact NH2-OD2 3.16Å
287	L	96.5	Very high	93.6	Very high	1 Å²	1	46.4 Å²	46.4	1%	0.005	23%	0.23	C	C	.	.	S	Bend	trans	-68.5	-20.8	178.5	-65	-174.7	0	0	0	114	W35 V37 F295 L296 L318 W319 L324 L334 Y337 L342	W35-L287 HydrophobicContact CH2-CD1 3.66Å; W35-L287 HydrophobicContact CZ3-CD1 3.77Å; V37-L287 HydrophobicContact CG2-CD1 3.67Å; V37-L287 HydrophobicContact CG2-CG 4.36Å; L287-F295 HydrophobicContact CB-CD1 4.26Å; L287-F295 HydrophobicContact CB-CE1 4.46Å; L287-F295 CarbonylContact O-C 3.39Å; L287-F295 VanDerWaalsContact O-CA 3.31Å; L287-F295 WeakPolarHBondContact O-CA 3.3Å; L287-L296 PolarHBondContact O-N 2.93Å; L287-L318 HydrophobicContact CD2-CB 4.1Å; L287-L318 HydrophobicContact CD2-CD1 4.36Å; L287-L318 HydrophobicContact CD2-CD2 3.98Å; L287-L318 HydrophobicContact CD2-CG 4.37Å; L287-W319 PolarHBondContact N-O 2.8Å; L287-L324 HydrophobicContact CB-CD1 4.48Å; L287-L324 HydrophobicContact CD1-CD1 4.27Å; L287-L334 HydrophobicContact CD1-CD1 4.1Å; L287-Y337 HydrophobicContact CD2-CE1 4.33Å; L287-L342 HydrophobicContact CD2-CD2 3.74Å
288	T	96	Very high	94	Very high	6 Å²	6	49.7 Å²	49.7	4%	0.037	25%	0.245	C	C	.	.	B	Isolated β-bridge	trans	-127.5	151.4	-174.3	59.3	0	0	0	0	113	R286 R290 G293 R294 F295 L324	R286-T288 WeakPolarHBondContact CD-O 3.46Å; R286-T288 VanDerWaalsContact CG-O 3.25Å; R286-T288 WeakPolarHBondContact CG-O 3.48Å; R286-T288 PolarHBondContact NE-O 3.14Å; R286-T288 PolarHBondContact NE-OG1 3.19Å; R286-T288 PolarHBondContact O-N 2.94Å; T288-R290 PolarHBondContact O-N 3.26Å; T288-G293 WeakPolarHBondContact CB-O 3.47Å; T288-G293 WeakPolarHBondContact CG2-O 3.17Å; T288-R294 CarbonylContact C-O 3.11Å; T288-R294 VanDerWaalsContact CA-O 3.24Å; T288-R294 WeakPolarHBondContact CA-O 3.48Å; T288-F295 HydrophobicContact CG2-CD1 3.63Å; T288-F295 HydrophobicContact CG2-CE1 3.87Å; T288-F295 HydrophobicContact CG2-CG 4.31Å; T288-L324 HydrophobicContact CG2-CD2 3.94Å
289	H	92.6	Very high	94.3	Very high	27 Å²	27	51.4 Å²	51.4	13%	0.125	25%	0.25	C	S	.	.			trans	-67.1	119.3	167.5	-77.2	-85.8	0	0	0	109.9	R291 S292 G293 R294 L296 D300	H289-R291 PolarHBondContact O-N 2.98Å; H289-S292 VanDerWaalsContact CB-OG 3.3Å; H289-S292 WeakPolarHBondContact CB-OG 3.39Å; H289-S292 PolarHBondContact O-N 3.17Å; H289-G293 PolarHBondContact O-N 3.08Å; H289-R294 PolarHBondContact N-O 3.22Å; H289-L296 WeakPolarHBondContact NE2-CD2 3.47Å; H289-D300 IonicContact CD2-OD2 3.86Å; H289-D300 IonicContact CE1-OD2 3.8Å; H289-D300 IonicContact NE2-OD1 3.16Å; H289-D300 IonicContact NE2-OD2 3.64Å; H289-D300 PolarHBondContact NE2-OD2 2.85Å
290	R	82	Confident	94.4	Very high	163 Å²	163	51.1 Å²	51.1	62%	0.615	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-49.2	-31	-171	-81.5	-177.6	67.6	-174.4	3.1	116.4	P249 T288	P249-R290 HydrophobicContact CG-CB 4.38Å; T288-R290 PolarHBondContact O-N 3.26Å
291	R	78.5	Confident	94.5	Very high	184 Å²	184	49.5 Å²	49.5	69%	0.694	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.4	-33.5	-177.2	-81.4	-165.4	-179	-166.8	0.1	114	P249 H289	P249-R291 HydrophobicContact CB-CB 4.41Å; P249-R291 HydrophobicContact CB-CG 3.85Å; P249-R291 HydrophobicContact CG-CG 3.93Å; H289-R291 PolarHBondContact O-N 2.98Å
292	S	85.3	Confident	94.5	Very high	81 Å²	81	50.8 Å²	50.8	57%	0.566	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-97.1	-17	-175	54.4	0	0	0	0	112.9	H289 R294	H289-S292 VanDerWaalsContact CB-OG 3.3Å; H289-S292 WeakPolarHBondContact CB-OG 3.39Å; H289-S292 PolarHBondContact O-N 3.17Å; S292-R294 PolarHBondContact O-N 3.29Å; S292-R294 PolarHBondContact OG-N 3.01Å
293	G	86.6	Confident	94.5	Very high	44 Å²	44	52 Å²	52	45%	0.454	25%	0.252	S	S	.	.			trans	70.6	-10.2	-171.6	0	0	0	0	0	113.7	T288 H289 F295	T288-G293 WeakPolarHBondContact CB-O 3.47Å; T288-G293 WeakPolarHBondContact CG2-O 3.17Å; H289-G293 PolarHBondContact O-N 3.08Å; G293-F295 PolarHBondContact O-N 3.46Å
294	R	93.5	Very high	94.5	Very high	160 Å²	160	52.1 Å²	52.1	60%	0.604	25%	0.252	S	S	*	.	P	Polyproline II helix	trans	-60.8	133.8	177.9	-167.2	-176.9	69.9	162	1.4	110.7	T288 H289 S292	T288-R294 CarbonylContact C-O 3.11Å; T288-R294 VanDerWaalsContact CA-O 3.24Å; T288-R294 WeakPolarHBondContact CA-O 3.48Å; H289-R294 PolarHBondContact N-O 3.22Å; S292-R294 PolarHBondContact O-N 3.29Å; S292-R294 PolarHBondContact OG-N 3.01Å
295	F	97.6	Very high	94.5	Very high	36 Å²	36	52.1 Å²	52.1	16%	0.158	25%	0.252	C	S	.	.	B	Isolated β-bridge	trans	-56.3	152.7	170.9	-68	-67.1	0	0	0	112.3	L287 T288 G293 L324 H333 L334 Y337	L287-F295 HydrophobicContact CB-CD1 4.26Å; L287-F295 HydrophobicContact CB-CE1 4.46Å; L287-F295 CarbonylContact O-C 3.39Å; L287-F295 VanDerWaalsContact O-CA 3.31Å; L287-F295 WeakPolarHBondContact O-CA 3.3Å; T288-F295 HydrophobicContact CG2-CD1 3.63Å; T288-F295 HydrophobicContact CG2-CE1 3.87Å; T288-F295 HydrophobicContact CG2-CG 4.31Å; G293-F295 PolarHBondContact O-N 3.46Å; F295-L324 HydrophobicContact CE1-CD1 4.44Å; F295-L324 HydrophobicContact CE1-CD2 3.88Å; F295-L324 HydrophobicContact CZ-CD2 3.95Å; F295-H333 HydrophobicContact CE2-CB 4.3Å; F295-L334 HydrophobicContact CE1-CD1 3.87Å; F295-L334 HydrophobicContact CZ-CB 4.34Å; F295-L334 HydrophobicContact CZ-CD1 3.98Å; F295-Y337 HydrophobicContact CB-CD1 4.17Å; F295-Y337 HydrophobicContact CB-CD2 3.48Å; F295-Y337 VanDerWaalsContact CB-CD2 3.48Å; F295-Y337 HydrophobicContact CB-CE1 4.15Å; F295-Y337 HydrophobicContact CB-CE2 3.5Å; F295-Y337 HydrophobicContact CB-CG 3.83Å; F295-Y337 AromaticContact CD1-CD1 3.39Å; F295-Y337 HydrophobicContact CD1-CD1 3.39Å; F295-Y337 HydrophobicContact CD1-CD2 4.26Å; F295-Y337 AromaticContact CD1-CE1 3.65Å; F295-Y337 HydrophobicContact CD1-CE1 3.65Å; F295-Y337 HydrophobicContact CD1-CE2 4.49Å; F295-Y337 AromaticContact CD1-CG 3.71Å; F295-Y337 HydrophobicContact CD1-CG 3.71Å; F295-Y337 HydrophobicContact CD2-CD1 4.32Å; F295-Y337 HydrophobicContact CD2-CD2 4.13Å; F295-Y337 AromaticContact CD2-CG 3.79Å; F295-Y337 HydrophobicContact CD2-CG 3.79Å; F295-Y337 AromaticContact CE1-CD1 3.78Å; F295-Y337 HydrophobicContact CE1-CD1 3.78Å; F295-Y337 HydrophobicContact CE1-CE1 4.34Å; F295-Y337 HydrophobicContact CE1-CG 4.2Å; F295-Y337 HydrophobicContact CE2-CG 4.27Å; F295-Y337 AromaticContact CG-CD1 3.71Å; F295-Y337 HydrophobicContact CG-CD1 3.71Å; F295-Y337 AromaticContact CG-CD2 3.72Å; F295-Y337 HydrophobicContact CG-CD2 3.72Å; F295-Y337 HydrophobicContact CG-CE1 4.08Å; F295-Y337 HydrophobicContact CG-CE2 4.11Å; F295-Y337 AromaticContact CG-CG 3.49Å; F295-Y337 HydrophobicContact CG-CG 3.49Å; F295-Y337 VanDerWaalsContact CG-CG 3.49Å; F295-Y337 HydrophobicContact CZ-CD1 4.39Å; F295-Y337 HydrophobicContact CZ-CG 4.46Å
296	L	97.6	Very high	94.5	Very high	7 Å²	7	52 Å²	52	4%	0.037	25%	0.252	C	S	.	.	P	Polyproline II helix	trans	-62.6	135.5	172.2	-68	-166.2	0	0	0	109.7	L247 V285 R286 L287 H289 D300 L301 T304 Y337	L247-L296 HydrophobicContact CD1-CD2 4.09Å; V285-L296 HydrophobicContact CG1-CD1 4.1Å; R286-L296 WeakPolarHBondContact O-CD1 3.44Å; L287-L296 PolarHBondContact O-N 2.93Å; H289-L296 WeakPolarHBondContact NE2-CD2 3.47Å; L296-D300 WeakPolarHBondContact CA-OD2 3.5Å; L296-D300 HydrophobicContact CB-CB 3.7Å; L296-D300 HydrophobicContact CD1-CB 4.3Å; L296-D300 HydrophobicContact CD2-CB 3.97Å; L296-D300 HydrophobicContact CG-CB 4.18Å; L296-L301 HydrophobicContact CB-CD2 4.09Å; L296-L301 HydrophobicContact CB-CG 4.45Å; L296-L301 HydrophobicContact CD1-CD2 4.27Å; L296-T304 HydrophobicContact CD1-CG2 4.48Å; L296-Y337 WeakPolarHBondContact O-CE2 3.36Å; L296-Y337 PolarHBondContact O-OH 2.99Å
297	S	97.7	Very high	94.5	Very high	45 Å²	45	50.5 Å²	50.5	32%	0.315	25%	0.246	S	C	.	.	P	Polyproline II helix	trans	-72.4	170.2	172	67.6	0	0	0	0	111.2	D299 D300 L301	S297-D299 PolarHBondContact O-N 3.16Å; S297-D299 PolarHBondContact OG-N 3.25Å; S297-D300 PolarHBondContact N-OD2 3.15Å; S297-D300 WeakPolarHBondContact O-CB 3.24Å; S297-D300 PolarHBondContact O-N 3.32Å; S297-D300 VanDerWaalsContact O-N 3.08Å; S297-D300 PolarHBondContact OG-N 2.97Å; S297-D300 PolarHBondContact OG-OD2 3.33Å; S297-L301 WeakPolarHBondContact O-CG 3.16Å; S297-L301 PolarHBondContact O-N 3.45Å
298	Q	97.5	Very high	94.6	Very high	123 Å²	123	50.4 Å²	50.4	58%	0.575	25%	0.246	S	C	*	.	H	α-helix	trans	-54.6	-40.4	170.9	-176.7	171.6	-19.4	0	0	112.4	D300 L301 V302 T341	Q298-D300 PolarHBondContact O-N 3.26Å; Q298-L301 WeakPolarHBondContact O-CB 3.23Å; Q298-L301 PolarHBondContact O-N 3.01Å; Q298-L301 VanDerWaalsContact O-N 3.16Å; Q298-V302 WeakPolarHBondContact O-CG2 3.07Å; Q298-V302 PolarHBondContact O-N 3.31Å; Q298-T341 HydrophobicContact CB-CG2 4.47Å
299	D	97.3	Very high	94.7	Very high	112 Å²	112	50.3 Å²	50.3	60%	0.599	25%	0.245	S	C	*	.	H	α-helix	trans	-63.5	-40.3	175.6	-65.8	-25.2	0	0	0	112.4	S297 L301 V302 Q303	S297-D299 PolarHBondContact O-N 3.16Å; S297-D299 PolarHBondContact OG-N 3.25Å; D299-L301 VanDerWaalsContact C-N 3.29Å; D299-L301 PolarHBondContact O-N 3.49Å; D299-V302 PolarHBondContact O-N 3.46Å; D299-Q303 WeakPolarHBondContact O-CB 3.23Å; D299-Q303 WeakPolarHBondContact O-CG 3.5Å; D299-Q303 PolarHBondContact O-N 3.14Å
300	D	98.1	Very high	94.9	Very high	7 Å²	7	49 Å²	49	4%	0.037	24%	0.239	C	C	.	.	H	α-helix	trans	-63.1	-38.3	174.4	-66.5	-36.3	0	0	0	110.5	L247 H256 H289 L296 S297 Q298 Q303 T304	L247-D300 HydrophobicContact CD1-CB 4.17Å; H256-D300 IonicContact CE1-OD1 3.19Å; H256-D300 PolarHBondContact CE1-OD1 2.9Å; H256-D300 IonicContact ND1-OD1 2.74Å; H256-D300 PolarHBondContact ND1-OD1 3.03Å; H289-D300 IonicContact CD2-OD2 3.86Å; H289-D300 IonicContact CE1-OD2 3.8Å; H289-D300 IonicContact NE2-OD1 3.16Å; H289-D300 IonicContact NE2-OD2 3.64Å; H289-D300 PolarHBondContact NE2-OD2 2.85Å; L296-D300 WeakPolarHBondContact CA-OD2 3.5Å; L296-D300 HydrophobicContact CB-CB 3.7Å; L296-D300 HydrophobicContact CD1-CB 4.3Å; L296-D300 HydrophobicContact CD2-CB 3.97Å; L296-D300 HydrophobicContact CG-CB 4.18Å; S297-D300 PolarHBondContact N-OD2 3.15Å; S297-D300 WeakPolarHBondContact O-CB 3.24Å; S297-D300 PolarHBondContact O-N 3.32Å; S297-D300 VanDerWaalsContact O-N 3.08Å; S297-D300 PolarHBondContact OG-N 2.97Å; S297-D300 PolarHBondContact OG-OD2 3.33Å; Q298-D300 PolarHBondContact O-N 3.26Å; D300-Q303 CarbonylContact O-C 3.55Å; D300-Q303 PolarHBondContact O-N 3.25Å; D300-T304 WeakPolarHBondContact O-CB 3.21Å; D300-T304 VanDerWaalsContact O-CG2 3.31Å; D300-T304 WeakPolarHBondContact O-CG2 3.32Å; D300-T304 PolarHBondContact O-N 3.42Å; D300-T304 PolarHBondContact O-OG1 3.21Å
301	L	98.6	Very high	95.6	Very high	1 Å²	1	42 Å²	42	1%	0.005	21%	0.214	C	C	.	.	H	α-helix	trans	-66.4	-40.6	176.6	-64.5	179.3	0	0	0	112.2	L296 S297 Q298 D299 Q303 T304 I305 G306 T341 L342 Y345	L296-L301 HydrophobicContact CB-CD2 4.09Å; L296-L301 HydrophobicContact CB-CG 4.45Å; L296-L301 HydrophobicContact CD1-CD2 4.27Å; S297-L301 WeakPolarHBondContact O-CG 3.16Å; S297-L301 PolarHBondContact O-N 3.45Å; Q298-L301 WeakPolarHBondContact O-CB 3.23Å; Q298-L301 PolarHBondContact O-N 3.01Å; Q298-L301 VanDerWaalsContact O-N 3.16Å; D299-L301 VanDerWaalsContact C-N 3.29Å; D299-L301 PolarHBondContact O-N 3.49Å; L301-Q303 VanDerWaalsContact C-N 3.33Å; L301-Q303 PolarHBondContact O-N 2.96Å; L301-T304 WeakPolarHBondContact CA-OG1 3.45Å; L301-T304 PolarHBondContact O-N 3.18Å; L301-T304 PolarHBondContact O-OG1 2.94Å; L301-I305 HydrophobicContact CD2-CD1 3.9Å; L301-I305 PolarHBondContact O-N 3.21Å; L301-G306 PolarHBondContact O-N 2.76Å; L301-T341 HydrophobicContact CD1-CG2 3.98Å; L301-L342 HydrophobicContact CD1-CB 4.46Å; L301-L342 HydrophobicContact CD1-CD1 3.89Å; L301-L342 HydrophobicContact CD2-CD1 3.78Å; L301-Y345 HydrophobicContact CB-CD1 3.7Å; L301-Y345 HydrophobicContact CB-CE1 3.89Å; L301-Y345 HydrophobicContact CB-CG 4.06Å; L301-Y345 HydrophobicContact CD1-CD1 4.19Å; L301-Y345 HydrophobicContact CD1-CG 4.22Å; L301-Y345 PolarHBondContact O-OH 3.39Å
302	V	98.2	Very high	96.5	Very high	29 Å²	29	33.5 Å²	33.5	18%	0.176	18%	0.183	C	C	.	.	I	π-helix	trans	-57.3	-49	170.9	171.6	0	0	0	0	110.3	Q298 D299 T304 G306 V307 Y345 F378	Q298-V302 WeakPolarHBondContact O-CG2 3.07Å; Q298-V302 PolarHBondContact O-N 3.31Å; D299-V302 PolarHBondContact O-N 3.46Å; V302-T304 PolarHBondContact O-N 2.04Å; V302-G306 CarbonylContact O-C 3.53Å; V302-G306 WeakPolarHBondContact O-CA 3.44Å; V302-G306 PolarHBondContact O-N 2.84Å; V302-V307 PolarHBondContact O-N 2.88Å; V302-V307 VanDerWaalsContact O-N 3.13Å; V302-Y345 WeakPolarHBondContact CA-OH 3.46Å; V302-Y345 HydrophobicContact CB-CE2 4.49Å; V302-Y345 HydrophobicContact CG2-CD2 4.4Å; V302-Y345 HydrophobicContact CG2-CE2 3.58Å; V302-F378 HydrophobicContact CG1-CD1 4.35Å; V302-F378 HydrophobicContact CG1-CD2 4.36Å; V302-F378 HydrophobicContact CG1-CE1 3.98Å; V302-F378 HydrophobicContact CG1-CE2 4.02Å; V302-F378 HydrophobicContact CG1-CZ 3.8Å
303	Q	98.1	Very high	97.1	Very high	32 Å²	32	29.7 Å²	29.7	15%	0.15	16%	0.156	C	C	.	.	I	π-helix	trans	-78.7	-2.2	-176.1	-65	-167	74.5	0	0	114.7	P253 H256 Q257 V260 D299 D300 L301 V307	P253-Q303 PolarHBondContact O-NE2 3.41Å; P253-Q303 PolarHBondContact O-OE1 3.38Å; H256-Q303 HydrophobicContact CB-CB 3.78Å; H256-Q303 HydrophobicContact CB-CG 4.41Å; Q257-Q303 HydrophobicContact CB-CB 4.45Å; Q257-Q303 HydrophobicContact CB-CG 4.25Å; V260-Q303 VanDerWaalsContact CG2-O 3.3Å; V260-Q303 WeakPolarHBondContact CG2-O 3.27Å; D299-Q303 WeakPolarHBondContact O-CB 3.23Å; D299-Q303 WeakPolarHBondContact O-CG 3.5Å; D299-Q303 PolarHBondContact O-N 3.14Å; D300-Q303 CarbonylContact O-C 3.55Å; D300-Q303 PolarHBondContact O-N 3.25Å; L301-Q303 VanDerWaalsContact C-N 3.33Å; L301-Q303 PolarHBondContact O-N 2.96Å; Q303-V307 WeakPolarHBondContact O-CG2 3.37Å
304	T	98.6	Very high	97.6	Very high	1 Å²	1	27.9 Å²	27.9	1%	0.006	14%	0.137	C	C	.	.	I	π-helix	trans	-117.8	-73.1	175.8	53.2	0	0	0	0	111.8	L247 V260 L296 D300 L301 V302 S308	L247-T304 HydrophobicContact CD1-CG2 4.02Å; L247-T304 HydrophobicContact CD2-CG2 3.96Å; L247-T304 HydrophobicContact CG-CG2 3.91Å; V260-T304 HydrophobicContact CG2-CG2 4.08Å; L296-T304 HydrophobicContact CD1-CG2 4.48Å; D300-T304 WeakPolarHBondContact O-CB 3.21Å; D300-T304 VanDerWaalsContact O-CG2 3.31Å; D300-T304 WeakPolarHBondContact O-CG2 3.32Å; D300-T304 PolarHBondContact O-N 3.42Å; D300-T304 PolarHBondContact O-OG1 3.21Å; L301-T304 WeakPolarHBondContact CA-OG1 3.45Å; L301-T304 PolarHBondContact O-N 3.18Å; L301-T304 PolarHBondContact O-OG1 2.94Å; V302-T304 PolarHBondContact O-N 2.04Å; T304-S308 PolarHBondContact O-N 3.41Å; T304-S308 VanDerWaalsContact O-N 3.11Å; T304-S308 PolarHBondContact O-OG 2.62Å
305	I	98.8	Very high	97.8	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	11%	0.108	C	C	.	.	I	π-helix	trans	-67.2	-42.2	-179.8	-59.1	179.3	0	0	0	110.3	F31 V285 L301 S308 A309 V316 L318 L342 Y345 V349	F31-I305 HydrophobicContact CE1-CG2 3.7Å; F31-I305 HydrophobicContact CZ-CG2 3.82Å; V285-I305 HydrophobicContact CG1-CG1 4.37Å; V285-I305 HydrophobicContact CG2-CG1 4.28Å; L301-I305 HydrophobicContact CD2-CD1 3.9Å; L301-I305 PolarHBondContact O-N 3.21Å; I305-S308 WeakPolarHBondContact O-CB 3.25Å; I305-S308 PolarHBondContact O-N 3.36Å; I305-A309 PolarHBondContact O-N 2.97Å; I305-V316 HydrophobicContact CD1-CG2 4.43Å; I305-V316 HydrophobicContact CG1-CG1 4.47Å; I305-V316 HydrophobicContact CG1-CG2 4.2Å; I305-V316 HydrophobicContact CG2-CG2 4.19Å; I305-L318 HydrophobicContact CD1-CD2 3.93Å; I305-L342 HydrophobicContact CD1-CD1 3.94Å; I305-Y345 HydrophobicContact CB-CE1 3.83Å; I305-Y345 HydrophobicContact CG2-CE1 3.9Å; I305-V349 HydrophobicContact CG2-CG1 4.11Å
306	G	98.1	Very high	97.8	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	10%	0.101	C	C	.	.	I	π-helix	trans	-62	-45.1	178.6	0	0	0	0	0	112.9	L301 V302 S308 A309 A310 Y345	L301-G306 PolarHBondContact O-N 2.76Å; V302-G306 CarbonylContact O-C 3.53Å; V302-G306 WeakPolarHBondContact O-CA 3.44Å; V302-G306 PolarHBondContact O-N 2.84Å; G306-S308 VanDerWaalsContact C-N 3.27Å; G306-S308 PolarHBondContact O-N 3.01Å; G306-A309 PolarHBondContact O-N 2.84Å; G306-A310 VanDerWaalsContact O-CB 3.31Å; G306-A310 WeakPolarHBondContact O-CB 3.17Å; G306-A310 PolarHBondContact O-N 3.37Å; G306-Y345 WeakPolarHBondContact CA-OH 3.4Å; G306-Y345 PolarHBondContact N-OH 3.02Å; G306-Y345 VanDerWaalsContact N-OH 3.07Å
307	V	98.2	Very high	97.9	Very high	1 Å²	1	18.2 Å²	18.2	1%	0.006	10%	0.099	C	C	.	.	H	α-helix	trans	-60.5	-40.2	174.4	-179	0	0	0	0	110.9	Q257 V260 R261 L264 V302 Q303 A310 L311 F378	Q257-V307 HydrophobicContact CB-CG2 4.33Å; Q257-V307 HydrophobicContact CG-CG2 3.76Å; V260-V307 HydrophobicContact CB-CG1 4.33Å; V260-V307 HydrophobicContact CG1-CB 3.92Å; V260-V307 HydrophobicContact CG1-CG1 3.85Å; R261-V307 HydrophobicContact CB-CG1 4.18Å; L264-V307 HydrophobicContact CD1-CG1 4.17Å; V302-V307 PolarHBondContact O-N 2.88Å; V302-V307 VanDerWaalsContact O-N 3.13Å; Q303-V307 WeakPolarHBondContact O-CG2 3.37Å; V307-A310 PolarHBondContact O-N 3.43Å; V307-L311 HydrophobicContact CG1-CD1 3.91Å; V307-L311 HydrophobicContact CG1-CG 4.41Å; V307-L311 WeakPolarHBondContact O-CG 3.4Å; V307-L311 PolarHBondContact O-N 3.24Å; V307-F378 HydrophobicContact CG2-CE1 3.79Å; V307-F378 HydrophobicContact CG2-CZ 4.28Å
308	S	98.6	Very high	97.9	Very high	0 Å²	0	16 Å²	16	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-60.8	-48.4	177.5	-56	0	0	0	0	111.9	I245 T304 I305 G306 A313	I245-S308 WeakPolarHBondContact CD1-OG 3.33Å; T304-S308 PolarHBondContact O-N 3.41Å; T304-S308 VanDerWaalsContact O-N 3.11Å; T304-S308 PolarHBondContact O-OG 2.62Å; I305-S308 WeakPolarHBondContact O-CB 3.25Å; I305-S308 PolarHBondContact O-N 3.36Å; G306-S308 VanDerWaalsContact C-N 3.27Å; G306-S308 PolarHBondContact O-N 3.01Å; S308-A313 WeakPolarHBondContact O-CB 3.3Å; S308-A313 PolarHBondContact O-N 3.37Å
309	A	97.9	Very high	97.9	Very high	3 Å²	3	11.9 Å²	11.9	3%	0.025	6%	0.063	C	C	.	.	H	α-helix	trans	-64.1	-45.5	176.5	0	0	0	0	0	111.7	F31 I305 G306 L311 G312 V349 L379	F31-A309 HydrophobicContact CD1-CB 4.11Å; F31-A309 HydrophobicContact CD2-CB 3.81Å; F31-A309 HydrophobicContact CE1-CB 4.06Å; F31-A309 HydrophobicContact CE2-CB 3.77Å; F31-A309 HydrophobicContact CG-CB 3.98Å; F31-A309 HydrophobicContact CZ-CB 3.88Å; I305-A309 PolarHBondContact O-N 2.97Å; G306-A309 PolarHBondContact O-N 2.84Å; A309-L311 VanDerWaalsContact C-N 3.26Å; A309-L311 PolarHBondContact O-N 2.78Å; A309-G312 PolarHBondContact O-N 2.9Å; A309-V349 HydrophobicContact CB-CG2 3.45Å; A309-V349 VanDerWaalsContact CB-CG2 3.45Å; A309-L379 HydrophobicContact CB-CD1 4.46Å
310	A	97.1	Very high	97.8	Very high	0 Å²	0	6.6 Å²	6.6	0%	0	4%	0.035	C	C	.	.	H	α-helix	trans	-62.8	-30	-177.7	0	0	0	0	0	113.2	G306 V307 G312 A368 R369 F378 F393	G306-A310 VanDerWaalsContact O-CB 3.31Å; G306-A310 WeakPolarHBondContact O-CB 3.17Å; G306-A310 PolarHBondContact O-N 3.37Å; V307-A310 PolarHBondContact O-N 3.43Å; A310-G312 VanDerWaalsContact C-N 3.3Å; A310-A368 CarbonylContact O-C 3.51Å; A310-A368 WeakPolarHBondContact O-CA 3.22Å; A310-R369 WeakPolarHBondContact O-CB 3.31Å; A310-R369 PolarHBondContact O-N 3.32Å; A310-F378 HydrophobicContact CB-CD1 4.28Å; A310-F393 HydrophobicContact CB-CE1 4.38Å
311	L	96.8	Very high	97.5	Very high	17 Å²	17	8.7 Å²	8.7	9%	0.089	5%	0.046	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.2	1.5	175.8	-64.2	175.7	0	0	0	113.6	R261 L264 F268 V307 A309	R261-L311 HydrophobicContact CB-CD1 4.43Å; R261-L311 HydrophobicContact CG-CD1 4.13Å; L264-L311 HydrophobicContact CB-CD1 3.75Å; L264-L311 HydrophobicContact CD1-CD1 3.85Å; L264-L311 HydrophobicContact CG-CD1 4.47Å; F268-L311 HydrophobicContact CE2-CB 3.78Å; F268-L311 WeakPolarHBondContact CE2-O 3.31Å; F268-L311 HydrophobicContact CZ-CB 4.48Å; F268-L311 WeakPolarHBondContact CZ-O 3.24Å; V307-L311 HydrophobicContact CG1-CD1 3.91Å; V307-L311 HydrophobicContact CG1-CG 4.41Å; V307-L311 WeakPolarHBondContact O-CG 3.4Å; V307-L311 PolarHBondContact O-N 3.24Å; A309-L311 VanDerWaalsContact C-N 3.26Å; A309-L311 PolarHBondContact O-N 2.78Å
312	G	96	Very high	97.1	Very high	4 Å²	4	13.6 Å²	13.6	4%	0.041	7%	0.072	C	C	.	.	T	Hydrogen-bonded Turn	trans	80.1	27	178.3	0	0	0	0	0	114.3	A309 A310	A309-G312 PolarHBondContact O-N 2.9Å; A310-G312 VanDerWaalsContact C-N 3.3Å
313	A	97.6	Very high	96.9	Very high	1 Å²	1	15 Å²	15	1%	0.008	8%	0.082	C	C	.	.			trans	-61.2	154.2	172.2	0	0	0	0	0	110.6	F31 F268 S308 G315	F31-A313 HydrophobicContact CE2-CB 4.44Å; F268-A313 HydrophobicContact CZ-CB 4.17Å; S308-A313 WeakPolarHBondContact O-CB 3.3Å; S308-A313 PolarHBondContact O-N 3.37Å; A313-G315 PolarHBondContact O-N 3.46Å
314	A	97.3	Very high	96.7	Very high	6 Å²	6	13.7 Å²	13.7	5%	0.05	8%	0.077	C	C	.	.	S	Bend	trans	-68.5	-26.4	175.2	0	0	0	0	0	113	S32 P280 V281 L282	S32-A314 PolarHBondContact N-O 3.1Å; P280-A314 HydrophobicContact CB-CB 3.76Å; V281-A314 WeakPolarHBondContact O-CB 3.4Å; V281-A314 PolarHBondContact O-N 2.95Å; L282-A314 HydrophobicContact CD1-CB 4.29Å; L282-A314 HydrophobicContact CG-CB 4.16Å
315	G	97.8	Very high	96.6	Very high	0 Å²	0	13.7 Å²	13.7	0%	0	8%	0.077	C	C	.	.	E	Extended strand (participates in β ladder)	trans	167.6	-169.5	-178.1	0	0	0	0	0	112.4	S32 V281 L282 A283 A313	S32-G315 CarbonylContact O-C 3.43Å; S32-G315 WeakPolarHBondContact O-CA 3.39Å; V281-G315 PolarHBondContact O-N 2.95Å; L282-G315 WeakPolarHBondContact CA-O 2.88Å; A283-G315 PolarHBondContact N-O 3.32Å; A283-G315 VanDerWaalsContact N-O 3.08Å; A313-G315 PolarHBondContact O-N 3.46Å
316	V	98.8	Very high	96.5	Very high	0 Å²	0	17.3 Å²	17.3	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	148.7	172.2	-66.2	0	0	0	0	110.2	F31 S32 V33 L34 A283 V285 I305 L318	F31-V316 HydrophobicContact CE1-CG2 4.48Å; F31-V316 HydrophobicContact CE2-CG1 4.33Å; F31-V316 HydrophobicContact CZ-CG1 3.81Å; F31-V316 HydrophobicContact CZ-CG2 4.2Å; S32-V316 PolarHBondContact O-N 3.48Å; V33-V316 HydrophobicContact CB-CG2 4.29Å; V33-V316 HydrophobicContact CG1-CG2 4.01Å; V33-V316 HydrophobicContact CG2-CG2 3.96Å; L34-V316 PolarHBondContact N-O 2.84Å; A283-V316 HydrophobicContact CB-CG1 4.31Å; A283-V316 CarbonylContact O-C 3.51Å; A283-V316 WeakPolarHBondContact O-CA 3.23Å; A283-V316 WeakPolarHBondContact O-CB 3.47Å; V285-V316 HydrophobicContact CG2-CB 4.02Å; V285-V316 HydrophobicContact CG2-CG1 3.92Å; I305-V316 HydrophobicContact CD1-CG2 4.43Å; I305-V316 HydrophobicContact CG1-CG1 4.47Å; I305-V316 HydrophobicContact CG1-CG2 4.2Å; I305-V316 HydrophobicContact CG2-CG2 4.19Å; V316-L318 HydrophobicContact CG2-CD2 4.34Å
317	V	98.7	Very high	96.4	Very high	0 Å²	0	19.1 Å²	19.1	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	112.8	168.8	-177.1	0	0	0	0	107.7	L34 N36 M70 L282 A283 Y284 V285	L34-V317 HydrophobicContact CB-CG2 4.39Å; L34-V317 HydrophobicContact CD1-CG2 4.37Å; N36-V317 HydrophobicContact CB-CG1 3.48Å; N36-V317 VanDerWaalsContact CB-CG1 3.48Å; M70-V317 HydrophobicContact CE-CG1 4.31Å; M70-V317 HydrophobicContact CE-CG2 4.48Å; L282-V317 HydrophobicContact CB-CG2 4.28Å; A283-V317 PolarHBondContact O-N 3.08Å; Y284-V317 WeakPolarHBondContact CA-O 3.03Å; Y284-V317 HydrophobicContact CD1-CB 4.12Å; Y284-V317 HydrophobicContact CD1-CG1 4.03Å; Y284-V317 HydrophobicContact CD2-CB 3.97Å; Y284-V317 HydrophobicContact CD2-CG1 4.5Å; Y284-V317 HydrophobicContact CD2-CG2 4.25Å; Y284-V317 HydrophobicContact CE1-CB 4.07Å; Y284-V317 HydrophobicContact CE1-CG1 3.57Å; Y284-V317 HydrophobicContact CE2-CB 3.91Å; Y284-V317 HydrophobicContact CE2-CG1 4.08Å; Y284-V317 HydrophobicContact CE2-CG2 3.95Å; Y284-V317 HydrophobicContact CG-CB 4.09Å; Y284-V317 HydrophobicContact CG-CG1 4.49Å; V285-V317 PolarHBondContact N-O 3.38Å
318	L	98.6	Very high	96.4	Very high	0 Å²	0	24 Å²	24	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	119.9	175.4	-58.9	178	0	0	0	109.1	V33 L34 W35 N36 I57 V285 L287 I305 V316 L342	V33-L318 HydrophobicContact CG1-CD1 3.46Å; V33-L318 VanDerWaalsContact CG1-CD1 3.46Å; V33-L318 HydrophobicContact CG1-CD2 4.33Å; V33-L318 HydrophobicContact CG1-CG 3.78Å; L34-L318 WeakPolarHBondContact O-CB 3.33Å; L34-L318 PolarHBondContact O-N 2.95Å; W35-L318 HydrophobicContact CE3-CB 4.11Å; W35-L318 HydrophobicContact CE3-CD1 3.85Å; W35-L318 HydrophobicContact CZ3-CB 4.47Å; W35-L318 HydrophobicContact CZ3-CD1 4.05Å; N36-L318 CarbonylContact C-O 3.47Å; N36-L318 VanDerWaalsContact C-O 3.27Å; N36-L318 VanDerWaalsContact CA-O 3.3Å; N36-L318 WeakPolarHBondContact CA-O 3.5Å; N36-L318 PolarHBondContact N-O 2.9Å; I57-L318 HydrophobicContact CD1-CD1 4.32Å; I57-L318 HydrophobicContact CG2-CD1 4.28Å; V285-L318 HydrophobicContact CB-CD2 4.33Å; V285-L318 WeakPolarHBondContact O-CA 3.17Å; L287-L318 HydrophobicContact CD2-CB 4.1Å; L287-L318 HydrophobicContact CD2-CD1 4.36Å; L287-L318 HydrophobicContact CD2-CD2 3.98Å; L287-L318 HydrophobicContact CD2-CG 4.37Å; I305-L318 HydrophobicContact CD1-CD2 3.93Å; V316-L318 HydrophobicContact CG2-CD2 4.34Å; L318-L342 HydrophobicContact CD1-CD2 3.74Å
319	W	97.4	Very high	96.4	Very high	36 Å²	36	30.2 Å²	30.2	14%	0.136	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	145.2	-177.2	-176.2	93.9	0	0	0	111.2	Y74 Y246 Y284 V285 R286 L287 D321	Y74-W319 PolarHBondContact OH-NE1 3.42Å; Y246-W319 HydrophobicContact CE2-CE3 4.09Å; Y246-W319 HydrophobicContact CE2-CZ3 4.5Å; Y246-W319 AromaticContact CZ-CE3 3.98Å; Y246-W319 VanDerWaalsContact OH-CB 3.24Å; Y246-W319 WeakPolarHBondContact OH-CB 3.24Å; Y246-W319 VanDerWaalsContact OH-CG 3.23Å; Y284-W319 HydrophobicContact CD1-CB 3.99Å; Y284-W319 HydrophobicContact CD1-CG 4.4Å; Y284-W319 HydrophobicContact CE1-CB 4.29Å; Y284-W319 HydrophobicContact CE1-CG 4.45Å; V285-W319 PolarHBondContact O-N 2.98Å; R286-W319 WeakPolarHBondContact CA-O 3.21Å; R286-W319 HydrophobicContact CG-CE3 4.07Å; R286-W319 HydrophobicContact CG-CZ3 4.28Å; R286-W319 VanDerWaalsContact NH1-CZ3 3.29Å; L287-W319 PolarHBondContact N-O 2.8Å; W319-D321 HydrophobicContact CH2-CB 3.85Å; W319-D321 HydrophobicContact CZ2-CB 4.43Å; W319-D321 HydrophobicContact CZ3-CB 4.39Å
320	G	94.2	Very high	96.4	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	18%	0.18	C	C	.	.			trans	-151	158.7	174.2	0	0	0	0	0	109.1	P38	P38-G320 WeakPolarHBondContact CD-O 3.46Å
321	D	91.7	Very high	96.5	Very high	51 Å²	51	33.1 Å²	33.1	27%	0.273	18%	0.18	S	C	.	.			trans	-92.4	175	173.7	58.7	61.9	0	0	0	111	R286 W319 S323 L324	R286-D321 IonicContact CZ-OD2 3.47Å; R286-D321 IonicContact NH1-OD2 2.78Å; R286-D321 IonicContact NH2-OD2 3.24Å; R286-D321 PolarHBondContact NH2-OD2 3.16Å; W319-D321 HydrophobicContact CH2-CB 3.85Å; W319-D321 HydrophobicContact CZ2-CB 4.43Å; W319-D321 HydrophobicContact CZ3-CB 4.39Å; D321-S323 PolarHBondContact O-N 3.26Å; D321-S323 WeakPolarHBondContact OD1-CB 3.29Å; D321-S323 PolarHBondContact OD1-N 3.01Å; D321-S323 VanDerWaalsContact OD1-N 3.11Å; D321-S323 PolarHBondContact OD1-OG 3.43Å; D321-L324 PolarHBondContact O-N 3.03Å
322	L	91.8	Very high	96.5	Very high	105 Å²	105	37.7 Å²	37.7	55%	0.55	20%	0.196	S	C	.	.	G	3₁₀ helix	trans	-60.3	-17	-175.4	-77.3	165.4	0	0	0	114	P38 L324 S325 S326	P38-L322 HydrophobicContact CB-CD2 3.68Å; P38-L322 HydrophobicContact CB-CG 4.32Å; P38-L322 HydrophobicContact CG-CD2 3.78Å; P38-L322 HydrophobicContact CG-CG 3.98Å; L322-L324 PolarHBondContact O-N 3.06Å; L322-S325 CarbonylContact O-C 3.4Å; L322-S325 PolarHBondContact O-N 3.5Å; L322-S325 VanDerWaalsContact O-N 3.11Å; L322-S325 PolarHBondContact O-OG 3.25Å; L322-S326 PolarHBondContact O-N 3.05Å
323	S	93.8	Very high	96.6	Very high	57 Å²	57	41.6 Å²	41.6	40%	0.399	21%	0.213	S	C	.	.	G	3₁₀ helix	trans	-57.8	-36.2	178.6	63.6	0	0	0	0	112.4	D321 S325 S326	D321-S323 PolarHBondContact O-N 3.26Å; D321-S323 WeakPolarHBondContact OD1-CB 3.29Å; D321-S323 PolarHBondContact OD1-N 3.01Å; D321-S323 VanDerWaalsContact OD1-N 3.11Å; D321-S323 PolarHBondContact OD1-OG 3.43Å; S323-S325 PolarHBondContact O-N 2.99Å; S323-S326 WeakPolarHBondContact O-CB 3.46Å; S323-S326 PolarHBondContact O-N 2.95Å; S323-S326 VanDerWaalsContact O-N 3.16Å; S323-S326 PolarHBondContact O-OG 2.88Å
324	L	93.7	Very high	96.7	Very high	5 Å²	5	41.6 Å²	41.6	3%	0.026	21%	0.212	C	C	.	.	G	3₁₀ helix	trans	-67	-2.5	179.6	-58.7	-177.1	0	0	0	114.6	V37 L287 T288 F295 D321 L322 L334	V37-L324 HydrophobicContact CG1-CB 4.45Å; V37-L324 HydrophobicContact CG1-CD1 3.99Å; L287-L324 HydrophobicContact CB-CD1 4.48Å; L287-L324 HydrophobicContact CD1-CD1 4.27Å; T288-L324 HydrophobicContact CG2-CD2 3.94Å; F295-L324 HydrophobicContact CE1-CD1 4.44Å; F295-L324 HydrophobicContact CE1-CD2 3.88Å; F295-L324 HydrophobicContact CZ-CD2 3.95Å; D321-L324 PolarHBondContact O-N 3.03Å; L322-L324 PolarHBondContact O-N 3.06Å; L324-L334 HydrophobicContact CB-CD2 4.31Å
325	S	95.7	Very high	96.7	Very high	1 Å²	1	43.1 Å²	43.1	1%	0.007	22%	0.219	C	C	.	.	G	3₁₀ helix	trans	-140.9	23.5	179.6	67	0	0	0	0	111.9	P38 L322 S323	P38-S325 PolarHBondContact O-OG 3.44Å; L322-S325 CarbonylContact O-C 3.4Å; L322-S325 PolarHBondContact O-N 3.5Å; L322-S325 VanDerWaalsContact O-N 3.11Å; L322-S325 PolarHBondContact O-OG 3.25Å; S323-S325 PolarHBondContact O-N 2.99Å
326	S	96.2	Very high	96.8	Very high	77 Å²	77	46.4 Å²	46.4	54%	0.538	24%	0.236	S	C	.	.	S	Bend	trans	-82.1	-24.4	-172.5	63.2	0	0	0	0	113.5	L322 S323	L322-S326 PolarHBondContact O-N 3.05Å; S323-S326 WeakPolarHBondContact O-CB 3.46Å; S323-S326 PolarHBondContact O-N 2.95Å; S323-S326 VanDerWaalsContact O-N 3.16Å; S323-S326 PolarHBondContact O-OG 2.88Å
327	S	97.8	Very high	96.7	Very high	37 Å²	37	47.2 Å²	47.2	26%	0.259	24%	0.239	S	C	.	.	S	Bend	trans	-142.5	168.8	177.6	68.5	0	0	0	0	110.8	F46 E329 E330 C331	F46-S327 VanDerWaalsContact CE2-C 3.48Å; S327-E329 VanDerWaalsContact C-N 3.3Å; S327-E329 PolarHBondContact OG-N 2.98Å; S327-E330 PolarHBondContact O-N 3.32Å; S327-E330 WeakPolarHBondContact OG-CG 3.01Å; S327-E330 PolarHBondContact OG-N 2.8Å; S327-E330 VanDerWaalsContact OG-N 3.1Å; S327-C331 PolarHBondContact O-N 3.17Å; S327-C331 VanDerWaalsContact O-N 3.14Å; S327-C331 PolarHBondContact O-SG 3.09Å; S327-C331 VanDerWaalsContact O-SG 3.37Å
328	E	98	Very high	96.7	Very high	104 Å²	104	47.2 Å²	47.2	49%	0.486	24%	0.239	S	C	.	.	H	α-helix	trans	-59.4	-41.9	171.1	-178.1	174.3	-174.3	0	0	111.7	F46 V48 C331 W332	F46-E328 HydrophobicContact CB-CB 4Å; F46-E328 HydrophobicContact CB-CG 4.18Å; F46-E328 HydrophobicContact CD1-CB 3.87Å; F46-E328 HydrophobicContact CG-CB 3.99Å; V48-E328 HydrophobicContact CG2-CG 4.27Å; E328-C331 WeakPolarHBondContact O-CB 3.33Å; E328-C331 PolarHBondContact O-N 3.4Å; E328-W332 PolarHBondContact O-N 3.4Å
329	E	98	Very high	96.7	Very high	130 Å²	130	50 Å²	50	61%	0.607	26%	0.257	S	S	*	.	H	α-helix	trans	-60.5	-48.3	177.4	-177.8	177.5	-165.1	0	0	112.2	S327 C331 W332 H333	S327-E329 VanDerWaalsContact C-N 3.3Å; S327-E329 PolarHBondContact OG-N 2.98Å; E329-C331 PolarHBondContact O-N 3.11Å; E329-W332 PolarHBondContact O-N 3.15Å; E329-W332 VanDerWaalsContact O-N 3.14Å; E329-H333 PolarHBondContact O-CD2 3.27Å; E329-H333 PolarHBondContact O-N 3.05Å; E329-H333 IonicContact OE1-NE2 3.78Å
330	E	97.6	Very high	96.8	Very high	65 Å²	65	53.9 Å²	53.9	30%	0.304	28%	0.28	S	S	.	.	H	α-helix	trans	-62.8	-34.2	177	-71.6	-64.6	157.5	0	0	112	S327 H333 L334	S327-E330 PolarHBondContact O-N 3.32Å; S327-E330 WeakPolarHBondContact OG-CG 3.01Å; S327-E330 PolarHBondContact OG-N 2.8Å; S327-E330 VanDerWaalsContact OG-N 3.1Å; E330-H333 PolarHBondContact O-N 3.18Å; E330-L334 WeakPolarHBondContact O-CB 3.36Å; E330-L334 PolarHBondContact O-N 3.44Å
331	C	98.3	Very high	97	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-68.3	-37.9	174.6	-75.7	0	0	0	0	112.8	C42 V48 S327 E328 E329 L334 H335	C42-C331 WeakPolarHBondContact CA-SG 3.49Å; C42-C331 HydrophobicContact CB-CB 3.65Å; C42-C331 WeakPolarHBondContact CB-SG 3.18Å; C42-C331 WeakPolarHBondContact SG-CB 3.21Å; C42-C331 CovalentContact SG-SG 2.04Å; C42-C331 PolarHBondContact SG-SG 2.86Å; V48-C331 HydrophobicContact CB-CB 3.95Å; V48-C331 HydrophobicContact CG1-CB 4.07Å; V48-C331 HydrophobicContact CG2-CB 4.04Å; S327-C331 PolarHBondContact O-N 3.17Å; S327-C331 VanDerWaalsContact O-N 3.14Å; S327-C331 PolarHBondContact O-SG 3.09Å; S327-C331 VanDerWaalsContact O-SG 3.37Å; E328-C331 WeakPolarHBondContact O-CB 3.33Å; E328-C331 PolarHBondContact O-N 3.4Å; E329-C331 PolarHBondContact O-N 3.11Å; C331-L334 PolarHBondContact O-N 3.5Å; C331-H335 WeakPolarHBondContact O-CB 3.46Å; C331-H335 PolarHBondContact O-N 3.06Å
332	W	98.4	Very high	97.3	Very high	113 Å²	113	53.4 Å²	53.4	43%	0.428	28%	0.279	S	S	.	.	H	α-helix	trans	-68.7	-41.2	172.3	-79.4	118.5	0	0	0	111.8	V48 E328 E329 L334 H335 D336	V48-W332 HydrophobicContact CG1-CD2 3.97Å; V48-W332 HydrophobicContact CG1-CE3 4.04Å; V48-W332 HydrophobicContact CG1-CG 4.47Å; V48-W332 HydrophobicContact CG1-CH2 4.41Å; V48-W332 HydrophobicContact CG1-CZ2 4.35Å; V48-W332 HydrophobicContact CG1-CZ3 4.25Å; V48-W332 HydrophobicContact CG2-CD2 4.16Å; V48-W332 HydrophobicContact CG2-CG 4.32Å; V48-W332 HydrophobicContact CG2-CZ2 4.09Å; E328-W332 PolarHBondContact O-N 3.4Å; E329-W332 PolarHBondContact O-N 3.15Å; E329-W332 VanDerWaalsContact O-N 3.14Å; W332-L334 VanDerWaalsContact C-N 3.29Å; W332-L334 PolarHBondContact O-N 3.42Å; W332-H335 HydrophobicContact CE3-CB 4.03Å; W332-H335 AromaticContact CE3-CG 3.91Å; W332-H335 AromaticContact CE3-ND1 3.84Å; W332-H335 HydrophobicContact CZ3-CB 4.47Å; W332-H335 AromaticContact CZ3-CG 3.92Å; W332-H335 AromaticContact CZ3-ND1 3.8Å; W332-H335 WeakPolarHBondContact O-CB 3.5Å; W332-H335 PolarHBondContact O-N 2.91Å; W332-H335 VanDerWaalsContact O-N 3.1Å; W332-D336 PolarHBondContact O-N 3.24Å
333	H	98	Very high	97.6	Very high	86 Å²	86	48.4 Å²	48.4	40%	0.398	25%	0.252	S	S	.	.	H	α-helix	trans	-58.8	-40.7	172.1	-73.2	-36.8	0	0	0	112.8	F295 E329 E330 Y337	F295-H333 HydrophobicContact CE2-CB 4.3Å; E329-H333 PolarHBondContact O-CD2 3.27Å; E329-H333 PolarHBondContact O-N 3.05Å; E329-H333 IonicContact OE1-NE2 3.78Å; E330-H333 PolarHBondContact O-N 3.18Å; H333-Y337 WeakPolarHBondContact O-CB 3.02Å; H333-Y337 PolarHBondContact O-N 3.23Å
334	L	98.3	Very high	97.8	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-65.8	-42.4	173.9	-177.9	61.1	0	0	0	111.8	W35 L50 L287 F295 L324 E330 C331 W332 L338	W35-L334 HydrophobicContact CH2-CD1 4.08Å; W35-L334 HydrophobicContact CH2-CD2 4.49Å; W35-L334 HydrophobicContact CZ2-CD2 4.19Å; L50-L334 HydrophobicContact CD1-CD2 3.68Å; L50-L334 HydrophobicContact CD1-CG 4.24Å; L50-L334 HydrophobicContact CD2-CG 4.4Å; L287-L334 HydrophobicContact CD1-CD1 4.1Å; F295-L334 HydrophobicContact CE1-CD1 3.87Å; F295-L334 HydrophobicContact CZ-CB 4.34Å; F295-L334 HydrophobicContact CZ-CD1 3.98Å; L324-L334 HydrophobicContact CB-CD2 4.31Å; E330-L334 WeakPolarHBondContact O-CB 3.36Å; E330-L334 PolarHBondContact O-N 3.44Å; C331-L334 PolarHBondContact O-N 3.5Å; W332-L334 VanDerWaalsContact C-N 3.29Å; W332-L334 PolarHBondContact O-N 3.42Å; L334-L338 HydrophobicContact CG-CD1 4.39Å; L334-L338 WeakPolarHBondContact O-CB 3.36Å; L334-L338 VanDerWaalsContact O-CG 3.23Å; L334-L338 WeakPolarHBondContact O-CG 3.46Å; L334-L338 PolarHBondContact O-N 3.17Å
335	H	98.4	Very high	98	Very high	39 Å²	39	49.1 Å²	49.1	18%	0.181	26%	0.255	C	S	.	.	H	α-helix	trans	-57.9	-51.1	175.4	170.9	-84.4	0	0	0	111.3	V48 H49 L50 C331 W332 Y337 L338 V339	V48-H335 HydrophobicContact CG1-CB 4.28Å; H49-H335 PolarHBondContact O-CD2 3.25Å; H49-H335 VanDerWaalsContact O-CD2 3.29Å; L50-H335 HydrophobicContact CD2-CB 3.88Å; C331-H335 WeakPolarHBondContact O-CB 3.46Å; C331-H335 PolarHBondContact O-N 3.06Å; W332-H335 HydrophobicContact CE3-CB 4.03Å; W332-H335 AromaticContact CE3-CG 3.91Å; W332-H335 AromaticContact CE3-ND1 3.84Å; W332-H335 HydrophobicContact CZ3-CB 4.47Å; W332-H335 AromaticContact CZ3-CG 3.92Å; W332-H335 AromaticContact CZ3-ND1 3.8Å; W332-H335 WeakPolarHBondContact O-CB 3.5Å; W332-H335 PolarHBondContact O-N 2.91Å; W332-H335 VanDerWaalsContact O-N 3.1Å; H335-Y337 PolarHBondContact O-N 3.33Å; H335-L338 WeakPolarHBondContact O-CB 3.22Å; H335-L338 PolarHBondContact O-N 3.42Å; H335-L338 VanDerWaalsContact O-N 3.08Å; H335-V339 WeakPolarHBondContact O-CG2 3.24Å; H335-V339 PolarHBondContact O-N 2.83Å
336	D	98.5	Very high	98.1	Very high	69 Å²	69	49.1 Å²	49.1	37%	0.369	25%	0.254	S	S	.	.	H	α-helix	trans	-65.2	-42.6	-176.5	-62.4	-12.6	0	0	0	110.3	W332 L338 V339 D340	W332-D336 PolarHBondContact O-N 3.24Å; D336-L338 VanDerWaalsContact C-N 3.28Å; D336-L338 PolarHBondContact O-N 3.36Å; D336-V339 PolarHBondContact O-N 3.33Å; D336-D340 VanDerWaalsContact O-CB 3.25Å; D336-D340 WeakPolarHBondContact O-CB 3.32Å; D336-D340 VanDerWaalsContact O-CG 3.31Å; D336-D340 PolarHBondContact O-N 2.96Å
337	Y	98.6	Very high	98.1	Very high	16 Å²	16	47.7 Å²	47.7	6%	0.063	24%	0.24	C	C	.	.	H	α-helix	trans	-59.1	-37.8	173	176.1	-111.6	0	0	0	113.2	L287 F295 L296 H333 H335 T341 L342	L287-Y337 HydrophobicContact CD2-CE1 4.33Å; F295-Y337 HydrophobicContact CB-CD1 4.17Å; F295-Y337 HydrophobicContact CB-CD2 3.48Å; F295-Y337 VanDerWaalsContact CB-CD2 3.48Å; F295-Y337 HydrophobicContact CB-CE1 4.15Å; F295-Y337 HydrophobicContact CB-CE2 3.5Å; F295-Y337 HydrophobicContact CB-CG 3.83Å; F295-Y337 AromaticContact CD1-CD1 3.39Å; F295-Y337 HydrophobicContact CD1-CD1 3.39Å; F295-Y337 HydrophobicContact CD1-CD2 4.26Å; F295-Y337 AromaticContact CD1-CE1 3.65Å; F295-Y337 HydrophobicContact CD1-CE1 3.65Å; F295-Y337 HydrophobicContact CD1-CE2 4.49Å; F295-Y337 AromaticContact CD1-CG 3.71Å; F295-Y337 HydrophobicContact CD1-CG 3.71Å; F295-Y337 HydrophobicContact CD2-CD1 4.32Å; F295-Y337 HydrophobicContact CD2-CD2 4.13Å; F295-Y337 AromaticContact CD2-CG 3.79Å; F295-Y337 HydrophobicContact CD2-CG 3.79Å; F295-Y337 AromaticContact CE1-CD1 3.78Å; F295-Y337 HydrophobicContact CE1-CD1 3.78Å; F295-Y337 HydrophobicContact CE1-CE1 4.34Å; F295-Y337 HydrophobicContact CE1-CG 4.2Å; F295-Y337 HydrophobicContact CE2-CG 4.27Å; F295-Y337 AromaticContact CG-CD1 3.71Å; F295-Y337 HydrophobicContact CG-CD1 3.71Å; F295-Y337 AromaticContact CG-CD2 3.72Å; F295-Y337 HydrophobicContact CG-CD2 3.72Å; F295-Y337 HydrophobicContact CG-CE1 4.08Å; F295-Y337 HydrophobicContact CG-CE2 4.11Å; F295-Y337 AromaticContact CG-CG 3.49Å; F295-Y337 HydrophobicContact CG-CG 3.49Å; F295-Y337 VanDerWaalsContact CG-CG 3.49Å; F295-Y337 HydrophobicContact CZ-CD1 4.39Å; F295-Y337 HydrophobicContact CZ-CG 4.46Å; L296-Y337 WeakPolarHBondContact O-CE2 3.36Å; L296-Y337 PolarHBondContact O-OH 2.99Å; H333-Y337 WeakPolarHBondContact O-CB 3.02Å; H333-Y337 PolarHBondContact O-N 3.23Å; H335-Y337 PolarHBondContact O-N 3.33Å; Y337-T341 HydrophobicContact CD2-CG2 4.3Å; Y337-T341 HydrophobicContact CE2-CG2 3.71Å; Y337-T341 PolarHBondContact O-N 3.07Å; Y337-T341 VanDerWaalsContact O-N 3.15Å; Y337-L342 HydrophobicContact CD1-CB 4.32Å; Y337-L342 HydrophobicContact CE1-CB 3.83Å; Y337-L342 HydrophobicContact CE1-CD2 4.16Å; Y337-L342 HydrophobicContact CE1-CG 4.5Å; Y337-L342 PolarHBondContact O-N 3.28Å
338	L	98.5	Very high	98.1	Very high	0 Å²	0	48 Å²	48	0%	0	24%	0.239	C	C	.	.	I	π-helix	trans	-65.6	-44.3	175.6	-75.4	171.3	0	0	0	111.8	W35 L50 L52 L55 I57 L334 H335 D336 L342 G343	W35-L338 HydrophobicContact CH2-CD1 4.14Å; W35-L338 HydrophobicContact CH2-CD2 3.88Å; W35-L338 HydrophobicContact CH2-CG 4.39Å; W35-L338 HydrophobicContact CZ3-CD2 3.82Å; L50-L338 HydrophobicContact CB-CD1 3.87Å; L50-L338 HydrophobicContact CD1-CD1 4.18Å; L50-L338 HydrophobicContact CD2-CD1 4.09Å; L50-L338 HydrophobicContact CG-CD1 4.26Å; L52-L338 HydrophobicContact CD2-CD1 3.73Å; L52-L338 HydrophobicContact CD2-CD2 4.08Å; L55-L338 HydrophobicContact CD1-CB 3.92Å; L55-L338 WeakPolarHBondContact CD1-O 3.48Å; I57-L338 HydrophobicContact CD1-CD2 3.96Å; L334-L338 HydrophobicContact CG-CD1 4.39Å; L334-L338 WeakPolarHBondContact O-CB 3.36Å; L334-L338 VanDerWaalsContact O-CG 3.23Å; L334-L338 WeakPolarHBondContact O-CG 3.46Å; L334-L338 PolarHBondContact O-N 3.17Å; H335-L338 WeakPolarHBondContact O-CB 3.22Å; H335-L338 PolarHBondContact O-N 3.42Å; H335-L338 VanDerWaalsContact O-N 3.08Å; D336-L338 VanDerWaalsContact C-N 3.28Å; D336-L338 PolarHBondContact O-N 3.36Å; L338-L342 HydrophobicContact CD2-CB 4.38Å; L338-L342 HydrophobicContact CD2-CD2 3.58Å; L338-L342 HydrophobicContact CD2-CG 4.36Å; L338-G343 WeakPolarHBondContact O-CA 3.26Å; L338-G343 PolarHBondContact O-N 2.03Å
339	V	98.3	Very high	98	Very high	60 Å²	60	43 Å²	43	36%	0.364	22%	0.216	S	C	.	.	I	π-helix	trans	-75.2	-42.1	-176.7	174.7	0	0	0	0	111.6	P51 H335 D336 P344	P51-V339 HydrophobicContact CG-CG2 3.87Å; H335-V339 WeakPolarHBondContact O-CG2 3.24Å; H335-V339 PolarHBondContact O-N 2.83Å; D336-V339 PolarHBondContact O-N 3.33Å; V339-P344 WeakPolarHBondContact O-CD 3.38Å; V339-P344 VanDerWaalsContact O-CG 3.26Å; V339-P344 WeakPolarHBondContact O-CG 3.33Å
340	D	98.1	Very high	97.9	Very high	117 Å²	117	38.1 Å²	38.1	63%	0.626	20%	0.195	S	C	*	.	I	π-helix	trans	-89.2	-29	-168.3	-64	-17.6	0	0	0	113.2	D336	D336-D340 VanDerWaalsContact O-CB 3.25Å; D336-D340 WeakPolarHBondContact O-CB 3.32Å; D336-D340 VanDerWaalsContact O-CG 3.31Å; D336-D340 PolarHBondContact O-N 2.96Å
341	T	98.3	Very high	97.8	Very high	40 Å²	40	42.7 Å²	42.7	25%	0.245	21%	0.209	C	C	.	.	I	π-helix	trans	-128.5	-60.2	-170.4	-55	0	0	0	0	113	Q298 L301 Y337 Y345	Q298-T341 HydrophobicContact CB-CG2 4.47Å; L301-T341 HydrophobicContact CD1-CG2 3.98Å; Y337-T341 HydrophobicContact CD2-CG2 4.3Å; Y337-T341 HydrophobicContact CE2-CG2 3.71Å; Y337-T341 PolarHBondContact O-N 3.07Å; Y337-T341 VanDerWaalsContact O-N 3.15Å; T341-Y345 WeakPolarHBondContact O-CB 3.44Å
342	L	98.6	Very high	97.7	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	21%	0.209	C	C	.	.	I	π-helix	trans	-70.5	-47	-172.3	-179.1	62	0	0	0	112.3	W35 I57 L287 L301 I305 L318 Y337 L338 Y345 V346	W35-L342 HydrophobicContact CZ3-CD2 4.33Å; I57-L342 HydrophobicContact CD1-CD2 4.23Å; L287-L342 HydrophobicContact CD2-CD2 3.74Å; L301-L342 HydrophobicContact CD1-CB 4.46Å; L301-L342 HydrophobicContact CD1-CD1 3.89Å; L301-L342 HydrophobicContact CD2-CD1 3.78Å; I305-L342 HydrophobicContact CD1-CD1 3.94Å; L318-L342 HydrophobicContact CD1-CD2 3.74Å; Y337-L342 HydrophobicContact CD1-CB 4.32Å; Y337-L342 HydrophobicContact CE1-CB 3.83Å; Y337-L342 HydrophobicContact CE1-CD2 4.16Å; Y337-L342 HydrophobicContact CE1-CG 4.5Å; Y337-L342 PolarHBondContact O-N 3.28Å; L338-L342 HydrophobicContact CD2-CB 4.38Å; L338-L342 HydrophobicContact CD2-CD2 3.58Å; L338-L342 HydrophobicContact CD2-CG 4.36Å; L342-Y345 PolarHBondContact O-N 2.94Å; L342-V346 HydrophobicContact CD1-CG2 3.87Å; L342-V346 HydrophobicContact CG-CG2 4.09Å; L342-V346 WeakPolarHBondContact O-CB 3.5Å; L342-V346 VanDerWaalsContact O-CG2 3.3Å; L342-V346 WeakPolarHBondContact O-CG2 3.45Å; L342-V346 PolarHBondContact O-N 3.27Å
343	G	98.3	Very high	97.6	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-59.3	-54.6	-176	0	0	0	0	0	113.7	L338 Y345 V346 I347	L338-G343 WeakPolarHBondContact O-CA 3.26Å; L338-G343 PolarHBondContact O-N 2.03Å; G343-Y345 PolarHBondContact O-N 3.45Å; G343-V346 PolarHBondContact O-N 3.45Å; G343-I347 WeakPolarHBondContact O-CG1 3.36Å; G343-I347 PolarHBondContact O-N 2.8Å
344	P	97.6	Very high	97.5	Very high	66 Å²	66	36.1 Å²	36.1	43%	0.429	19%	0.185	S	C	.	.	H	α-helix	trans	-54.8	-41.2	176.1	-27.6	35.7	0	0	0	112.5	V339 N348	V339-P344 WeakPolarHBondContact O-CD 3.38Å; V339-P344 VanDerWaalsContact O-CG 3.26Å; V339-P344 WeakPolarHBondContact O-CG 3.33Å; P344-N348 WeakPolarHBondContact O-CB 3.17Å; P344-N348 PolarHBondContact O-N 2.95Å
345	Y	98.1	Very high	97.3	Very high	12 Å²	12	36.9 Å²	36.9	5%	0.047	19%	0.191	C	C	.	.	H	α-helix	trans	-68.2	-43	178.2	-176.4	-95.6	0	0	0	112.9	L301 V302 I305 G306 T341 L342 G343 N348 V349 H380	L301-Y345 HydrophobicContact CB-CD1 3.7Å; L301-Y345 HydrophobicContact CB-CE1 3.89Å; L301-Y345 HydrophobicContact CB-CG 4.06Å; L301-Y345 HydrophobicContact CD1-CD1 4.19Å; L301-Y345 HydrophobicContact CD1-CG 4.22Å; L301-Y345 PolarHBondContact O-OH 3.39Å; V302-Y345 WeakPolarHBondContact CA-OH 3.46Å; V302-Y345 HydrophobicContact CB-CE2 4.49Å; V302-Y345 HydrophobicContact CG2-CD2 4.4Å; V302-Y345 HydrophobicContact CG2-CE2 3.58Å; I305-Y345 HydrophobicContact CB-CE1 3.83Å; I305-Y345 HydrophobicContact CG2-CE1 3.9Å; G306-Y345 WeakPolarHBondContact CA-OH 3.4Å; G306-Y345 PolarHBondContact N-OH 3.02Å; G306-Y345 VanDerWaalsContact N-OH 3.07Å; T341-Y345 WeakPolarHBondContact O-CB 3.44Å; L342-Y345 PolarHBondContact O-N 2.94Å; G343-Y345 PolarHBondContact O-N 3.45Å; Y345-N348 WeakPolarHBondContact O-CB 3.01Å; Y345-N348 PolarHBondContact O-N 3.16Å; Y345-V349 HydrophobicContact CE1-CB 4.46Å; Y345-V349 HydrophobicContact CE1-CG1 4.3Å; Y345-V349 WeakPolarHBondContact O-CG1 3.37Å; Y345-V349 PolarHBondContact O-N 3.08Å; Y345-H380 AromaticContact CE2-CE1 3.94Å; Y345-H380 AromaticContact CE2-NE2 3.33Å; Y345-H380 VanDerWaalsContact CE2-NE2 3.33Å; Y345-H380 WeakPolarHBondContact CE2-NE2 3.41Å; Y345-H380 AromaticContact CZ-NE2 3.45Å; Y345-H380 PolarHBondContact OH-NE2 3.32Å
346	V	98.3	Very high	97.2	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-60.7	-45	175.7	167.3	0	0	0	0	111	V33 L55 I57 L342 G343 N348 V349 T350	V33-V346 HydrophobicContact CB-CG1 4.1Å; V33-V346 HydrophobicContact CG1-CG1 4.33Å; V33-V346 HydrophobicContact CG1-CG2 4.06Å; V33-V346 HydrophobicContact CG2-CG1 3.87Å; V33-V346 HydrophobicContact CG2-CG2 4.31Å; L55-V346 WeakPolarHBondContact O-CG1 3.46Å; I57-V346 HydrophobicContact CG1-CG1 4.06Å; I57-V346 HydrophobicContact CG1-CG2 4.46Å; L342-V346 HydrophobicContact CD1-CG2 3.87Å; L342-V346 HydrophobicContact CG-CG2 4.09Å; L342-V346 WeakPolarHBondContact O-CB 3.5Å; L342-V346 VanDerWaalsContact O-CG2 3.3Å; L342-V346 WeakPolarHBondContact O-CG2 3.45Å; L342-V346 PolarHBondContact O-N 3.27Å; G343-V346 PolarHBondContact O-N 3.45Å; V346-N348 VanDerWaalsContact C-N 3.31Å; V346-N348 PolarHBondContact O-N 3.46Å; V346-V349 WeakPolarHBondContact O-CG1 3.47Å; V346-V349 PolarHBondContact O-N 3.29Å; V346-T350 HydrophobicContact CG1-CG2 4.17Å; V346-T350 WeakPolarHBondContact O-CB 3.49Å; V346-T350 VanDerWaalsContact O-CG2 3.25Å; V346-T350 WeakPolarHBondContact O-CG2 3.42Å; V346-T350 PolarHBondContact O-N 2.68Å; V346-T350 PolarHBondContact O-OG1 2.97Å
347	I	96.4	Very high	97.1	Very high	47 Å²	47	31.9 Å²	31.9	24%	0.241	17%	0.166	C	C	.	.	H	α-helix	trans	-59.8	-44.7	176.5	-68.5	166.7	0	0	0	110.3	L55 G343 T350 R351	L55-I347 HydrophobicContact CD2-CD1 4.17Å; G343-I347 WeakPolarHBondContact O-CG1 3.36Å; G343-I347 PolarHBondContact O-N 2.8Å; I347-T350 PolarHBondContact O-OG1 2.76Å; I347-R351 HydrophobicContact CG2-CG 4.39Å; I347-R351 VanDerWaalsContact O-CB 3.26Å; I347-R351 WeakPolarHBondContact O-CB 3.19Å; I347-R351 VanDerWaalsContact O-CG 3.24Å; I347-R351 WeakPolarHBondContact O-CG 3.26Å; I347-R351 PolarHBondContact O-N 3.37Å; I347-R351 VanDerWaalsContact O-N 3.08Å
348	N	96.6	Very high	96.8	Very high	44 Å²	44	36.3 Å²	36.3	24%	0.235	19%	0.187	C	C	.	.	H	α-helix	trans	-59.7	-56.4	179.3	-175.6	-51.6	0	0	0	111.4	P344 Y345 V346 T350 R351 A352 H380 L381	P344-N348 WeakPolarHBondContact O-CB 3.17Å; P344-N348 PolarHBondContact O-N 2.95Å; Y345-N348 WeakPolarHBondContact O-CB 3.01Å; Y345-N348 PolarHBondContact O-N 3.16Å; V346-N348 VanDerWaalsContact C-N 3.31Å; V346-N348 PolarHBondContact O-N 3.46Å; N348-T350 PolarHBondContact O-N 2.65Å; N348-R351 PolarHBondContact O-N 3.16Å; N348-A352 WeakPolarHBondContact O-CB 3.48Å; N348-A352 PolarHBondContact O-N 3.19Å; N348-H380 WeakPolarHBondContact OD1-CA 2.96Å; N348-H380 WeakPolarHBondContact OD1-CB 3.38Å; N348-L381 PolarHBondContact OD1-N 3.2Å
349	V	96.9	Very high	96.6	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-66.9	-37.6	-174.3	70.5	0	0	0	0	112.6	F31 I305 A309 Y345 V346 A353	F31-V349 HydrophobicContact CD1-CG1 4.36Å; F31-V349 HydrophobicContact CE1-CG1 4.14Å; F31-V349 HydrophobicContact CE1-CG2 4.43Å; I305-V349 HydrophobicContact CG2-CG1 4.11Å; A309-V349 HydrophobicContact CB-CG2 3.45Å; A309-V349 VanDerWaalsContact CB-CG2 3.45Å; Y345-V349 HydrophobicContact CE1-CB 4.46Å; Y345-V349 HydrophobicContact CE1-CG1 4.3Å; Y345-V349 WeakPolarHBondContact O-CG1 3.37Å; Y345-V349 PolarHBondContact O-N 3.08Å; V346-V349 WeakPolarHBondContact O-CG1 3.47Å; V346-V349 PolarHBondContact O-N 3.29Å; V349-A353 WeakPolarHBondContact O-CB 3.3Å; V349-A353 PolarHBondContact O-N 3.16Å
350	T	96.3	Very high	96.4	Very high	27 Å²	27	43.5 Å²	43.5	17%	0.166	21%	0.213	C	C	.	.	H	α-helix	trans	-71.4	-41.4	-179.9	54.7	0	0	0	0	111.7	F31 V33 V346 I347 N348 A353 M354	F31-T350 HydrophobicContact CD1-CG2 4.2Å; V33-T350 HydrophobicContact CG2-CG2 4.04Å; V346-T350 HydrophobicContact CG1-CG2 4.17Å; V346-T350 WeakPolarHBondContact O-CB 3.49Å; V346-T350 VanDerWaalsContact O-CG2 3.25Å; V346-T350 WeakPolarHBondContact O-CG2 3.42Å; V346-T350 PolarHBondContact O-N 2.68Å; V346-T350 PolarHBondContact O-OG1 2.97Å; I347-T350 PolarHBondContact O-OG1 2.76Å; N348-T350 PolarHBondContact O-N 2.65Å; T350-A353 PolarHBondContact O-N 2.84Å; T350-M354 WeakPolarHBondContact O-CG 3.39Å; T350-M354 PolarHBondContact O-N 3.33Å
351	R	95.2	Very high	96.3	Very high	161 Å²	161	38 Å²	38	61%	0.608	18%	0.183	S	C	*	.	H	α-helix	trans	-64.3	-42.1	174	-74.5	-178.5	177	-175	1.7	112	I347 N348 M354 A355 L381	I347-R351 HydrophobicContact CG2-CG 4.39Å; I347-R351 VanDerWaalsContact O-CB 3.26Å; I347-R351 WeakPolarHBondContact O-CB 3.19Å; I347-R351 VanDerWaalsContact O-CG 3.24Å; I347-R351 WeakPolarHBondContact O-CG 3.26Å; I347-R351 PolarHBondContact O-N 3.37Å; I347-R351 VanDerWaalsContact O-N 3.08Å; N348-R351 PolarHBondContact O-N 3.16Å; R351-M354 WeakPolarHBondContact O-CB 3.03Å; R351-M354 PolarHBondContact O-N 3.45Å; R351-A355 WeakPolarHBondContact O-CB 3.48Å; R351-A355 PolarHBondContact O-N 2.86Å; R351-L381 HydrophobicContact CB-CD1 4.02Å; R351-L381 HydrophobicContact CB-CD2 4.43Å
352	A	95.9	Very high	96.1	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-63.1	-42.7	175.9	0	0	0	0	0	111.8	N348 A355 C356 L379 L381 W390	N348-A352 WeakPolarHBondContact O-CB 3.48Å; N348-A352 PolarHBondContact O-N 3.19Å; A352-A355 PolarHBondContact O-N 3.2Å; A352-C356 WeakPolarHBondContact O-CB 3.41Å; A352-C356 PolarHBondContact O-N 2.86Å; A352-L379 VanDerWaalsContact CB-C 3.46Å; A352-L379 HydrophobicContact CB-CB 4.26Å; A352-L379 WeakPolarHBondContact CB-O 3.33Å; A352-L381 HydrophobicContact CB-CD2 4.06Å; A352-L381 HydrophobicContact CB-CG 4.34Å; A352-W390 HydrophobicContact CB-CH2 4.24Å
353	A	96.4	Very high	95.8	Very high	5 Å²	5	40.2 Å²	40.2	4%	0.041	19%	0.193	C	C	.	.	H	α-helix	trans	-62.5	-42.6	175.7	0	0	0	0	0	112.5	P30 F31 V349 T350 S357 L379	P30-A353 VanDerWaalsContact CG-C 3.47Å; P30-A353 HydrophobicContact CG-CB 4.04Å; P30-A353 WeakPolarHBondContact CG-O 3.25Å; F31-A353 HydrophobicContact CB-CB 3.8Å; V349-A353 WeakPolarHBondContact O-CB 3.3Å; V349-A353 PolarHBondContact O-N 3.16Å; T350-A353 PolarHBondContact O-N 2.84Å; A353-S357 WeakPolarHBondContact O-CB 3.39Å; A353-S357 PolarHBondContact O-N 3.37Å; A353-L379 HydrophobicContact CB-CD1 4.24Å
354	M	95.2	Very high	95.6	Very high	55 Å²	55	42.5 Å²	42.5	27%	0.271	20%	0.203	S	C	.	.	H	α-helix	trans	-58.6	-52.3	172.9	-77.8	-66.7	-51.6	0	0	111.5	P30 T350 R351 C356 S357 H358	P30-M354 WeakPolarHBondContact CD-SD 3.43Å; P30-M354 HydrophobicContact CG-CG 4.29Å; P30-M354 HydrophobicContact CG-SD 3.93Å; T350-M354 WeakPolarHBondContact O-CG 3.39Å; T350-M354 PolarHBondContact O-N 3.33Å; R351-M354 WeakPolarHBondContact O-CB 3.03Å; R351-M354 PolarHBondContact O-N 3.45Å; M354-C356 PolarHBondContact O-N 3.25Å; M354-S357 WeakPolarHBondContact O-CB 3.22Å; M354-S357 PolarHBondContact O-N 3.03Å; M354-H358 WeakPolarHBondContact CE-NE2 3.48Å; M354-H358 PolarHBondContact O-CD2 3.33Å; M354-H358 PolarHBondContact O-N 2.02Å
355	A	95	Very high	95.5	Very high	16 Å²	16	39.3 Å²	39.3	13%	0.132	18%	0.183	C	C	.	.	H	α-helix	trans	-59.8	-45.9	-178.8	0	0	0	0	0	111.8	R351 A352 H358 Q359 L387 W390	R351-A355 WeakPolarHBondContact O-CB 3.48Å; R351-A355 PolarHBondContact O-N 2.86Å; A352-A355 PolarHBondContact O-N 3.2Å; A355-H358 PolarHBondContact O-N 2.91Å; A355-Q359 VanDerWaalsContact O-CB 3.32Å; A355-Q359 WeakPolarHBondContact O-CB 3.38Å; A355-Q359 VanDerWaalsContact O-CG 3.31Å; A355-Q359 WeakPolarHBondContact O-CG 3.38Å; A355-Q359 PolarHBondContact O-N 2.8Å; A355-L387 HydrophobicContact CB-CD1 3.98Å; A355-L387 HydrophobicContact CB-CD2 3.51Å; A355-L387 HydrophobicContact CB-CG 4.36Å; A355-W390 HydrophobicContact CB-CZ2 3.95Å
356	C	95.9	Very high	95.3	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-63.3	-43.3	177.3	-168.9	0	0	0	0	111.7	A352 M354 H358 Q359 R360 C367 L379 W390	A352-C356 WeakPolarHBondContact O-CB 3.41Å; A352-C356 PolarHBondContact O-N 2.86Å; M354-C356 PolarHBondContact O-N 3.25Å; C356-H358 PolarHBondContact O-N 2.87Å; C356-Q359 PolarHBondContact O-N 3.33Å; C356-R360 WeakPolarHBondContact O-CA 3.45Å; C356-R360 WeakPolarHBondContact O-CB 3.34Å; C356-R360 PolarHBondContact O-N 2.98Å; C356-C367 HydrophobicContact CB-CB 3.84Å; C356-C367 WeakPolarHBondContact CB-SG 3.31Å; C356-C367 PolarHBondContact O-SG 3.44Å; C356-C367 VanDerWaalsContact O-SG 3.37Å; C356-C367 WeakPolarHBondContact SG-CB 3.37Å; C356-C367 CovalentContact SG-SG 2.02Å; C356-C367 PolarHBondContact SG-SG 2.9Å; C356-L379 HydrophobicContact CB-CD2 3.83Å; C356-W390 HydrophobicContact CB-CD2 3.75Å; C356-W390 HydrophobicContact CB-CE3 3.99Å; C356-W390 HydrophobicContact CB-CG 4.12Å; C356-W390 HydrophobicContact CB-CZ2 4.36Å; C356-W390 HydrophobicContact CB-CZ3 4.41Å
357	S	95.9	Very high	95.2	Very high	4 Å²	4	40.9 Å²	40.9	3%	0.028	19%	0.189	C	C	.	.	H	α-helix	trans	-56.2	-47.8	175.8	-179.6	0	0	0	0	111.8	A353 M354 C361 H362 G363 G365	A353-S357 WeakPolarHBondContact O-CB 3.39Å; A353-S357 PolarHBondContact O-N 3.37Å; M354-S357 WeakPolarHBondContact O-CB 3.22Å; M354-S357 PolarHBondContact O-N 3.03Å; S357-C361 CarbonylContact O-C 3.57Å; S357-C361 WeakPolarHBondContact O-CA 3.4Å; S357-C361 VanDerWaalsContact O-CB 3.29Å; S357-C361 WeakPolarHBondContact O-CB 3.3Å; S357-C361 PolarHBondContact O-N 2.04Å; S357-H362 PolarHBondContact O-N 2.74Å; S357-H362 VanDerWaalsContact O-N 3.14Å; S357-G363 PolarHBondContact O-N 2.99Å; S357-G365 WeakPolarHBondContact CB-O 3.49Å; S357-G365 PolarHBondContact OG-O 3.31Å
358	H	93.9	Very high	95.2	Very high	109 Å²	109	38.7 Å²	38.7	51%	0.505	18%	0.178	S	C	.	.	H	α-helix	trans	-69.2	-46	179.3	-75.6	-67.3	0	0	0	113.1	M354 A355 C356 H362	M354-H358 WeakPolarHBondContact CE-NE2 3.48Å; M354-H358 PolarHBondContact O-CD2 3.33Å; M354-H358 PolarHBondContact O-N 2.02Å; A355-H358 PolarHBondContact O-N 2.91Å; C356-H358 PolarHBondContact O-N 2.87Å; H358-H362 PolarHBondContact O-N 2.88Å
359	Q	93.6	Very high	95.1	Very high	114 Å²	114	37.3 Å²	37.3	53%	0.533	17%	0.17	S	C	.	.	H	α-helix	trans	-78.9	-30.6	-172.6	-68.3	179	-9.5	0	0	113.6	A355 C356	A355-Q359 VanDerWaalsContact O-CB 3.32Å; A355-Q359 WeakPolarHBondContact O-CB 3.38Å; A355-Q359 VanDerWaalsContact O-CG 3.31Å; A355-Q359 WeakPolarHBondContact O-CG 3.38Å; A355-Q359 PolarHBondContact O-N 2.8Å; C356-Q359 PolarHBondContact O-N 3.33Å
360	R	94.3	Very high	94.8	Very high	97 Å²	97	44.1 Å²	44.1	37%	0.366	20%	0.195	S	C	.	.	H	α-helix	trans	-106.3	-34.7	-176.2	-163.1	71.6	-176.3	162.5	6.3	112.9	C356 C395 T405	C356-R360 WeakPolarHBondContact O-CA 3.45Å; C356-R360 WeakPolarHBondContact O-CB 3.34Å; C356-R360 PolarHBondContact O-N 2.98Å; R360-C395 VanDerWaalsContact C-SG 3.54Å; R360-C395 PolarHBondContact O-SG 3.25Å; R360-T405 WeakPolarHBondContact O-CB 3.33Å
361	C	95.2	Very high	94.3	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-117	16	-170.5	-48.1	0	0	0	0	113.2	S357 G363 H364 C395 T405	S357-C361 CarbonylContact O-C 3.57Å; S357-C361 WeakPolarHBondContact O-CA 3.4Å; S357-C361 VanDerWaalsContact O-CB 3.29Å; S357-C361 WeakPolarHBondContact O-CB 3.3Å; S357-C361 PolarHBondContact O-N 2.04Å; C361-G363 PolarHBondContact O-N 3.33Å; C361-H364 PolarHBondContact O-N 2.93Å; C361-C395 WeakPolarHBondContact CA-SG 3.36Å; C361-C395 HydrophobicContact CB-CB 3.78Å; C361-C395 WeakPolarHBondContact CB-SG 3.23Å; C361-C395 VanDerWaalsContact SG-CA 3.54Å; C361-C395 WeakPolarHBondContact SG-CB 3.34Å; C361-C395 CovalentContact SG-SG 2.04Å; C361-C395 PolarHBondContact SG-SG 3.07Å; C361-T405 CarbonylContact C-O 3.21Å; C361-T405 VanDerWaalsContact CA-O 3.22Å; C361-T405 WeakPolarHBondContact CA-O 3.22Å
362	H	93.9	Very high	93.3	Very high	80 Å²	80	42.2 Å²	42.2	37%	0.37	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.6	21.9	-179.9	-60.3	89.4	0	0	0	115	S357 H358 H364 T405	S357-H362 PolarHBondContact O-N 2.74Å; S357-H362 VanDerWaalsContact O-N 3.14Å; H358-H362 PolarHBondContact O-N 2.88Å; H362-H364 PolarHBondContact O-CD2 3.36Å; H362-H364 PolarHBondContact O-N 2.88Å; H362-T405 PolarHBondContact ND1-O 2.74Å
363	G	93.6	Very high	92.4	Very high	8 Å²	8	44.7 Å²	44.7	8%	0.082	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.8	7.7	-172.9	0	0	0	0	0	113.9	V26 S357 C361	V26-G363 WeakPolarHBondContact CG1-O 3.5Å; S357-G363 PolarHBondContact O-N 2.99Å; C361-G363 PolarHBondContact O-N 3.33Å
364	H	94.1	Very high	91.9	Very high	47 Å²	47	47.2 Å²	47.2	22%	0.218	24%	0.236	C	C	.	.	S	Bend	trans	-110.9	14	-175.8	-62.5	-36.5	0	0	0	112.9	C361 H362 Y398 W401 C406	C361-H364 PolarHBondContact O-N 2.93Å; H362-H364 PolarHBondContact O-CD2 3.36Å; H362-H364 PolarHBondContact O-N 2.88Å; H364-Y398 WeakPolarHBondContact O-CD2 3.47Å; H364-Y398 PolarHBondContact O-N 3.22Å; H364-W401 HydrophobicContact CB-CB 4.13Å; H364-W401 HydrophobicContact CB-CD2 3.59Å; H364-W401 HydrophobicContact CB-CE3 4.03Å; H364-W401 HydrophobicContact CB-CG 3.62Å; H364-W401 AromaticContact CD2-CD2 3.77Å; H364-W401 AromaticContact CD2-CE2 3.77Å; H364-W401 AromaticContact CD2-CE3 3.56Å; H364-W401 AromaticContact CD2-CH2 3.4Å; H364-W401 VanDerWaalsContact CD2-CH2 3.4Å; H364-W401 WeakPolarHBondContact CD2-CH2 3.36Å; H364-W401 AromaticContact CD2-CZ2 3.62Å; H364-W401 AromaticContact CD2-CZ3 3.37Å; H364-W401 WeakPolarHBondContact CD2-CZ3 3.47Å; H364-W401 AromaticContact CE1-CE2 3.8Å; H364-W401 AromaticContact CE1-CH2 3.63Å; H364-W401 AromaticContact CE1-CZ2 3.3Å; H364-W401 WeakPolarHBondContact CE1-CZ2 3.32Å; H364-W401 AromaticContact CG-CD2 3.5Å; H364-W401 VanDerWaalsContact CG-CD2 3.5Å; H364-W401 AromaticContact CG-CE2 3.42Å; H364-W401 VanDerWaalsContact CG-CE2 3.42Å; H364-W401 AromaticContact CG-CE3 3.79Å; H364-W401 AromaticContact CG-CH2 3.94Å; H364-W401 AromaticContact CG-CZ2 3.67Å; H364-W401 AromaticContact CG-CZ3 4Å; H364-W401 AromaticContact CG-NE1 3.89Å; H364-W401 AromaticContact ND1-CE2 3.44Å; H364-W401 AromaticContact ND1-CZ2 3.47Å; H364-W401 WeakPolarHBondContact ND1-CZ2 3.19Å; H364-W401 AromaticContact ND1-NE1 3.71Å; H364-W401 AromaticContact NE2-CH2 3.19Å; H364-W401 WeakPolarHBondContact NE2-CH2 3.42Å; H364-W401 AromaticContact NE2-CZ2 3.41Å; H364-W401 WeakPolarHBondContact NE2-CZ2 3.35Å; H364-W401 AromaticContact NE2-CZ3 3.67Å; H364-C406 HydrophobicContact CB-CB 3.78Å; H364-C406 VanDerWaalsContact CB-O 3.23Å; H364-C406 WeakPolarHBondContact CB-O 3.31Å; H364-C406 WeakPolarHBondContact O-CB 3.3Å
365	G	93.8	Very high	91.5	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-166.3	172.1	175.3	0	0	0	0	0	113	S357 H396	S357-G365 WeakPolarHBondContact CB-O 3.49Å; S357-G365 PolarHBondContact OG-O 3.31Å; G365-H396 CarbonylContact C-O 3.55Å; G365-H396 WeakPolarHBondContact CA-O 3.43Å
366	R	95.3	Very high	91.3	Very high	40 Å²	40	53.5 Å²	53.5	15%	0.151	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	145.8	174.1	-62.8	177.9	177.1	146.4	1.4	109.9	P30 C395 H396 Y398	P30-R366 HydrophobicContact CB-CG 3.91Å; P30-R366 WeakPolarHBondContact O-CD 3.4Å; P30-R366 PolarHBondContact O-NE 3.13Å; R366-C395 CarbonylContact O-C 3.11Å; R366-C395 WeakPolarHBondContact O-CA 3.37Å; R366-H396 PolarHBondContact N-O 2.85Å; R366-H396 PolarHBondContact O-N 3.08Å; R366-Y398 HydrophobicContact CG-CE1 3.65Å
367	C	95.7	Very high	91.1	Very high	4 Å²	4	54 Å²	54	3%	0.027	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	133.2	165.3	-71	0	0	0	0	110.2	C356 L379 F393 S394	C356-C367 HydrophobicContact CB-CB 3.84Å; C356-C367 WeakPolarHBondContact CB-SG 3.31Å; C356-C367 PolarHBondContact O-SG 3.44Å; C356-C367 VanDerWaalsContact O-SG 3.37Å; C356-C367 WeakPolarHBondContact SG-CB 3.37Å; C356-C367 CovalentContact SG-SG 2.02Å; C356-C367 PolarHBondContact SG-SG 2.9Å; C367-L379 HydrophobicContact CB-CD1 4.15Å; C367-L379 HydrophobicContact CB-CD2 4.1Å; C367-F393 HydrophobicContact CB-CB 4.05Å; C367-F393 HydrophobicContact CB-CD1 4.09Å; C367-F393 HydrophobicContact CB-CG 4.24Å; C367-S394 WeakPolarHBondContact CA-O 3.44Å
368	A	95.6	Very high	91	Very high	1 Å²	1	55.6 Å²	55.6	1%	0.008	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	146.3	171.8	0	0	0	0	0	109	A310 R370 F393 S394 H396	A310-A368 CarbonylContact O-C 3.51Å; A310-A368 WeakPolarHBondContact O-CA 3.22Å; A368-R370 PolarHBondContact O-N 2.98Å; A368-F393 CarbonylContact O-C 3.58Å; A368-F393 VanDerWaalsContact O-CA 3.31Å; A368-F393 WeakPolarHBondContact O-CA 3.4Å; A368-S394 PolarHBondContact N-O 3Å; A368-S394 PolarHBondContact O-N 2.88Å; A368-S394 PolarHBondContact O-OG 2.92Å; A368-H396 WeakPolarHBondContact CB-CE1 3.43Å; A368-H396 WeakPolarHBondContact CB-ND1 3.15Å; A368-H396 WeakPolarHBondContact CB-NE2 3.33Å
369	R	94.8	Very high	91	Very high	16 Å²	16	50.6 Å²	50.6	6%	0.06	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.3	129.7	-180	-170.6	-174	-67.1	176.8	-11.1	109.5	A310 D371 Q374 M375 A377 F393	A310-R369 WeakPolarHBondContact O-CB 3.31Å; A310-R369 PolarHBondContact O-N 3.32Å; R369-D371 WeakPolarHBondContact CD-O 3.5Å; R369-D371 VanDerWaalsContact CG-O 3.3Å; R369-D371 WeakPolarHBondContact CG-O 3.21Å; R369-Q374 WeakPolarHBondContact CD-O 3.32Å; R369-Q374 PolarHBondContact NE-O 3.22Å; R369-Q374 PolarHBondContact NH1-O 2.89Å; R369-Q374 VanDerWaalsContact NH1-O 3.16Å; R369-Q374 PolarHBondContact NH2-O 3.49Å; R369-M375 PolarHBondContact NH2-O 3.2Å; R369-A377 HydrophobicContact CG-CB 4.32Å; R369-A377 PolarHBondContact NE-O 3.18Å; R369-A377 VanDerWaalsContact NE-O 3.13Å; R369-A377 PolarHBondContact NH2-O 2.94Å; R369-F393 HydrophobicContact CB-CE1 4.47Å
370	R	90.3	Very high	91	Very high	142 Å²	142	47.4 Å²	47.4	54%	0.536	24%	0.236	S	C	.	.	S	Bend	trans	-70.1	-45.6	-177.4	-175.4	-176.3	-57.7	175.6	9.8	112.1	A368 K391 S392 F393	A368-R370 PolarHBondContact O-N 2.98Å; R370-K391 PolarHBondContact NH2-O 2.79Å; R370-S392 PolarHBondContact N-O 3.45Å; R370-F393 PolarHBondContact NH2-O 3.34Å
371	D	87.1	Confident	90.7	Very high	78 Å²	78	44.1 Å²	44.1	42%	0.417	23%	0.226	S	C	.	.			trans	-112.2	116.1	-179.1	179.4	2.7	0	0	0	109.6	R369 G373 Q374	R369-D371 WeakPolarHBondContact CD-O 3.5Å; R369-D371 VanDerWaalsContact CG-O 3.3Å; R369-D371 WeakPolarHBondContact CG-O 3.21Å; D371-G373 PolarHBondContact O-N 3.47Å; D371-G373 VanDerWaalsContact O-N 3.08Å; D371-G373 PolarHBondContact OD1-N 3.34Å; D371-Q374 HydrophobicContact CB-CG 4.01Å; D371-Q374 PolarHBondContact O-N 3.34Å
372	P	74.4	Confident	90	Very high	70 Å²	70	51.2 Å²	51.2	46%	0.455	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.5	-26.2	174.6	-25.8	34.8	0	0	0	114
373	G	76.6	Confident	89.2	Confident	52 Å²	52	54 Å²	54	54%	0.536	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-20.1	178.3	0	0	0	0	0	115.3	D371 M375	D371-G373 PolarHBondContact O-N 3.47Å; D371-G373 VanDerWaalsContact O-N 3.08Å; D371-G373 PolarHBondContact OD1-N 3.34Å; G373-M375 PolarHBondContact O-N 3.21Å
374	Q	86.6	Confident	88.5	Confident	58 Å²	58	59.8 Å²	59.8	27%	0.271	31%	0.306	S	S	.	.			trans	-78.2	68.8	177.8	-71.6	-176.5	-9.3	0	0	111.4	R369 D371 E376 A377 S392	R369-Q374 WeakPolarHBondContact CD-O 3.32Å; R369-Q374 PolarHBondContact NE-O 3.22Å; R369-Q374 PolarHBondContact NH1-O 2.89Å; R369-Q374 VanDerWaalsContact NH1-O 3.16Å; R369-Q374 PolarHBondContact NH2-O 3.49Å; D371-Q374 HydrophobicContact CB-CG 4.01Å; D371-Q374 PolarHBondContact O-N 3.34Å; Q374-E376 PolarHBondContact O-N 3.01Å; Q374-A377 HydrophobicContact CB-CB 4.17Å; Q374-A377 PolarHBondContact O-N 3.21Å; Q374-A377 VanDerWaalsContact O-N 3.11Å; Q374-S392 PolarHBondContact OE1-OG 3.01Å
375	M	86.3	Confident	87.5	Confident	67 Å²	67	59.8 Å²	59.8	33%	0.33	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-30.4	-171.5	-67.7	-170.3	62.5	0	0	113.2	Q257 R369 G373 A377 F378	Q257-M375 HydrophobicContact CB-CE 4.26Å; Q257-M375 HydrophobicContact CG-CE 3.78Å; Q257-M375 PolarHBondContact NE2-O 3.44Å; R369-M375 PolarHBondContact NH2-O 3.2Å; G373-M375 PolarHBondContact O-N 3.21Å; M375-A377 VanDerWaalsContact C-N 3.33Å; M375-A377 PolarHBondContact O-N 3.4Å; M375-F378 WeakPolarHBondContact O-CE2 3.33Å
376	E	90.2	Very high	86.7	Confident	136 Å²	136	62.1 Å²	62.1	64%	0.636	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.6	-14.4	177.9	69.6	-67.3	157.5	0	0	115	Q374 F378	Q374-E376 PolarHBondContact O-N 3.01Å; E376-F378 VanDerWaalsContact O-CD2 3.31Å; E376-F378 WeakPolarHBondContact O-CD2 2.99Å; E376-F378 PolarHBondContact O-N 3.38Å
377	A	92.3	Very high	86	Confident	10 Å²	10	63.7 Å²	63.7	8%	0.083	35%	0.347	C	S	.	.			trans	-79.7	105.1	-176.7	0	0	0	0	0	112	R369 Q374 M375 F393	R369-A377 HydrophobicContact CG-CB 4.32Å; R369-A377 PolarHBondContact NE-O 3.18Å; R369-A377 VanDerWaalsContact NE-O 3.13Å; R369-A377 PolarHBondContact NH2-O 2.94Å; Q374-A377 HydrophobicContact CB-CB 4.17Å; Q374-A377 PolarHBondContact O-N 3.21Å; Q374-A377 VanDerWaalsContact O-N 3.11Å; M375-A377 VanDerWaalsContact C-N 3.33Å; M375-A377 PolarHBondContact O-N 3.4Å; A377-F393 HydrophobicContact CB-CZ 4.41Å
378	F	94.3	Very high	84.9	Confident	39 Å²	39	64.1 Å²	64.1	17%	0.171	35%	0.352	C	S	.	.			trans	-118.1	156.1	176.1	-68.4	-83.3	0	0	0	112.3	V302 V307 A310 M375 E376 H380	V302-F378 HydrophobicContact CG1-CD1 4.35Å; V302-F378 HydrophobicContact CG1-CD2 4.36Å; V302-F378 HydrophobicContact CG1-CE1 3.98Å; V302-F378 HydrophobicContact CG1-CE2 4.02Å; V302-F378 HydrophobicContact CG1-CZ 3.8Å; V307-F378 HydrophobicContact CG2-CE1 3.79Å; V307-F378 HydrophobicContact CG2-CZ 4.28Å; A310-F378 HydrophobicContact CB-CD1 4.28Å; M375-F378 WeakPolarHBondContact O-CE2 3.33Å; E376-F378 VanDerWaalsContact O-CD2 3.31Å; E376-F378 WeakPolarHBondContact O-CD2 2.99Å; E376-F378 PolarHBondContact O-N 3.38Å; F378-H380 WeakPolarHBondContact CB-ND1 3.47Å; F378-H380 AromaticContact CG-CE1 3.9Å; F378-H380 PolarHBondContact O-N 3.43Å
379	L	93.4	Very high	84	Confident	3 Å²	3	68.8 Å²	68.8	2%	0.016	38%	0.377	C	S	.	.			trans	-86.6	82.6	170.5	-69.9	172.6	0	0	0	108.8	A309 A352 A353 C356 C367 W390 F393	A309-L379 HydrophobicContact CB-CD1 4.46Å; A352-L379 VanDerWaalsContact CB-C 3.46Å; A352-L379 HydrophobicContact CB-CB 4.26Å; A352-L379 WeakPolarHBondContact CB-O 3.33Å; A353-L379 HydrophobicContact CB-CD1 4.24Å; C356-L379 HydrophobicContact CB-CD2 3.83Å; C367-L379 HydrophobicContact CB-CD1 4.15Å; C367-L379 HydrophobicContact CB-CD2 4.1Å; L379-W390 HydrophobicContact CD2-CE3 4.05Å; L379-W390 HydrophobicContact CD2-CZ3 4.09Å; L379-F393 HydrophobicContact CD1-CE1 4.32Å; L379-F393 HydrophobicContact CD2-CD1 3.95Å; L379-F393 HydrophobicContact CD2-CD2 4.12Å; L379-F393 HydrophobicContact CD2-CE1 3.71Å; L379-F393 HydrophobicContact CD2-CE2 3.86Å; L379-F393 HydrophobicContact CD2-CG 4.17Å; L379-F393 HydrophobicContact CD2-CZ 3.67Å; L379-F393 HydrophobicContact CG-CD1 4.25Å; L379-F393 HydrophobicContact CG-CE1 3.64Å; L379-F393 HydrophobicContact CG-CE2 4.44Å; L379-F393 HydrophobicContact CG-CZ 3.75Å
380	H	93.4	Very high	83.8	Confident	47 Å²	47	68.7 Å²	68.7	22%	0.218	38%	0.376	C	S	.	.			trans	-125.9	153.4	174.4	-62.5	144.8	0	0	0	111	Y345 N348 F378	Y345-H380 AromaticContact CE2-CE1 3.94Å; Y345-H380 AromaticContact CE2-NE2 3.33Å; Y345-H380 VanDerWaalsContact CE2-NE2 3.33Å; Y345-H380 WeakPolarHBondContact CE2-NE2 3.41Å; Y345-H380 AromaticContact CZ-NE2 3.45Å; Y345-H380 PolarHBondContact OH-NE2 3.32Å; N348-H380 WeakPolarHBondContact OD1-CA 2.96Å; N348-H380 WeakPolarHBondContact OD1-CB 3.38Å; F378-H380 WeakPolarHBondContact CB-ND1 3.47Å; F378-H380 AromaticContact CG-CE1 3.9Å; F378-H380 PolarHBondContact O-N 3.43Å
381	L	87.7	Confident	83.7	Confident	29 Å²	29	68.6 Å²	68.6	15%	0.152	38%	0.38	C	S	.	.			trans	-74.5	148.4	166.4	-55	177	0	0	0	109.4	N348 R351 A352 L387	N348-L381 PolarHBondContact OD1-N 3.2Å; R351-L381 HydrophobicContact CB-CD1 4.02Å; R351-L381 HydrophobicContact CB-CD2 4.43Å; A352-L381 HydrophobicContact CB-CD2 4.06Å; A352-L381 HydrophobicContact CB-CG 4.34Å; L381-L387 HydrophobicContact CD2-CD2 3.6Å
382	W	80.5	Confident	84	Confident	148 Å²	148	66.6 Å²	66.6	56%	0.561	37%	0.372	S	S	*	.			trans	-63.5	159.4	170.9	-69.5	110.5	0	0	0	111.2	D384 G385 S386 L387	W382-D384 WeakPolarHBondContact CB-OD1 3.4Å; W382-D384 PolarHBondContact O-N 2.89Å; W382-D384 VanDerWaalsContact O-N 3.13Å; W382-G385 WeakPolarHBondContact O-CA 2.95Å; W382-G385 PolarHBondContact O-N 3.17Å; W382-S386 WeakPolarHBondContact CB-OG 3.04Å; W382-S386 VanDerWaalsContact CD1-OG 3.23Å; W382-S386 PolarHBondContact N-O 2.91Å; W382-L387 PolarHBondContact NE1-O 2.73Å
383	P	77.6	Confident	85	Confident	139 Å²	139	63.6 Å²	63.6	90%	0.903	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	-27.9	-179.7	-27.1	35.6	0	0	0	114.8	G385	P383-G385 VanDerWaalsContact C-N 3.26Å
384	D	79.3	Confident	85.9	Confident	129 Å²	129	62.8 Å²	62.8	69%	0.69	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.7	1.7	175.4	67.9	-10.2	0	0	0	113.5	W382 S386	W382-D384 WeakPolarHBondContact CB-OD1 3.4Å; W382-D384 PolarHBondContact O-N 2.89Å; W382-D384 VanDerWaalsContact O-N 3.13Å; D384-S386 VanDerWaalsContact C-N 3.32Å; D384-S386 VanDerWaalsContact OD1-CB 3.22Å; D384-S386 WeakPolarHBondContact OD1-CB 3.37Å; D384-S386 PolarHBondContact OD1-N 3.02Å; D384-S386 PolarHBondContact OD1-OG 3.11Å; D384-S386 PolarHBondContact OD2-OG 3.03Å
385	G	72.5	Confident	86.3	Confident	47 Å²	47	60.9 Å²	60.9	49%	0.485	33%	0.331	S	S	.	.	S	Bend	trans	83	1.2	-177.3	0	0	0	0	0	114.6	W382 P383	W382-G385 WeakPolarHBondContact O-CA 2.95Å; W382-G385 PolarHBondContact O-N 3.17Å; P383-G385 VanDerWaalsContact C-N 3.26Å
386	S	77.1	Confident	86.6	Confident	49 Å²	49	62 Å²	62	34%	0.343	34%	0.335	S	S	.	.	P	Polyproline II helix	trans	-73	164.4	177.8	69.9	0	0	0	0	112.6	W382 D384	W382-S386 WeakPolarHBondContact CB-OG 3.04Å; W382-S386 VanDerWaalsContact CD1-OG 3.23Å; W382-S386 PolarHBondContact N-O 2.91Å; D384-S386 VanDerWaalsContact C-N 3.32Å; D384-S386 VanDerWaalsContact OD1-CB 3.22Å; D384-S386 WeakPolarHBondContact OD1-CB 3.37Å; D384-S386 PolarHBondContact OD1-N 3.02Å; D384-S386 PolarHBondContact OD1-OG 3.11Å; D384-S386 PolarHBondContact OD2-OG 3.03Å
387	L	80.6	Confident	86.8	Confident	73 Å²	73	57.2 Å²	57.2	38%	0.382	32%	0.316	S	S	.	.	P	Polyproline II helix	trans	-91.2	145.9	-176	-61.5	178.2	0	0	0	111.8	A355 L381 W382 W390	A355-L387 HydrophobicContact CB-CD1 3.98Å; A355-L387 HydrophobicContact CB-CD2 3.51Å; A355-L387 HydrophobicContact CB-CG 4.36Å; L381-L387 HydrophobicContact CD2-CD2 3.6Å; W382-L387 PolarHBondContact NE1-O 2.73Å; L387-W390 HydrophobicContact CB-CZ2 3.91Å; L387-W390 HydrophobicContact CD2-CZ2 4.14Å
388	G	71.6	Confident	86.7	Confident	14 Å²	14	57.8 Å²	57.8	14%	0.144	32%	0.316	C	S	.	.	P	Polyproline II helix	trans	-70.7	163.7	173.2	0	0	0	0	0	113.1	W390	G388-W390 PolarHBondContact O-N 3.24Å; G388-W390 PolarHBondContact O-NE1 3.29Å
389	D	77.9	Confident	86.3	Confident	98 Å²	98	58.6 Å²	58.6	52%	0.524	33%	0.326	S	S	.	.			trans	-82.1	-1.6	176.2	70.8	8	0	0	0	113.9	K391	D389-K391 HydrophobicContact CB-CG 4.29Å; D389-K391 PolarHBondContact O-N 3.34Å; D389-K391 PolarHBondContact OD1-N 3.21Å; D389-K391 WeakPolarHBondContact OD2-CD 3.37Å; D389-K391 WeakPolarHBondContact OD2-CE 3.31Å; D389-K391 IonicContact OD2-NZ 2.71Å; D389-K391 PolarHBondContact OD2-NZ 3.44Å
390	W	90.4	Very high	86.1	Confident	14 Å²	14	59.1 Å²	59.1	5%	0.053	33%	0.332	C	S	.	.			trans	51.6	18.8	177.6	-41	123.5	0	0	0	115.3	A352 A355 C356 L379 L387 G388 S392 F393	A352-W390 HydrophobicContact CB-CH2 4.24Å; A355-W390 HydrophobicContact CB-CZ2 3.95Å; C356-W390 HydrophobicContact CB-CD2 3.75Å; C356-W390 HydrophobicContact CB-CE3 3.99Å; C356-W390 HydrophobicContact CB-CG 4.12Å; C356-W390 HydrophobicContact CB-CZ2 4.36Å; C356-W390 HydrophobicContact CB-CZ3 4.41Å; L379-W390 HydrophobicContact CD2-CE3 4.05Å; L379-W390 HydrophobicContact CD2-CZ3 4.09Å; L387-W390 HydrophobicContact CB-CZ2 3.91Å; L387-W390 HydrophobicContact CD2-CZ2 4.14Å; G388-W390 PolarHBondContact O-N 3.24Å; G388-W390 PolarHBondContact O-NE1 3.29Å; W390-S392 VanDerWaalsContact C-N 3.28Å; W390-S392 PolarHBondContact O-N 3.33Å; W390-F393 PolarHBondContact O-N 3.27Å
391	K	89	Confident	86	Confident	140 Å²	140	59.8 Å²	59.8	61%	0.609	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-33.8	-172.7	-74	178.5	-172.5	141.1	0	113.5	R370 D389 F393	R370-K391 PolarHBondContact NH2-O 2.79Å; D389-K391 HydrophobicContact CB-CG 4.29Å; D389-K391 PolarHBondContact O-N 3.34Å; D389-K391 PolarHBondContact OD1-N 3.21Å; D389-K391 WeakPolarHBondContact OD2-CD 3.37Å; D389-K391 WeakPolarHBondContact OD2-CE 3.31Å; D389-K391 IonicContact OD2-NZ 2.71Å; D389-K391 PolarHBondContact OD2-NZ 3.44Å; K391-F393 PolarHBondContact O-N 3.25Å
392	S	92.8	Very high	86.1	Confident	36 Å²	36	59.2 Å²	59.2	25%	0.252	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-1.3	176.8	-64.6	0	0	0	0	114.3	R370 Q374 W390	R370-S392 PolarHBondContact N-O 3.45Å; Q374-S392 PolarHBondContact OE1-OG 3.01Å; W390-S392 VanDerWaalsContact C-N 3.28Å; W390-S392 PolarHBondContact O-N 3.33Å
393	F	95.3	Very high	86.7	Confident	8 Å²	8	53.6 Å²	53.6	4%	0.035	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	149.2	-175.8	-62.7	-87.7	0	0	0	112.6	A310 C367 A368 R369 R370 A377 L379 W390 K391	A310-F393 HydrophobicContact CB-CE1 4.38Å; C367-F393 HydrophobicContact CB-CB 4.05Å; C367-F393 HydrophobicContact CB-CD1 4.09Å; C367-F393 HydrophobicContact CB-CG 4.24Å; A368-F393 CarbonylContact O-C 3.58Å; A368-F393 VanDerWaalsContact O-CA 3.31Å; A368-F393 WeakPolarHBondContact O-CA 3.4Å; R369-F393 HydrophobicContact CB-CE1 4.47Å; R370-F393 PolarHBondContact NH2-O 3.34Å; A377-F393 HydrophobicContact CB-CZ 4.41Å; L379-F393 HydrophobicContact CD1-CE1 4.32Å; L379-F393 HydrophobicContact CD2-CD1 3.95Å; L379-F393 HydrophobicContact CD2-CD2 4.12Å; L379-F393 HydrophobicContact CD2-CE1 3.71Å; L379-F393 HydrophobicContact CD2-CE2 3.86Å; L379-F393 HydrophobicContact CD2-CG 4.17Å; L379-F393 HydrophobicContact CD2-CZ 3.67Å; L379-F393 HydrophobicContact CG-CD1 4.25Å; L379-F393 HydrophobicContact CG-CE1 3.64Å; L379-F393 HydrophobicContact CG-CE2 4.44Å; L379-F393 HydrophobicContact CG-CZ 3.75Å; W390-F393 PolarHBondContact O-N 3.27Å; K391-F393 PolarHBondContact O-N 3.25Å
394	S	95.4	Very high	87.4	Confident	35 Å²	35	52.1 Å²	52.1	25%	0.245	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	170.4	166.9	58.7	0	0	0	0	109.3	C367 A368	C367-S394 WeakPolarHBondContact CA-O 3.44Å; A368-S394 PolarHBondContact N-O 3Å; A368-S394 PolarHBondContact O-N 2.88Å; A368-S394 PolarHBondContact O-OG 2.92Å
395	C	95	Very high	88.1	Confident	18 Å²	18	47.9 Å²	47.9	12%	0.122	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	129.5	-178.2	-63.6	0	0	0	0	112.3	R360 C361 R366 P404 C406	R360-C395 VanDerWaalsContact C-SG 3.54Å; R360-C395 PolarHBondContact O-SG 3.25Å; C361-C395 WeakPolarHBondContact CA-SG 3.36Å; C361-C395 HydrophobicContact CB-CB 3.78Å; C361-C395 WeakPolarHBondContact CB-SG 3.23Å; C361-C395 VanDerWaalsContact SG-CA 3.54Å; C361-C395 WeakPolarHBondContact SG-CB 3.34Å; C361-C395 CovalentContact SG-SG 2.04Å; C361-C395 PolarHBondContact SG-SG 3.07Å; R366-C395 CarbonylContact O-C 3.11Å; R366-C395 WeakPolarHBondContact O-CA 3.37Å; C395-P404 WeakPolarHBondContact CB-O 3.43Å; C395-C406 WeakPolarHBondContact CB-SG 3.4Å
396	H	93.6	Very high	89.2	Confident	89 Å²	89	45.7 Å²	45.7	41%	0.412	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	101.1	163.9	-70.7	-175.2	0	0	0	108.2	G365 R366 A368	G365-H396 CarbonylContact C-O 3.55Å; G365-H396 WeakPolarHBondContact CA-O 3.43Å; R366-H396 PolarHBondContact N-O 2.85Å; R366-H396 PolarHBondContact O-N 3.08Å; A368-H396 WeakPolarHBondContact CB-CE1 3.43Å; A368-H396 WeakPolarHBondContact CB-ND1 3.15Å; A368-H396 WeakPolarHBondContact CB-NE2 3.33Å
397	C	92.4	Very high	90	Very high	36 Å²	36	49.1 Å²	49.1	24%	0.243	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	145.3	-172.9	-53.7	0	0	0	0	113.2	W401 G403 C406	C397-W401 HydrophobicContact CB-CB 4.04Å; C397-W401 WeakPolarHBondContact CB-O 3.13Å; C397-G403 PolarHBondContact SG-O 2.84Å; C397-C406 WeakPolarHBondContact CA-SG 3.1Å; C397-C406 HydrophobicContact CB-CB 3.77Å; C397-C406 WeakPolarHBondContact CB-SG 3.16Å; C397-C406 WeakPolarHBondContact SG-CA 3.42Å; C397-C406 WeakPolarHBondContact SG-CB 3.19Å; C397-C406 CovalentContact SG-SG 2.04Å; C397-C406 PolarHBondContact SG-SG 3.13Å
398	Y	91.2	Very high	90.5	Very high	22 Å²	22	51.1 Å²	51.1	9%	0.086	29%	0.285	C	S	.	.	P	Polyproline II helix	trans	-67.1	161.4	170.7	-60.2	-42.9	0	0	0	111.1	V26 P27 P30 H364 R366 G400 W401	V26-Y398 HydrophobicContact CG1-CD2 4.06Å; V26-Y398 HydrophobicContact CG1-CE2 3.99Å; P27-Y398 HydrophobicContact CB-CE1 4.31Å; P27-Y398 HydrophobicContact CG-CD1 3.87Å; P27-Y398 HydrophobicContact CG-CD2 4.41Å; P27-Y398 HydrophobicContact CG-CE1 3.67Å; P27-Y398 HydrophobicContact CG-CE2 4.26Å; P27-Y398 HydrophobicContact CG-CG 4.25Å; P30-Y398 WeakPolarHBondContact CA-OH 3.31Å; P30-Y398 WeakPolarHBondContact CB-OH 3.31Å; H364-Y398 WeakPolarHBondContact O-CD2 3.47Å; H364-Y398 PolarHBondContact O-N 3.22Å; R366-Y398 HydrophobicContact CG-CE1 3.65Å; Y398-G400 PolarHBondContact O-N 3.13Å; Y398-W401 PolarHBondContact O-N 3.44Å
399	C	86.3	Confident	91.3	Very high	56 Å²	56	54.7 Å²	54.7	38%	0.378	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.1	131.8	173.8	-171	0	0	0	0	109.8	P24 H277	P24-C399 HydrophobicContact CG-CB 4.19Å; H277-C399 VanDerWaalsContact CE1-SG 3.59Å; H277-C399 PolarHBondContact ND1-SG 2.75Å
400	G	87.9	Confident	91.4	Very high	14 Å²	14	56.1 Å²	56.1	14%	0.144	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	90.3	-1.7	-176	0	0	0	0	0	115.1	Y398 P409 R410	Y398-G400 PolarHBondContact O-N 3.13Å; G400-P409 CarbonylContact O-C 3.53Å; G400-P409 WeakPolarHBondContact O-CA 3.21Å; G400-R410 PolarHBondContact O-N 3.04Å
401	W	91.1	Very high	90.2	Very high	61 Å²	61	62.9 Å²	62.9	23%	0.231	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	151.7	179.2	-62	93.2	0	0	0	112.9	H364 C397 Y398 C406 E408 P409 R410	H364-W401 HydrophobicContact CB-CB 4.13Å; H364-W401 HydrophobicContact CB-CD2 3.59Å; H364-W401 HydrophobicContact CB-CE3 4.03Å; H364-W401 HydrophobicContact CB-CG 3.62Å; H364-W401 AromaticContact CD2-CD2 3.77Å; H364-W401 AromaticContact CD2-CE2 3.77Å; H364-W401 AromaticContact CD2-CE3 3.56Å; H364-W401 AromaticContact CD2-CH2 3.4Å; H364-W401 VanDerWaalsContact CD2-CH2 3.4Å; H364-W401 WeakPolarHBondContact CD2-CH2 3.36Å; H364-W401 AromaticContact CD2-CZ2 3.62Å; H364-W401 AromaticContact CD2-CZ3 3.37Å; H364-W401 WeakPolarHBondContact CD2-CZ3 3.47Å; H364-W401 AromaticContact CE1-CE2 3.8Å; H364-W401 AromaticContact CE1-CH2 3.63Å; H364-W401 AromaticContact CE1-CZ2 3.3Å; H364-W401 WeakPolarHBondContact CE1-CZ2 3.32Å; H364-W401 AromaticContact CG-CD2 3.5Å; H364-W401 VanDerWaalsContact CG-CD2 3.5Å; H364-W401 AromaticContact CG-CE2 3.42Å; H364-W401 VanDerWaalsContact CG-CE2 3.42Å; H364-W401 AromaticContact CG-CE3 3.79Å; H364-W401 AromaticContact CG-CH2 3.94Å; H364-W401 AromaticContact CG-CZ2 3.67Å; H364-W401 AromaticContact CG-CZ3 4Å; H364-W401 AromaticContact CG-NE1 3.89Å; H364-W401 AromaticContact ND1-CE2 3.44Å; H364-W401 AromaticContact ND1-CZ2 3.47Å; H364-W401 WeakPolarHBondContact ND1-CZ2 3.19Å; H364-W401 AromaticContact ND1-NE1 3.71Å; H364-W401 AromaticContact NE2-CH2 3.19Å; H364-W401 WeakPolarHBondContact NE2-CH2 3.42Å; H364-W401 AromaticContact NE2-CZ2 3.41Å; H364-W401 WeakPolarHBondContact NE2-CZ2 3.35Å; H364-W401 AromaticContact NE2-CZ3 3.67Å; C397-W401 HydrophobicContact CB-CB 4.04Å; C397-W401 WeakPolarHBondContact CB-O 3.13Å; Y398-W401 PolarHBondContact O-N 3.44Å; W401-C406 HydrophobicContact CB-CB 4.32Å; W401-E408 CarbonylContact C-O 3.57Å; W401-E408 WeakPolarHBondContact CA-O 3.39Å; W401-P409 HydrophobicContact CZ3-CB 4.5Å; W401-R410 PolarHBondContact O-NE 3.11Å
402	A	91.1	Very high	88.8	Confident	18 Å²	18	58.8 Å²	58.8	15%	0.149	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	176.3	-176	0	0	0	0	0	112.3	C406 Q407 E408 R410	A402-C406 CarbonylContact O-C 3.5Å; A402-C406 WeakPolarHBondContact O-CA 3.08Å; A402-Q407 PolarHBondContact O-N 2.7Å; A402-E408 HydrophobicContact CB-CB 4.37Å; A402-E408 PolarHBondContact N-O 3.16Å; A402-E408 PolarHBondContact O-N 3.49Å; A402-R410 HydrophobicContact CB-CG 3.53Å
403	G	92.1	Very high	86.5	Confident	30 Å²	30	62 Å²	62	31%	0.309	36%	0.358	S	S	.	.	S	Bend	trans	89.1	169	-177.5	0	0	0	0	0	112.7	C397 T405 C406	C397-G403 PolarHBondContact SG-O 2.84Å; G403-T405 PolarHBondContact O-N 3.21Å; G403-C406 PolarHBondContact O-N 2.97Å
404	P	93.3	Very high	83.9	Confident	108 Å²	108	70.8 Å²	70.8	70%	0.701	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-19.1	-176.3	26.8	-35	0	0	0	113.8	C395	C395-P404 WeakPolarHBondContact CB-O 3.43Å
405	T	94.3	Very high	81.2	Confident	40 Å²	40	77.1 Å²	77.1	25%	0.245	42%	0.422	C	S	.	.	T	Hydrogen-bonded Turn	trans	-125.6	11.4	-177.9	57.1	0	0	0	0	112.6	R360 C361 H362 G403 Q407	R360-T405 WeakPolarHBondContact O-CB 3.33Å; C361-T405 CarbonylContact C-O 3.21Å; C361-T405 VanDerWaalsContact CA-O 3.22Å; C361-T405 WeakPolarHBondContact CA-O 3.22Å; H362-T405 PolarHBondContact ND1-O 2.74Å; G403-T405 PolarHBondContact O-N 3.21Å; T405-Q407 VanDerWaalsContact C-N 3.25Å; T405-Q407 PolarHBondContact O-N 2.89Å
406	C	94.2	Very high	78.1	Confident	0 Å²	0	81 Å²	81	0%	0	46%	0.455	C	S	.	.	S	Bend	trans	59.8	26.3	178.9	-48	0	0	0	0	115.8	H364 C395 C397 W401 A402 G403	H364-C406 HydrophobicContact CB-CB 3.78Å; H364-C406 VanDerWaalsContact CB-O 3.23Å; H364-C406 WeakPolarHBondContact CB-O 3.31Å; H364-C406 WeakPolarHBondContact O-CB 3.3Å; C395-C406 WeakPolarHBondContact CB-SG 3.4Å; C397-C406 WeakPolarHBondContact CA-SG 3.1Å; C397-C406 HydrophobicContact CB-CB 3.77Å; C397-C406 WeakPolarHBondContact CB-SG 3.16Å; C397-C406 WeakPolarHBondContact SG-CA 3.42Å; C397-C406 WeakPolarHBondContact SG-CB 3.19Å; C397-C406 CovalentContact SG-SG 2.04Å; C397-C406 PolarHBondContact SG-SG 3.13Å; W401-C406 HydrophobicContact CB-CB 4.32Å; A402-C406 CarbonylContact O-C 3.5Å; A402-C406 WeakPolarHBondContact O-CA 3.08Å; G403-C406 PolarHBondContact O-N 2.97Å
407	Q	94	Very high	75.3	Confident	121 Å²	121	87.9 Å²	87.9	57%	0.565	49%	0.492	S	S	*	.			trans	-85	-19.5	-179.2	-163.7	174.1	3.9	0	0	113	A402 T405	A402-Q407 PolarHBondContact O-N 2.7Å; T405-Q407 VanDerWaalsContact C-N 3.25Å; T405-Q407 PolarHBondContact O-N 2.89Å
408	E	91.8	Very high	74.5	Confident	116 Å²	116	90.5 Å²	90.5	54%	0.542	51%	0.505	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	122.9	-174.8	-64.9	168.4	-161.1	0	0	110.2	W401 A402 R410	W401-E408 CarbonylContact C-O 3.57Å; W401-E408 WeakPolarHBondContact CA-O 3.39Å; A402-E408 HydrophobicContact CB-CB 4.37Å; A402-E408 PolarHBondContact N-O 3.16Å; A402-E408 PolarHBondContact O-N 3.49Å; E408-R410 PolarHBondContact O-N 3.41Å
409	P	88.8	Confident	73.6	Confident	88 Å²	88	94.1 Å²	94.1	57%	0.571	53%	0.527	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.9	129.4	170.5	26.4	-30.8	0	0	0	109.7	G400 W401 L411	G400-P409 CarbonylContact O-C 3.53Å; G400-P409 WeakPolarHBondContact O-CA 3.21Å; W401-P409 HydrophobicContact CZ3-CB 4.5Å; P409-L411 PolarHBondContact O-N 2.71Å; P409-L411 VanDerWaalsContact O-N 3.15Å
410	R	80.4	Confident	72.9	Confident	129 Å²	129	96.2 Å²	96.2	49%	0.487	54%	0.535	S	S	.	.			trans	-73	104.7	167	-72.8	-175.5	-171.2	-153.8	-11.3	107.9	H277 G400 W401 A402 E408 G412	H277-R410 PolarHBondContact NE2-NH1 3.31Å; H277-R410 VanDerWaalsContact NE2-NH1 3.12Å; G400-R410 PolarHBondContact O-N 3.04Å; W401-R410 PolarHBondContact O-NE 3.11Å; A402-R410 HydrophobicContact CB-CG 3.53Å; E408-R410 PolarHBondContact O-N 3.41Å; R410-G412 PolarHBondContact O-N 3.19Å
411	L	64.8	Low	72	Confident	156 Å²	156	101 Å²	101	82%	0.817	56%	0.558	S	S	*	*	P	Polyproline II helix	trans	-58	121.7	163.8	-66.8	168.2	0	0	0	107.4	P409	P409-L411 PolarHBondContact O-N 2.71Å; P409-L411 VanDerWaalsContact O-N 3.15Å
412	G	58.5	Low	70.8	Confident	54 Å²	54	103.5 Å²	103.5	56%	0.557	58%	0.578	S	S	*	*	P	Polyproline II helix	trans	-55.4	163.3	168	0	0	0	0	0	110	R410 K414	R410-G412 PolarHBondContact O-N 3.19Å; G412-K414 PolarHBondContact O-N 2.95Å
413	P	45.9	Very low	69.5	Low	104 Å²	104	109.2 Å²	109.2	68%	0.675	61%	0.607	S	S	*	*	P	Polyproline II helix	trans	-51.8	121.2	172.5	13.7	-17.1	0	0	0	107.5	E415	P413-E415 PolarHBondContact O-N 3.33Å
414	K	41.1	Very low	67.9	Low	192 Å²	192	114.9 Å²	114.9	84%	0.835	63%	0.628	S	S	*	*	P	Polyproline II helix	trans	-50.3	117.3	164.9	-74.2	-176.7	176.7	-177.8	0	104.6	G412 A416	G412-K414 PolarHBondContact O-N 2.95Å; K414-A416 VanDerWaalsContact C-N 3.3Å; K414-A416 PolarHBondContact O-N 2.98Å
415	E	37.4	Very low	65.9	Low	168 Å²	168	115.4 Å²	115.4	79%	0.785	62%	0.623	S	S	*	*			trans	-53.8	106.6	165.6	-71.1	177.4	164.4	0	0	105	P413 I417	P413-E415 PolarHBondContact O-N 3.33Å; E415-I417 VanDerWaalsContact C-N 3.31Å; E415-I417 PolarHBondContact O-N 2.64Å
416	A	31	Very low	63.5	Low	99 Å²	99	121.7 Å²	121.7	82%	0.818	65%	0.654	S	S	*	*			trans	-64.4	105.9	165.1	0	0	0	0	0	104.3	K414	K414-A416 VanDerWaalsContact C-N 3.3Å; K414-A416 PolarHBondContact O-N 2.98Å
417	I	34.6	Very low	60.8	Low	233 Å²	233	132.7 Å²	132.7	100%	1.195	71%	0.713	S	S	*	*			trans	-55.9	0	171.2	-66.3	161	0	0	0	109.1	E415	E415-I417 VanDerWaalsContact C-N 3.31Å; E415-I417 PolarHBondContact O-N 2.64Å

Retrieved 417 of 417 residues in 78.3 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).