A0A077ZD71_TRITR Loading...

GTP binding protein Rhes

AlphaFold DB , UniProt , Accession A0A077ZD71, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 255 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	35.4	Very low	39.7	Very low	243 Å²	243	156.7 Å²	156.7	100%	1.197	80%	0.8	S	S	*	*				0	142	0	-61.9	176.6	-166.2	0	0	107.2	A3	M1-A3 PolarHBondContact O-N 3Å
2	I	35.3	Very low	39.4	Very low	163 Å²	163	152.2 Å²	152.2	84%	0.836	80%	0.803	S	S	*	*			trans	-74.2	110.4	-169.5	-62.1	160.2	0	0	0	109.4	T4	I2-T4 PolarHBondContact O-N 3.06Å
3	A	35.3	Very low	39	Very low	90 Å²	90	152.3 Å²	152.3	74%	0.744	80%	0.804	S	S	*	*			trans	-79.4	97.8	171.9	0	0	0	0	0	109.2	M1 Q5	M1-A3 PolarHBondContact O-N 3Å; A3-Q5 PolarHBondContact O-N 3.34Å; A3-Q5 VanDerWaalsContact O-N 3.11Å
4	T	44.4	Very low	38.9	Very low	129 Å²	129	153.1 Å²	153.1	79%	0.791	81%	0.808	S	S	*	*			trans	-69.2	103.3	168.2	41.9	0	0	0	0	109.2	I2 C6	I2-T4 PolarHBondContact O-N 3.06Å; T4-C6 PolarHBondContact O-N 3.12Å
5	Q	41.5	Very low	38.7	Very low	165 Å²	165	150.3 Å²	150.3	77%	0.771	80%	0.801	S	S	*	*			trans	-63.3	127.4	174.8	-68.4	175.8	-14.1	0	0	110	A3 E7	A3-Q5 PolarHBondContact O-N 3.34Å; A3-Q5 VanDerWaalsContact O-N 3.11Å; Q5-E7 PolarHBondContact O-N 2.77Å
6	C	41.8	Very low	38.4	Very low	49 Å²	49	146.3 Å²	146.3	33%	0.331	80%	0.796	S	S	.	*			trans	-97.9	73.1	178.6	-178.5	0	0	0	0	109.2	T4 R136 C137	T4-C6 PolarHBondContact O-N 3.12Å; C6-R136 PolarHBondContact O-NH2 2.88Å; C6-C137 HydrophobicContact CB-CB 4.34Å; C6-C137 WeakPolarHBondContact CB-SG 3.46Å; C6-C137 WeakPolarHBondContact SG-CB 3.49Å; C6-C137 CovalentContact SG-SG 2.04Å; C6-C137 PolarHBondContact SG-SG 2.81Å
7	E	42.9	Very low	38.6	Very low	167 Å²	167	151.6 Å²	151.6	78%	0.78	80%	0.802	S	S	*	*			trans	-80.9	116	173.7	-71.6	-169.5	121.7	0	0	111.1	Q5	Q5-E7 PolarHBondContact O-N 2.77Å
8	Q	49.9	Very low	38.7	Very low	179 Å²	179	156.4 Å²	156.4	84%	0.836	81%	0.807	S	S	*	*			trans	-156.7	158.1	155.2	-84.9	-135.8	-30.4	0	0	110.3
9	P	37.4	Very low	38.7	Very low	117 Å²	117	160.1 Å²	160.1	76%	0.76	81%	0.81	S	S	*	*			trans	-85.4	165.9	-141.3	-15.6	31.7	0	0	0	117.9	E11	P9-E11 PolarHBondContact O-N 2.89Å
10	R	36.2	Very low	39.3	Very low	246 Å²	246	159.4 Å²	159.4	93%	0.928	81%	0.807	S	S	*	*			trans	-70.4	117.1	167.6	-66.8	177.8	173.4	-170.9	-2.5	111.1
11	E	37.2	Very low	39.2	Very low	176 Å²	176	159.1 Å²	159.1	82%	0.822	81%	0.808	S	S	*	*			trans	179.2	100.7	133.7	-103.9	178.7	-175.7	0	0	110.2	P9 L13	P9-E11 PolarHBondContact O-N 2.89Å; E11-L13 PolarHBondContact O-N 2.7Å
12	A	35.2	Very low	39.8	Very low	102 Å²	102	152 Å²	152	84%	0.843	78%	0.782	S	S	*	*			trans	-89.1	79.9	176.3	0	0	0	0	0	110.6	L14	A12-L14 PolarHBondContact O-N 2.74Å
13	L	34.5	Very low	40	Very low	154 Å²	154	148.5 Å²	148.5	81%	0.806	79%	0.786	S	S	*	*			trans	-70.9	120.7	164	-120	78.2	0	0	0	108.8	E11	E11-L13 PolarHBondContact O-N 2.7Å
14	L	37.1	Very low	40.6	Very low	164 Å²	164	147.8 Å²	147.8	86%	0.859	78%	0.78	S	S	*	*			trans	-49.6	123.7	176.4	-70.9	165.4	0	0	0	110.7	A12 A16	A12-L14 PolarHBondContact O-N 2.74Å; L14-A16 PolarHBondContact O-N 3.28Å
15	P	36.6	Very low	40.6	Very low	110 Å²	110	153.5 Å²	153.5	71%	0.714	79%	0.787	S	S	*	*			trans	-68.3	111	179.3	25.8	-32.4	0	0	0	110.1	R17	P15-R17 PolarHBondContact O-N 3.16Å
16	A	34.3	Very low	40.8	Very low	87 Å²	87	157.2 Å²	157.2	72%	0.719	79%	0.794	S	S	*	*			trans	-54.1	134.8	168.9	0	0	0	0	0	109.8	L14 R18	L14-A16 PolarHBondContact O-N 3.28Å; A16-R18 PolarHBondContact O-N 2.95Å
17	R	41.3	Very low	41.2	Very low	236 Å²	236	161.2 Å²	161.2	89%	0.891	81%	0.812	S	S	*	*			trans	-48.3	92.1	-175	-72.2	178.3	167	-166.8	-7.7	112.6	P15 R19	P15-R17 PolarHBondContact O-N 3.16Å; R17-R19 PolarHBondContact O-N 2.82Å; R17-R19 VanDerWaalsContact O-N 3.08Å
18	R	39.6	Very low	41.4	Very low	238 Å²	238	165.2 Å²	165.2	90%	0.898	82%	0.82	S	S	*	*			trans	-74.3	98.5	167.2	-77.5	-172.5	174	-174.6	-0.5	108.2	A16 L20	A16-R18 PolarHBondContact O-N 2.95Å; R18-L20 PolarHBondContact O-N 2.67Å
19	R	40.4	Very low	41.8	Very low	227 Å²	227	160.5 Å²	160.5	86%	0.857	82%	0.82	S	S	*	*			trans	-51.7	125.1	157.2	-77.9	-172.8	174	-132.1	-0.9	107.2	R17 N21	R17-R19 PolarHBondContact O-N 2.82Å; R17-R19 VanDerWaalsContact O-N 3.08Å; R19-N21 VanDerWaalsContact C-N 3.27Å; R19-N21 PolarHBondContact O-N 2.86Å
20	L	49	Very low	43.3	Very low	145 Å²	145	159 Å²	159	76%	0.759	81%	0.812	S	S	*	*			trans	-67.6	88.7	172.8	-77.5	160.6	0	0	0	108.2	R18 S22	R18-L20 PolarHBondContact O-N 2.67Å; L20-S22 PolarHBondContact O-N 2.86Å
21	N	38	Very low	45	Very low	155 Å²	155	151.4 Å²	151.4	83%	0.829	79%	0.79	S	S	*	*			trans	-67.4	89.1	169	-95.3	6.5	0	0	0	108.4	R19 G23	R19-N21 VanDerWaalsContact C-N 3.27Å; R19-N21 PolarHBondContact O-N 2.86Å; N21-G23 VanDerWaalsContact C-N 3.26Å; N21-G23 PolarHBondContact O-N 2.86Å
22	S	48.4	Very low	47.2	Very low	93 Å²	93	146 Å²	146	65%	0.65	77%	0.769	S	S	*	*			trans	-68.6	85.9	168.7	48.3	0	0	0	0	109.2	L20 A24	L20-S22 PolarHBondContact O-N 2.86Å; S22-A24 PolarHBondContact O-N 2.82Å
23	G	38.9	Very low	49.7	Very low	89 Å²	89	146.3 Å²	146.3	92%	0.918	76%	0.756	S	S	*	*			trans	-67.8	54.2	165	0	0	0	0	0	111.7	N21	N21-G23 VanDerWaalsContact C-N 3.26Å; N21-G23 PolarHBondContact O-N 2.86Å
24	A	47.4	Very low	52.2	Low	75 Å²	75	141 Å²	141	62%	0.62	73%	0.728	S	S	*	*			trans	-106.1	122.6	-178.6	0	0	0	0	0	109.7	S22 R26	S22-A24 PolarHBondContact O-N 2.82Å; A24-R26 PolarHBondContact O-N 2.79Å; A24-R26 VanDerWaalsContact O-N 3.12Å
25	R	46.3	Very low	54.8	Low	249 Å²	249	138.1 Å²	138.1	94%	0.94	71%	0.708	S	S	*	*			trans	-50.6	111.9	178.3	-164.3	177.1	-171.9	-178.3	1.5	109.9	D27	R25-D27 PolarHBondContact O-N 3.24Å
26	R	44.9	Very low	57.4	Low	243 Å²	243	132.9 Å²	132.9	92%	0.917	67%	0.674	S	S	*	*			trans	-58.4	105.6	-178.9	-80	-179.9	169.4	173.1	-5.1	111.1	A24	A24-R26 PolarHBondContact O-N 2.79Å; A24-R26 VanDerWaalsContact O-N 3.12Å
27	D	48.9	Very low	60.2	Low	133 Å²	133	130.2 Å²	130.2	71%	0.711	65%	0.648	S	S	*	*			trans	-75.2	144	156.7	-166.6	12.4	0	0	0	109.2	R25 G29	R25-D27 PolarHBondContact O-N 3.24Å; D27-G29 PolarHBondContact O-N 2.81Å
28	R	47.5	Very low	62.7	Low	252 Å²	252	119 Å²	119	95%	0.951	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.5	79.8	-168.7	-63.6	-170.9	-164.1	-159.1	6	111.3
29	G	59.1	Low	65.3	Low	80 Å²	80	107.6 Å²	107.6	83%	0.825	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	164.7	-18.1	166.3	0	0	0	0	0	116.9	D27	D27-G29 PolarHBondContact O-N 2.81Å
30	S	68.7	Low	68	Low	86 Å²	86	96.8 Å²	96.8	60%	0.601	52%	0.522	S	S	*	.	P	Polyproline II helix	trans	-95.7	129.9	179.5	48.8	0	0	0	0	112.1
31	L	72.2	Confident	70.2	Confident	86 Å²	86	90 Å²	90	45%	0.45	49%	0.486	S	S	.	.	P	Polyproline II helix	trans	-63.1	145.6	166.4	-63.4	165.1	0	0	0	109.3	I33 G82	L31-I33 WeakPolarHBondContact O-CG1 3.49Å; L31-I33 PolarHBondContact O-N 3.18Å; L31-G82 VanDerWaalsContact CD1-O 3.23Å; L31-G82 WeakPolarHBondContact CD1-O 3.47Å; L31-G82 WeakPolarHBondContact CD2-O 3.38Å
32	P	84	Confident	72.9	Confident	61 Å²	61	82.6 Å²	82.6	40%	0.396	45%	0.447	S	S	.	.	P	Polyproline II helix	trans	-55.3	131.2	172	24.7	-36.2	0	0	0	111.1	E83 E84 T85	P32-E83 VanDerWaalsContact CD-O 3.28Å; P32-E83 WeakPolarHBondContact CD-O 3.18Å; P32-E83 WeakPolarHBondContact CG-O 3.4Å; P32-E84 HydrophobicContact CG-CB 4.4Å; P32-E84 HydrophobicContact CG-CG 3.96Å; P32-T85 PolarHBondContact O-N 3.01Å
33	I	86.1	Confident	75	Confident	109 Å²	109	78.6 Å²	78.6	56%	0.559	42%	0.419	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.5	117.9	179	-52.6	-178.7	0	0	0	109.2	L31 T85 L87	L31-I33 WeakPolarHBondContact O-CG1 3.49Å; L31-I33 PolarHBondContact O-N 3.18Å; I33-T85 CarbonylContact C-O 3.57Å; I33-T85 VanDerWaalsContact CA-O 3.27Å; I33-T85 WeakPolarHBondContact CA-O 3.23Å; I33-L87 HydrophobicContact CG2-CB 3.82Å
34	I	88.4	Confident	77.5	Confident	44 Å²	44	76.6 Å²	76.6	23%	0.226	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	116.6	168.6	-58.5	175.8	0	0	0	106.8	V36 T85 L86 L87 L204	I34-V36 HydrophobicContact CG2-CG2 4.48Å; I34-T85 PolarHBondContact N-O 2.91Å; I34-L86 HydrophobicContact CB-CD1 4.42Å; I34-L86 HydrophobicContact CG2-CD1 4.21Å; I34-L86 CarbonylContact O-C 3.57Å; I34-L86 WeakPolarHBondContact O-CA 3.5Å; I34-L87 PolarHBondContact O-N 3.06Å; I34-L204 HydrophobicContact CG2-CD2 4.01Å
35	K	90.6	Very high	79.6	Confident	103 Å²	103	79 Å²	79	45%	0.448	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	140.6	179.5	174.9	169.4	166.8	153	0	111.2	N37 L87 E89	K35-N37 WeakPolarHBondContact CE-OD1 3.28Å; K35-L87 WeakPolarHBondContact CA-O 3.47Å; K35-L87 HydrophobicContact CD-CD2 4.39Å; K35-E89 WeakPolarHBondContact CE-OE1 3.41Å; K35-E89 WeakPolarHBondContact CE-OE2 3.38Å; K35-E89 IonicContact NZ-OE1 2.74Å; K35-E89 PolarHBondContact NZ-OE1 3.48Å; K35-E89 IonicContact NZ-OE2 2.67Å; K35-E89 PolarHBondContact NZ-OE2 3Å
36	V	92	Very high	81.9	Confident	0 Å²	0	67.1 Å²	67.1	0%	0	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	120.2	-177.7	-178.2	0	0	0	0	109.8	I34 V38 L86 L87 F88 E89 D111 K203 L204	I34-V36 HydrophobicContact CG2-CG2 4.48Å; V36-V38 HydrophobicContact CG1-CG2 4.12Å; V36-L86 HydrophobicContact CG2-CD1 3.62Å; V36-L87 PolarHBondContact N-O 3.02Å; V36-F88 HydrophobicContact CB-CD2 4.32Å; V36-F88 HydrophobicContact CG1-CD2 4.18Å; V36-F88 HydrophobicContact CG1-CE2 4.42Å; V36-E89 PolarHBondContact O-N 3.37Å; V36-D111 HydrophobicContact CG1-CB 4.24Å; V36-K203 HydrophobicContact CG1-CD 4.17Å; V36-L204 HydrophobicContact CB-CD1 4.23Å; V36-L204 HydrophobicContact CG1-CD1 3.76Å; V36-L204 HydrophobicContact CG2-CD1 3.51Å; V36-L204 HydrophobicContact CG2-CD2 3.44Å; V36-L204 VanDerWaalsContact CG2-CD2 3.44Å; V36-L204 HydrophobicContact CG2-CG 4.06Å
37	N	92.6	Very high	84.3	Confident	30 Å²	30	56.5 Å²	56.5	16%	0.16	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	103	179.9	-56.8	-13.1	0	0	0	111.3	K35 D111 A112	K35-N37 WeakPolarHBondContact CE-OD1 3.28Å; N37-D111 HydrophobicContact CB-CB 4.36Å; N37-D111 PolarHBondContact N-OD2 3.45Å; N37-D111 WeakPolarHBondContact O-CA 3.46Å; N37-D111 WeakPolarHBondContact O-CB 3.48Å; N37-D111 PolarHBondContact O-N 3.18Å; N37-A112 PolarHBondContact O-N 3.48Å
38	V	94.3	Very high	86.4	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	131.7	174	177.6	0	0	0	0	110.7	V36 F88 E89 L90 I91 A112 V114 L199	V36-V38 HydrophobicContact CG1-CG2 4.12Å; V38-F88 HydrophobicContact CB-CE1 4.27Å; V38-F88 HydrophobicContact CB-CE2 4.02Å; V38-F88 HydrophobicContact CB-CZ 3.62Å; V38-F88 HydrophobicContact CG1-CZ 4.11Å; V38-F88 HydrophobicContact CG2-CD2 4.1Å; V38-F88 HydrophobicContact CG2-CE1 4.31Å; V38-F88 HydrophobicContact CG2-CE2 3.18Å; V38-F88 HydrophobicContact CG2-CZ 3.29Å; V38-E89 PolarHBondContact N-O 3.02Å; V38-L90 HydrophobicContact CB-CD1 3.95Å; V38-L90 HydrophobicContact CG1-CD1 3.77Å; V38-L90 WeakPolarHBondContact O-CA 3.32Å; V38-I91 PolarHBondContact O-N 2.95Å; V38-A112 WeakPolarHBondContact CA-O 3.41Å; V38-A112 HydrophobicContact CG2-CB 4.2Å; V38-V114 HydrophobicContact CG1-CG2 4.05Å; V38-L199 HydrophobicContact CB-CD1 4.36Å; V38-L199 HydrophobicContact CG1-CD1 3.59Å; V38-L199 HydrophobicContact CG2-CD1 3.77Å; V38-L199 HydrophobicContact CG2-CD2 3.74Å; V38-L199 HydrophobicContact CG2-CG 4.42Å
39	V	94.6	Very high	88.5	Confident	0 Å²	0	41 Å²	41	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	122.5	-179	-168.7	0	0	0	0	109	L41 I91 A112 F113 V114	V39-L41 HydrophobicContact CG1-CD2 3.77Å; V39-L41 HydrophobicContact CG1-CG 3.93Å; V39-I91 HydrophobicContact CG1-CB 4.38Å; V39-I91 HydrophobicContact CG2-CD1 4.25Å; V39-A112 PolarHBondContact N-O 2.59Å; V39-A112 VanDerWaalsContact N-O 3.09Å; V39-F113 HydrophobicContact CB-CD1 3.76Å; V39-F113 HydrophobicContact CB-CE1 3.77Å; V39-F113 HydrophobicContact CG1-CD1 4.49Å; V39-F113 HydrophobicContact CG1-CE1 4.43Å; V39-F113 HydrophobicContact CG2-CD1 4.24Å; V39-F113 HydrophobicContact CG2-CE1 3.77Å; V39-F113 WeakPolarHBondContact O-CA 3.27Å; V39-V114 PolarHBondContact O-N 3.16Å
40	I	95.6	Very high	90.2	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	123	169.7	-44.7	-172.8	0	0	0	108.5	K48 I51 A52 L90 I91 S93 V114 V116	I40-K48 HydrophobicContact CB-CB 4.49Å; I40-K48 HydrophobicContact CG2-CB 3.75Å; I40-K48 HydrophobicContact CG2-CD 3.9Å; I40-K48 HydrophobicContact CG2-CG 3.78Å; I40-I51 HydrophobicContact CD1-CG2 4.33Å; I40-A52 HydrophobicContact CD1-CB 3.94Å; I40-L90 HydrophobicContact CD1-CD1 3.92Å; I40-L90 HydrophobicContact CD1-CD2 4.19Å; I40-L90 HydrophobicContact CD1-CG 4.21Å; I40-L90 HydrophobicContact CG1-CD1 3.71Å; I40-L90 HydrophobicContact CG1-CG 4.35Å; I40-I91 PolarHBondContact N-O 3.19Å; I40-S93 WeakPolarHBondContact O-CB 3.18Å; I40-S93 PolarHBondContact O-N 3.27Å; I40-S93 PolarHBondContact O-OG 3.3Å; I40-V114 CarbonylContact C-O 3.51Å; I40-V114 WeakPolarHBondContact CA-O 3.19Å; I40-V114 HydrophobicContact CG1-CB 4.4Å; I40-V114 HydrophobicContact CG2-CB 4.32Å; I40-V114 HydrophobicContact CG2-CG1 4.36Å; I40-V116 HydrophobicContact CG2-CG2 3.66Å
41	L	95.2	Very high	91.4	Very high	1 Å²	1	34.2 Å²	34.2	1%	0.005	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	161.5	-179.6	-61.9	172.4	0	0	0	109.4	V39 K48 M107 F113 V114 I115 V116 L131 V135	V39-L41 HydrophobicContact CG1-CD2 3.77Å; V39-L41 HydrophobicContact CG1-CG 3.93Å; L41-K48 VanDerWaalsContact C-CD 3.43Å; L41-M107 HydrophobicContact CD1-CE 3.92Å; L41-M107 HydrophobicContact CD1-CG 4.22Å; L41-M107 HydrophobicContact CD2-CE 4.3Å; L41-F113 HydrophobicContact CD1-CD1 3.7Å; L41-F113 HydrophobicContact CD1-CE1 4.28Å; L41-V114 PolarHBondContact N-O 2.56Å; L41-I115 HydrophobicContact CB-CG1 4.35Å; L41-I115 WeakPolarHBondContact O-CA 3.4Å; L41-V116 PolarHBondContact O-N 2.68Å; L41-L131 HydrophobicContact CB-CD1 4.14Å; L41-L131 HydrophobicContact CB-CD2 4.06Å; L41-L131 HydrophobicContact CD1-CD2 4.28Å; L41-L131 HydrophobicContact CD2-CD2 4.4Å; L41-L131 HydrophobicContact CG-CD2 4.49Å; L41-V135 HydrophobicContact CD1-CG2 3.73Å
42	G	95.3	Very high	92.4	Very high	1 Å²	1	30.2 Å²	30.2	1%	0.01	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	143.9	165.5	-178.5	0	0	0	0	0	111.6	K48 V116 L131	G42-K48 PolarHBondContact O-NZ 2.88Å; G42-V116 VanDerWaalsContact CA-O 3.25Å; G42-V116 WeakPolarHBondContact CA-O 3.27Å; G42-L131 VanDerWaalsContact CA-CD1 3.4Å
43	A	93.4	Very high	92.8	Very high	8 Å²	8	27.7 Å²	27.7	7%	0.066	15%	0.153	C	C	.	.			trans	-60.7	175.1	-179.9	0	0	0	0	0	112.9	V46 K48 E127	A43-V46 HydrophobicContact CB-CG1 3.84Å; A43-V46 WeakPolarHBondContact O-CG2 3.14Å; A43-K48 PolarHBondContact O-NZ 2.84Å; A43-E127 WeakPolarHBondContact CA-OE2 3.44Å; A43-E127 HydrophobicContact CB-CB 4.44Å; A43-E127 WeakPolarHBondContact CB-OE2 3.4Å
44	S	91.2	Very high	93.3	Very high	47 Å²	47	22.8 Å²	22.8	33%	0.329	13%	0.128	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.1	151.1	169.9	-161.8	0	0	0	0	111.4	V46 Y65	S44-V46 PolarHBondContact O-N 3.5Å; S44-Y65 PolarHBondContact OG-OH 3.22Å
45	Q	91.1	Very high	93.5	Very high	125 Å²	125	21.1 Å²	21.1	58%	0.584	12%	0.119	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.2	3.8	174.3	-58.3	178.5	42	0	0	117.8	G47 Y65 K151	Q45-G47 PolarHBondContact O-N 2.88Å; Q45-Y65 HydrophobicContact CG-CD1 3.81Å; Q45-Y65 HydrophobicContact CG-CD2 3.9Å; Q45-Y65 HydrophobicContact CG-CE1 3.57Å; Q45-Y65 HydrophobicContact CG-CE2 3.69Å; Q45-Y65 HydrophobicContact CG-CG 3.97Å; Q45-K151 WeakPolarHBondContact O-CE 3.43Å
46	V	95	Very high	93.5	Very high	1 Å²	1	16.3 Å²	16.3	1%	0.006	10%	0.098	C	C	.	.	S	Bend	trans	-69.2	-11.7	175.2	-55	0	0	0	0	114.5	A43 S44 K48 V116 A118 N150	A43-V46 HydrophobicContact CB-CG1 3.84Å; A43-V46 WeakPolarHBondContact O-CG2 3.14Å; S44-V46 PolarHBondContact O-N 3.5Å; V46-K48 HydrophobicContact CG2-CD 4.48Å; V46-K48 HydrophobicContact CG2-CG 3.7Å; V46-V116 HydrophobicContact CB-CG1 4.08Å; V46-V116 HydrophobicContact CG2-CB 3.82Å; V46-V116 HydrophobicContact CG2-CG1 3.76Å; V46-A118 HydrophobicContact CB-CB 4.35Å; V46-A118 HydrophobicContact CG1-CB 4.36Å; V46-N150 PolarHBondContact O-ND2 3.35Å
47	G	93.6	Very high	93.5	Very high	20 Å²	20	18 Å²	18	21%	0.206	10%	0.104	C	C	.	.	S	Bend	trans	98.5	21.2	175.9	0	0	0	0	0	116.8	Q45 T49 A50 I51	Q45-G47 PolarHBondContact O-N 2.88Å; G47-T49 PolarHBondContact O-N 2.93Å; G47-A50 WeakPolarHBondContact O-CA 3.41Å; G47-A50 WeakPolarHBondContact O-CB 3.45Å; G47-A50 PolarHBondContact O-N 2.86Å; G47-I51 PolarHBondContact O-N 2.78Å
48	K	94.1	Very high	93.5	Very high	8 Å²	8	21.6 Å²	21.6	4%	0.035	12%	0.124	C	C	.	.	H	α-helix	trans	-49.9	-54.4	176.7	-57.2	-167	-62.7	-78.7	0	113.3	I40 L41 G42 A43 V46 A50 I51 A52 D92 S93 V116	I40-K48 HydrophobicContact CB-CB 4.49Å; I40-K48 HydrophobicContact CG2-CB 3.75Å; I40-K48 HydrophobicContact CG2-CD 3.9Å; I40-K48 HydrophobicContact CG2-CG 3.78Å; L41-K48 VanDerWaalsContact C-CD 3.43Å; G42-K48 PolarHBondContact O-NZ 2.88Å; A43-K48 PolarHBondContact O-NZ 2.84Å; V46-K48 HydrophobicContact CG2-CD 4.48Å; V46-K48 HydrophobicContact CG2-CG 3.7Å; K48-A50 VanDerWaalsContact C-N 3.26Å; K48-A50 PolarHBondContact O-N 2.77Å; K48-I51 WeakPolarHBondContact O-CB 3.24Å; K48-I51 PolarHBondContact O-N 2.65Å; K48-I51 VanDerWaalsContact O-N 3.13Å; K48-A52 PolarHBondContact O-N 2.93Å; K48-D92 WeakPolarHBondContact CB-OD1 3.34Å; K48-S93 WeakPolarHBondContact CE-O 3.37Å; K48-V116 HydrophobicContact CG-CB 4.29Å; K48-V116 HydrophobicContact CG-CG2 4.28Å
49	T	91.9	Very high	93.3	Very high	52 Å²	52	26.5 Å²	26.5	32%	0.319	15%	0.145	S	C	.	.	H	α-helix	trans	-62	-29.8	176.7	-46.8	0	0	0	0	113.5	G47 S53 T68 D92	G47-T49 PolarHBondContact O-N 2.93Å; T49-S53 WeakPolarHBondContact O-CB 3.49Å; T49-S53 PolarHBondContact O-N 2.81Å; T49-S53 PolarHBondContact O-OG 2.78Å; T49-T68 WeakPolarHBondContact OG1-CG2 3.4Å; T49-T68 PolarHBondContact OG1-OG1 3.14Å; T49-D92 WeakPolarHBondContact CA-OD2 3.25Å; T49-D92 WeakPolarHBondContact CB-OD2 3.32Å; T49-D92 WeakPolarHBondContact CG2-OD2 3.35Å; T49-D92 PolarHBondContact N-OD1 3.4Å; T49-D92 PolarHBondContact OG1-OD2 3.02Å
50	A	93.5	Very high	92.9	Very high	22 Å²	22	30.7 Å²	30.7	18%	0.182	16%	0.163	C	C	.	.	H	α-helix	trans	-71.1	-44.3	174.6	0	0	0	0	0	111.1	G47 K48 S53 Q54 F60 A186	G47-A50 WeakPolarHBondContact O-CA 3.41Å; G47-A50 WeakPolarHBondContact O-CB 3.45Å; G47-A50 PolarHBondContact O-N 2.86Å; K48-A50 VanDerWaalsContact C-N 3.26Å; K48-A50 PolarHBondContact O-N 2.77Å; A50-S53 PolarHBondContact O-N 3.21Å; A50-Q54 WeakPolarHBondContact O-CB 3.39Å; A50-Q54 PolarHBondContact O-N 2.67Å; A50-F60 HydrophobicContact CB-CD2 4.11Å; A50-F60 HydrophobicContact CB-CE2 3.96Å; A50-A186 HydrophobicContact CB-CB 3.9Å
51	I	95.3	Very high	92.3	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-59.5	-48	173.2	-68.9	167.6	0	0	0	110.6	I40 G47 K48 Q54 F55 V116 V148 N150 A186 V192 I195 F196	I40-I51 HydrophobicContact CD1-CG2 4.33Å; G47-I51 PolarHBondContact O-N 2.78Å; K48-I51 WeakPolarHBondContact O-CB 3.24Å; K48-I51 PolarHBondContact O-N 2.65Å; K48-I51 VanDerWaalsContact O-N 3.13Å; I51-Q54 PolarHBondContact O-N 3.15Å; I51-F55 WeakPolarHBondContact O-CB 3.4Å; I51-F55 PolarHBondContact O-N 3.05Å; I51-V116 HydrophobicContact CD1-CG1 3.83Å; I51-V116 HydrophobicContact CD1-CG2 3.85Å; I51-V148 HydrophobicContact CD1-CG1 4.21Å; I51-N150 HydrophobicContact CD1-CB 4.28Å; I51-A186 HydrophobicContact CG1-CB 4.02Å; I51-V192 HydrophobicContact CG1-CG2 4.42Å; I51-V192 HydrophobicContact CG2-CG1 4.13Å; I51-V192 WeakPolarHBondContact O-CG1 3.41Å; I51-I195 HydrophobicContact CD1-CD1 4.41Å; I51-I195 HydrophobicContact CG2-CD1 3.66Å; I51-F196 HydrophobicContact CG2-CE2 4.13Å; I51-F196 HydrophobicContact CG2-CZ 4.37Å
52	A	93.5	Very high	91.3	Very high	2 Å²	2	39 Å²	39	2%	0.017	21%	0.213	C	C	.	.	H	α-helix	trans	-59.8	-49.8	176.5	0	0	0	0	0	112.1	I40 K48 Q54 F55 L56 L90 D92	I40-A52 HydrophobicContact CD1-CB 3.94Å; K48-A52 PolarHBondContact O-N 2.93Å; A52-Q54 VanDerWaalsContact C-N 3.33Å; A52-Q54 PolarHBondContact O-N 3.06Å; A52-F55 PolarHBondContact O-N 3.34Å; A52-L56 WeakPolarHBondContact O-CB 3.15Å; A52-L56 WeakPolarHBondContact O-CD1 2.9Å; A52-L56 VanDerWaalsContact O-CG 3.27Å; A52-L56 WeakPolarHBondContact O-CG 3.1Å; A52-L56 PolarHBondContact O-N 2.82Å; A52-L90 HydrophobicContact CB-CD2 3.81Å; A52-D92 HydrophobicContact CB-CB 4.36Å
53	S	92.5	Very high	90	Very high	8 Å²	8	46.8 Å²	46.8	6%	0.056	25%	0.249	C	C	.	.	H	α-helix	trans	-64	-37.9	-178.8	-62.3	0	0	0	0	112.8	T49 A50 W57 K59	T49-S53 WeakPolarHBondContact O-CB 3.49Å; T49-S53 PolarHBondContact O-N 2.81Å; T49-S53 PolarHBondContact O-OG 2.78Å; A50-S53 PolarHBondContact O-N 3.21Å; S53-W57 PolarHBondContact O-N 3.21Å; S53-K59 CarbonylContact C-O 3.53Å; S53-K59 VanDerWaalsContact CB-O 3.32Å; S53-K59 WeakPolarHBondContact CB-O 3.45Å
54	Q	94.6	Very high	88.6	Confident	7 Å²	7	56.4 Å²	56.4	3%	0.033	28%	0.283	C	S	.	.	H	α-helix	trans	-67.3	-45.6	177.8	-171.3	72.9	-22.6	0	0	110.7	A50 I51 A52 N58 K59 A186 K187 F189 V192	A50-Q54 WeakPolarHBondContact O-CB 3.39Å; A50-Q54 PolarHBondContact O-N 2.67Å; I51-Q54 PolarHBondContact O-N 3.15Å; A52-Q54 VanDerWaalsContact C-N 3.33Å; A52-Q54 PolarHBondContact O-N 3.06Å; Q54-N58 WeakPolarHBondContact O-CA 3.38Å; Q54-N58 PolarHBondContact O-N 3.02Å; Q54-K59 PolarHBondContact N-O 2.78Å; Q54-K59 VanDerWaalsContact OE1-N 3.15Å; Q54-A186 WeakPolarHBondContact CG-O 3.21Å; Q54-K187 PolarHBondContact NE2-O 2.78Å; Q54-F189 HydrophobicContact CG-CB 4.45Å; Q54-F189 HydrophobicContact CG-CD2 4.29Å; Q54-F189 VanDerWaalsContact NE2-N 3.17Å; Q54-F189 VanDerWaalsContact O-CD2 3.31Å; Q54-F189 WeakPolarHBondContact O-CD2 3.4Å; Q54-F189 WeakPolarHBondContact O-CE2 3.43Å; Q54-V192 HydrophobicContact CB-CB 4.43Å; Q54-V192 HydrophobicContact CB-CG1 4.24Å; Q54-V192 HydrophobicContact CB-CG2 4.11Å; Q54-V192 HydrophobicContact CG-CB 4.11Å; Q54-V192 HydrophobicContact CG-CG1 4.36Å; Q54-V192 HydrophobicContact CG-CG2 3.92Å
55	F	93.2	Very high	87.5	Confident	9 Å²	9	59.5 Å²	59.5	4%	0.039	29%	0.288	C	S	.	.	H	α-helix	trans	-63.6	-48.3	177	-179.2	-115.6	0	0	0	112.8	I51 A52 I75 Y77 F88 L90 V192 F196 F200	I51-F55 WeakPolarHBondContact O-CB 3.4Å; I51-F55 PolarHBondContact O-N 3.05Å; A52-F55 PolarHBondContact O-N 3.34Å; F55-I75 HydrophobicContact CE1-CG2 4.25Å; F55-Y77 WeakPolarHBondContact CZ-OH 3.48Å; F55-F88 HydrophobicContact CD1-CE1 4.44Å; F55-F88 HydrophobicContact CE1-CD1 4Å; F55-F88 AromaticContact CE1-CE1 3.72Å; F55-F88 HydrophobicContact CE1-CE1 3.72Å; F55-L90 HydrophobicContact CD1-CD2 4.4Å; F55-V192 HydrophobicContact CB-CG1 3.84Å; F55-F196 HydrophobicContact CB-CD2 3.9Å; F55-F196 HydrophobicContact CB-CE2 3.48Å; F55-F196 VanDerWaalsContact CB-CE2 3.48Å; F55-F196 HydrophobicContact CB-CZ 4.01Å; F55-F196 AromaticContact CD1-CD1 3.98Å; F55-F196 HydrophobicContact CD1-CD1 3.98Å; F55-F196 AromaticContact CD1-CD2 4Å; F55-F196 HydrophobicContact CD1-CD2 4Å; F55-F196 AromaticContact CD1-CE1 3.89Å; F55-F196 HydrophobicContact CD1-CE1 3.89Å; F55-F196 AromaticContact CD1-CE2 3.91Å; F55-F196 HydrophobicContact CD1-CE2 3.91Å; F55-F196 HydrophobicContact CD1-CG 4.04Å; F55-F196 AromaticContact CD1-CZ 3.85Å; F55-F196 HydrophobicContact CD1-CZ 3.85Å; F55-F196 HydrophobicContact CD2-CB 4Å; F55-F196 HydrophobicContact CD2-CD1 4.36Å; F55-F196 AromaticContact CD2-CD2 3.25Å; F55-F196 HydrophobicContact CD2-CD2 3.25Å; F55-F196 AromaticContact CD2-CE2 3.79Å; F55-F196 HydrophobicContact CD2-CE2 3.79Å; F55-F196 AromaticContact CD2-CG 3.6Å; F55-F196 HydrophobicContact CD2-CG 3.6Å; F55-F196 AromaticContact CE1-CD1 3.8Å; F55-F196 HydrophobicContact CE1-CD1 3.8Å; F55-F196 HydrophobicContact CE1-CD2 4.36Å; F55-F196 HydrophobicContact CE1-CE1 4.08Å; F55-F196 AromaticContact CE1-CG 3.95Å; F55-F196 HydrophobicContact CE1-CG 3.95Å; F55-F196 HydrophobicContact CE1-CZ 4.48Å; F55-F196 HydrophobicContact CE2-CB 3.48Å; F55-F196 VanDerWaalsContact CE2-CB 3.48Å; F55-F196 HydrophobicContact CE2-CD1 4.2Å; F55-F196 AromaticContact CE2-CD2 3.69Å; F55-F196 HydrophobicContact CE2-CD2 3.69Å; F55-F196 AromaticContact CE2-CG 3.5Å; F55-F196 HydrophobicContact CE2-CG 3.5Å; F55-F196 HydrophobicContact CG-CD1 4.26Å; F55-F196 AromaticContact CG-CD2 3.43Å; F55-F196 HydrophobicContact CG-CD2 3.43Å; F55-F196 VanDerWaalsContact CG-CD2 3.43Å; F55-F196 HydrophobicContact CG-CE1 4.26Å; F55-F196 AromaticContact CG-CE2 3.44Å; F55-F196 HydrophobicContact CG-CE2 3.44Å; F55-F196 VanDerWaalsContact CG-CE2 3.44Å; F55-F196 AromaticContact CG-CG 3.87Å; F55-F196 HydrophobicContact CG-CG 3.87Å; F55-F196 AromaticContact CG-CZ 3.87Å; F55-F196 HydrophobicContact CG-CZ 3.87Å; F55-F196 HydrophobicContact CZ-CB 3.77Å; F55-F196 AromaticContact CZ-CD1 3.91Å; F55-F196 HydrophobicContact CZ-CD1 3.91Å; F55-F196 HydrophobicContact CZ-CD2 4.22Å; F55-F196 AromaticContact CZ-CG 3.68Å; F55-F196 HydrophobicContact CZ-CG 3.68Å; F55-F200 HydrophobicContact CZ-CE2 4.35Å
56	L	91.8	Very high	86.7	Confident	1 Å²	1	59.1 Å²	59.1	1%	0.005	29%	0.285	C	S	.	.	H	α-helix	trans	-72.4	-46.5	-175	-67	162.7	0	0	0	112.4	A52 N73 I75 L90 Q218	A52-L56 WeakPolarHBondContact O-CB 3.15Å; A52-L56 WeakPolarHBondContact O-CD1 2.9Å; A52-L56 VanDerWaalsContact O-CG 3.27Å; A52-L56 WeakPolarHBondContact O-CG 3.1Å; A52-L56 PolarHBondContact O-N 2.82Å; L56-N73 HydrophobicContact CD1-CB 3.35Å; L56-N73 HydrophobicContact CD2-CB 4.3Å; L56-N73 HydrophobicContact CG-CB 4.47Å; L56-I75 HydrophobicContact CD2-CB 4.37Å; L56-I75 HydrophobicContact CD2-CG2 4.31Å; L56-L90 HydrophobicContact CD1-CD2 4.15Å; L56-L90 HydrophobicContact CG-CD2 4.28Å; L56-Q218 VanDerWaalsContact O-CD 3.31Å; L56-Q218 PolarHBondContact O-NE2 2.86Å; L56-Q218 PolarHBondContact O-OE1 3.29Å; L56-Q218 VanDerWaalsContact O-OE1 3.05Å
57	W	90.9	Very high	85.7	Confident	37 Å²	37	63.7 Å²	63.7	14%	0.14	32%	0.315	C	S	.	.	H	α-helix	trans	-118.5	-3.3	-166.7	-55.8	-63.2	0	0	0	114.6	S53 K59 N73 S219 P221	S53-W57 PolarHBondContact O-N 3.21Å; W57-K59 VanDerWaalsContact C-N 3.25Å; W57-K59 HydrophobicContact CB-CB 4.25Å; W57-K59 HydrophobicContact CB-CD 4.22Å; W57-K59 HydrophobicContact CB-CG 4.14Å; W57-K59 PolarHBondContact O-N 3.39Å; W57-N73 VanDerWaalsContact CH2-OD1 3.26Å; W57-N73 WeakPolarHBondContact CH2-OD1 3.2Å; W57-N73 WeakPolarHBondContact CZ2-OD1 3.43Å; W57-S219 PolarHBondContact NE1-O 2.69Å; W57-P221 HydrophobicContact CD2-CB 3.96Å; W57-P221 HydrophobicContact CD2-CG 3.63Å; W57-P221 HydrophobicContact CE3-CB 3.97Å; W57-P221 HydrophobicContact CE3-CG 4.1Å; W57-P221 HydrophobicContact CG-CG 3.84Å; W57-P221 HydrophobicContact CH2-CB 3.99Å; W57-P221 VanDerWaalsContact CZ2-CA 3.48Å; W57-P221 HydrophobicContact CZ2-CB 3.95Å; W57-P221 HydrophobicContact CZ2-CG 4.19Å; W57-P221 HydrophobicContact CZ3-CB 3.99Å
58	N	92.5	Very high	84.6	Confident	105 Å²	105	64.1 Å²	64.1	56%	0.561	31%	0.313	S	S	*	.	S	Bend	trans	51	48.1	-168	-167.4	23.9	0	0	0	111.2	Q54 F189	Q54-N58 WeakPolarHBondContact O-CA 3.38Å; Q54-N58 PolarHBondContact O-N 3.02Å; N58-F189 HydrophobicContact CB-CD2 4.1Å; N58-F189 HydrophobicContact CB-CE2 4.42Å; N58-F189 WeakPolarHBondContact OD1-CB 3.42Å; N58-F189 WeakPolarHBondContact OD1-CD2 3.43Å
59	K	90.2	Very high	83.7	Confident	102 Å²	102	69.9 Å²	69.9	44%	0.443	35%	0.349	S	S	.	.			trans	-133.4	123.4	-179.2	-71.6	-174.9	-179	-175.4	0	111.4	S53 Q54 W57 Y61	S53-K59 CarbonylContact C-O 3.53Å; S53-K59 VanDerWaalsContact CB-O 3.32Å; S53-K59 WeakPolarHBondContact CB-O 3.45Å; Q54-K59 PolarHBondContact N-O 2.78Å; Q54-K59 VanDerWaalsContact OE1-N 3.15Å; W57-K59 VanDerWaalsContact C-N 3.25Å; W57-K59 HydrophobicContact CB-CB 4.25Å; W57-K59 HydrophobicContact CB-CD 4.22Å; W57-K59 HydrophobicContact CB-CG 4.14Å; W57-K59 PolarHBondContact O-N 3.39Å; K59-Y61 HydrophobicContact CB-CE2 4.15Å; K59-Y61 HydrophobicContact CD-CE1 4.39Å; K59-Y61 VanDerWaalsContact CD-OH 3.25Å; K59-Y61 WeakPolarHBondContact CD-OH 3.27Å
60	F	87.2	Confident	82.9	Confident	88 Å²	88	69.5 Å²	69.5	39%	0.386	34%	0.343	S	S	.	.			trans	-106	121.8	168.1	-178.1	-98.3	0	0	0	109.9	A50 A62 A186 K187	A50-F60 HydrophobicContact CB-CD2 4.11Å; A50-F60 HydrophobicContact CB-CE2 3.96Å; F60-A62 HydrophobicContact CD1-CB 4.15Å; F60-A62 HydrophobicContact CE1-CB 3.75Å; F60-A186 HydrophobicContact CD2-CB 4.37Å; F60-A186 WeakPolarHBondContact CD2-O 3.26Å; F60-A186 HydrophobicContact CE2-CB 4.1Å; F60-K187 HydrophobicContact CB-CB 4.44Å; F60-K187 HydrophobicContact CD1-CB 3.88Å; F60-K187 HydrophobicContact CD2-CB 3.97Å; F60-K187 HydrophobicContact CE1-CB 4.05Å; F60-K187 HydrophobicContact CE2-CB 4.14Å; F60-K187 HydrophobicContact CG-CB 3.83Å; F60-K187 HydrophobicContact CZ-CB 4.18Å
61	Y	83.1	Confident	82.3	Confident	95 Å²	95	70.3 Å²	70.3	37%	0.373	35%	0.345	S	S	.	.			trans	-99.9	97.2	177.9	-58.4	-76.2	0	0	0	109.6	K59 E63	K59-Y61 HydrophobicContact CB-CE2 4.15Å; K59-Y61 HydrophobicContact CD-CE1 4.39Å; K59-Y61 VanDerWaalsContact CD-OH 3.25Å; K59-Y61 WeakPolarHBondContact CD-OH 3.27Å; Y61-E63 VanDerWaalsContact C-N 3.33Å
62	A	74.3	Confident	81.9	Confident	82 Å²	82	75.7 Å²	75.7	68%	0.678	37%	0.369	S	S	*	.			trans	-74	-21.7	-178.7	0	0	0	0	0	113.8	F60	F60-A62 HydrophobicContact CD1-CB 4.15Å; F60-A62 HydrophobicContact CE1-CB 3.75Å
63	E	67	Low	81.8	Confident	163 Å²	163	76 Å²	76	76%	0.762	37%	0.37	S	S	*	.	S	Bend	trans	-87.6	122.3	-171	-67.1	-173.5	-168.1	0	0	113.3	Y61	Y61-E63 VanDerWaalsContact C-N 3.33Å
64	R	63.8	Low	81.8	Confident	211 Å²	211	79.2 Å²	79.2	80%	0.796	38%	0.381	S	S	*	.			trans	50.4	100.8	169.3	-61.1	-171.6	-177	-158.6	1	115.1	K66	R64-K66 PolarHBondContact O-N 3.29Å; R64-K66 VanDerWaalsContact O-N 3.13Å
65	Y	68.2	Low	81.7	Confident	111 Å²	111	79 Å²	79	44%	0.435	38%	0.38	S	S	.	.			trans	-47.6	121.2	166.4	173.6	-107.6	0	0	0	111.5	S44 Q45 P67	S44-Y65 PolarHBondContact OG-OH 3.22Å; Q45-Y65 HydrophobicContact CG-CD1 3.81Å; Q45-Y65 HydrophobicContact CG-CD2 3.9Å; Q45-Y65 HydrophobicContact CG-CE1 3.57Å; Q45-Y65 HydrophobicContact CG-CE2 3.69Å; Q45-Y65 HydrophobicContact CG-CG 3.97Å; Y65-P67 HydrophobicContact CE1-CG 3.87Å; Y65-P67 WeakPolarHBondContact OH-CA 3.18Å
66	K	73.5	Confident	81.6	Confident	117 Å²	117	80 Å²	80	51%	0.509	38%	0.384	S	S	.	.			trans	-111.5	130.3	166.5	-66.9	175.2	-175.2	167.5	0	106.8	R64 T68	R64-K66 PolarHBondContact O-N 3.29Å; R64-K66 VanDerWaalsContact O-N 3.13Å; K66-T68 PolarHBondContact O-N 2.99Å
67	P	75	Confident	81.5	Confident	97 Å²	97	80.8 Å²	80.8	63%	0.63	39%	0.388	S	S	*	.	P	Polyproline II helix	trans	-54.2	125.1	170.9	-26.5	35	0	0	0	111.5	Y65 V69	Y65-P67 HydrophobicContact CE1-CG 3.87Å; Y65-P67 WeakPolarHBondContact OH-CA 3.18Å; P67-V69 PolarHBondContact O-N 2.93Å
68	T	70.2	Confident	81.4	Confident	29 Å²	29	80.6 Å²	80.6	18%	0.178	39%	0.391	C	S	.	.	P	Polyproline II helix	trans	-64.5	117	176.9	-42.8	0	0	0	0	109.4	T49 K66 D92 A94	T49-T68 WeakPolarHBondContact OG1-CG2 3.4Å; T49-T68 PolarHBondContact OG1-OG1 3.14Å; K66-T68 PolarHBondContact O-N 2.99Å; T68-D92 WeakPolarHBondContact CG2-OD2 3.27Å; T68-A94 VanDerWaalsContact O-CB 3.29Å; T68-A94 WeakPolarHBondContact O-CB 3.31Å
69	V	74.8	Confident	81.1	Confident	130 Å²	130	76.2 Å²	76.2	79%	0.788	37%	0.367	S	S	*	.	P	Polyproline II helix	trans	-75.4	136.7	154.7	-179.5	0	0	0	0	106.2	P67 D71	P67-V69 PolarHBondContact O-N 2.93Å; V69-D71 PolarHBondContact O-N 2.79Å
70	E	75.6	Confident	80.7	Confident	43 Å²	43	75 Å²	75	20%	0.201	37%	0.365	C	S	.	.	P	Polyproline II helix	trans	-48.6	124.3	-176.7	-60.3	-171.1	153.3	0	0	111.4	A94 Y106	E70-A94 HydrophobicContact CG-CB 4.04Å; E70-Y106 WeakPolarHBondContact OE2-CE2 3.11Å; E70-Y106 PolarHBondContact OE2-OH 3.46Å
71	D	80.4	Confident	80.3	Confident	40 Å²	40	75.2 Å²	75.2	21%	0.214	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	137.9	-174.7	-166	16.8	0	0	0	111.7	V69 N73 D92	V69-D71 PolarHBondContact O-N 2.79Å; D71-N73 PolarHBondContact OD2-ND2 2.79Å; D71-D92 PolarHBondContact N-O 2.85Å; D71-D92 VanDerWaalsContact N-O 3.14Å; D71-D92 PolarHBondContact O-N 2.85Å
72	F	87.1	Confident	80.2	Confident	113 Å²	113	72 Å²	72	50%	0.496	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	99.6	-176.5	-72.9	-92.8	0	0	0	109.4	I91 Y106	F72-I91 HydrophobicContact CD1-CD1 4.29Å; F72-I91 HydrophobicContact CD1-CG1 4.01Å; F72-I91 HydrophobicContact CE1-CD1 3.9Å; F72-I91 HydrophobicContact CE1-CG1 4.1Å; F72-I91 HydrophobicContact CE1-CG2 4.38Å; F72-Y106 AromaticContact CE1-CE1 3.83Å; F72-Y106 HydrophobicContact CE1-CE1 3.83Å; F72-Y106 AromaticContact CZ-CE1 3.59Å; F72-Y106 HydrophobicContact CZ-CE1 3.59Å; F72-Y106 AromaticContact CZ-CZ 3.72Å; F72-Y106 WeakPolarHBondContact CZ-OH 3.41Å
73	N	91.6	Very high	80.7	Confident	8 Å²	8	74.9 Å²	74.9	4%	0.043	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	161.7	179	-75.7	-74.4	0	0	0	111.5	L56 W57 D71 E89 L90 S219	L56-N73 HydrophobicContact CD1-CB 3.35Å; L56-N73 HydrophobicContact CD2-CB 4.3Å; L56-N73 HydrophobicContact CG-CB 4.47Å; W57-N73 VanDerWaalsContact CH2-OD1 3.26Å; W57-N73 WeakPolarHBondContact CH2-OD1 3.2Å; W57-N73 WeakPolarHBondContact CZ2-OD1 3.43Å; D71-N73 PolarHBondContact OD2-ND2 2.79Å; N73-E89 CarbonylContact O-C 3.59Å; N73-E89 WeakPolarHBondContact O-CA 3.34Å; N73-L90 PolarHBondContact N-O 2.86Å; N73-L90 PolarHBondContact O-N 3.44Å; N73-S219 WeakPolarHBondContact CA-OG 3.41Å; N73-S219 WeakPolarHBondContact CB-OG 3.18Å; N73-S219 WeakPolarHBondContact OD1-CB 3.33Å; N73-S219 PolarHBondContact OD1-OG 3.48Å
74	W	92.7	Very high	81.7	Confident	75 Å²	75	69.8 Å²	69.8	28%	0.284	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	154.3	179.2	59.9	-93.4	0	0	0	112.1	E76 L87 F88 E89 R217 Q218 S219	W74-E76 HydrophobicContact CE3-CG 4.02Å; W74-E76 HydrophobicContact CZ3-CB 4.33Å; W74-E76 HydrophobicContact CZ3-CG 3.71Å; W74-L87 HydrophobicContact CB-CD1 4.02Å; W74-L87 HydrophobicContact CD2-CD1 4.37Å; W74-L87 HydrophobicContact CE3-CD1 3.97Å; W74-L87 HydrophobicContact CG-CD1 4.41Å; W74-F88 CarbonylContact C-O 3.57Å; W74-F88 VanDerWaalsContact CA-O 3.24Å; W74-F88 WeakPolarHBondContact CA-O 3.42Å; W74-E89 HydrophobicContact CB-CG 4.15Å; W74-R217 HydrophobicContact CH2-CB 3.89Å; W74-R217 HydrophobicContact CZ3-CB 3.74Å; W74-Q218 VanDerWaalsContact CZ3-CA 3.43Å; W74-Q218 CarbonylContact O-C 3.37Å; W74-Q218 WeakPolarHBondContact O-CA 3.44Å; W74-Q218 WeakPolarHBondContact O-CB 3.23Å; W74-S219 PolarHBondContact N-OG 3.19Å; W74-S219 VanDerWaalsContact N-OG 3.16Å; W74-S219 PolarHBondContact O-N 2.75Å; W74-S219 PolarHBondContact O-OG 3.17Å
75	I	92.4	Very high	82.9	Confident	3 Å²	3	60.2 Å²	60.2	2%	0.015	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	125.9	173.1	178.4	165.7	0	0	0	109.5	F55 L56 Y77 F88 K215 Q218	F55-I75 HydrophobicContact CE1-CG2 4.25Å; L56-I75 HydrophobicContact CD2-CB 4.37Å; L56-I75 HydrophobicContact CD2-CG2 4.31Å; I75-Y77 HydrophobicContact CB-CE2 4.39Å; I75-Y77 HydrophobicContact CD1-CE1 3.91Å; I75-Y77 HydrophobicContact CD1-CE2 3.98Å; I75-Y77 WeakPolarHBondContact CD1-OH 3.35Å; I75-Y77 HydrophobicContact CG1-CD2 4.28Å; I75-Y77 HydrophobicContact CG1-CE1 4.33Å; I75-Y77 HydrophobicContact CG1-CE2 3.85Å; I75-Y77 HydrophobicContact CG2-CD2 4.48Å; I75-Y77 HydrophobicContact CG2-CE2 3.71Å; I75-F88 HydrophobicContact CG2-CB 3.86Å; I75-F88 HydrophobicContact CG2-CD1 3.85Å; I75-F88 HydrophobicContact CG2-CG 4.28Å; I75-F88 PolarHBondContact N-O 3.32Å; I75-F88 PolarHBondContact O-N 2.82Å; I75-K215 HydrophobicContact CD1-CB 4.42Å; I75-K215 HydrophobicContact CD1-CD 3.81Å; I75-K215 HydrophobicContact CD1-CG 3.94Å; I75-K215 HydrophobicContact CG1-CG 4.36Å; I75-Q218 HydrophobicContact CB-CB 4.04Å; I75-Q218 HydrophobicContact CG1-CB 4.2Å
76	E	91.5	Very high	83.9	Confident	29 Å²	29	55 Å²	55	14%	0.136	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	124.7	172.6	-76	174.2	-162.7	0	0	109.2	W74 T85 L86 L87 R216 R217	W74-E76 HydrophobicContact CE3-CG 4.02Å; W74-E76 HydrophobicContact CZ3-CB 4.33Å; W74-E76 HydrophobicContact CZ3-CG 3.71Å; E76-T85 HydrophobicContact CB-CG2 4.3Å; E76-T85 HydrophobicContact CG-CG2 4.26Å; E76-L86 CarbonylContact C-O 3.48Å; E76-L86 WeakPolarHBondContact CA-O 3.19Å; E76-L87 HydrophobicContact CG-CD1 3.95Å; E76-R216 HydrophobicContact CB-CB 4.26Å; E76-R216 PolarHBondContact O-N 3.36Å; E76-R216 IonicContact OE1-NH2 3.71Å; E76-R216 IonicContact OE2-CZ 3.14Å; E76-R216 IonicContact OE2-NE 2.74Å; E76-R216 PolarHBondContact OE2-NE 3.28Å; E76-R216 IonicContact OE2-NH2 2.7Å; E76-R216 PolarHBondContact OE2-NH2 3.34Å; E76-R217 HydrophobicContact CB-CB 4.34Å; E76-R217 PolarHBondContact N-O 3.02Å; E76-R217 WeakPolarHBondContact OE2-CD 3.47Å
77	Y	90.5	Very high	84.8	Confident	18 Å²	18	50.9 Å²	50.9	7%	0.071	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	141.6	166.7	-61.4	-85.9	0	0	0	110.7	F55 I75 T85 L86 F88 F200 L213 K214 K215	F55-Y77 WeakPolarHBondContact CZ-OH 3.48Å; I75-Y77 HydrophobicContact CB-CE2 4.39Å; I75-Y77 HydrophobicContact CD1-CE1 3.91Å; I75-Y77 HydrophobicContact CD1-CE2 3.98Å; I75-Y77 WeakPolarHBondContact CD1-OH 3.35Å; I75-Y77 HydrophobicContact CG1-CD2 4.28Å; I75-Y77 HydrophobicContact CG1-CE1 4.33Å; I75-Y77 HydrophobicContact CG1-CE2 3.85Å; I75-Y77 HydrophobicContact CG2-CD2 4.48Å; I75-Y77 HydrophobicContact CG2-CE2 3.71Å; Y77-T85 CarbonylContact O-C 3.59Å; Y77-T85 WeakPolarHBondContact O-CA 3.34Å; Y77-L86 HydrophobicContact CD2-CD2 4.39Å; Y77-L86 PolarHBondContact N-O 3.42Å; Y77-L86 PolarHBondContact O-N 3.03Å; Y77-F88 HydrophobicContact CE2-CB 4.48Å; Y77-F200 HydrophobicContact CE2-CZ 4.33Å; Y77-L213 HydrophobicContact CD1-CB 3.67Å; Y77-L213 HydrophobicContact CD1-CD1 4.23Å; Y77-L213 HydrophobicContact CD1-CG 4.49Å; Y77-L213 HydrophobicContact CD2-CD1 4.22Å; Y77-L213 HydrophobicContact CE1-CB 4.3Å; Y77-L213 HydrophobicContact CG-CB 4.03Å; Y77-L213 HydrophobicContact CG-CD1 4.05Å; Y77-L213 HydrophobicContact CG-CG 4.44Å; Y77-K214 CarbonylContact C-O 3.51Å; Y77-K214 WeakPolarHBondContact CA-O 3.27Å; Y77-K215 HydrophobicContact CD1-CB 4.09Å; Y77-K215 HydrophobicContact CE1-CB 4.07Å
78	T	88.9	Confident	85.6	Confident	34 Å²	34	46.2 Å²	46.2	21%	0.209	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	134.9	167	-54.4	0	0	0	0	109.7	K214	T78-K214 PolarHBondContact N-O 2.96Å; T78-K214 PolarHBondContact O-N 2.75Å
79	M	84.3	Confident	86.6	Confident	13 Å²	13	47 Å²	47	6%	0.064	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	166.8	-177.7	-79.4	-177	51.2	0	0	111.9	G81 G82 E83 E84 L86 L205 L213	M79-G81 VanDerWaalsContact C-N 3.3Å; M79-G81 PolarHBondContact O-N 2.87Å; M79-G82 PolarHBondContact O-N 2.79Å; M79-E83 PolarHBondContact O-N 2.76Å; M79-E84 HydrophobicContact CB-CB 4.11Å; M79-E84 PolarHBondContact N-O 3.03Å; M79-E84 PolarHBondContact O-N 2.87Å; M79-L86 HydrophobicContact CG-CB 4.25Å; M79-L86 HydrophobicContact SD-CB 3.49Å; M79-L86 WeakPolarHBondContact SD-CB 3.49Å; M79-L86 HydrophobicContact SD-CD2 3.82Å; M79-L86 HydrophobicContact SD-CG 4.24Å; M79-L205 HydrophobicContact CE-CD1 4.07Å; M79-L205 HydrophobicContact CE-CD2 3.4Å; M79-L205 VanDerWaalsContact CE-CD2 3.4Å; M79-L205 HydrophobicContact CE-CG 4.22Å; M79-L205 HydrophobicContact SD-CD1 3.98Å; M79-L205 HydrophobicContact SD-CD2 4.4Å; M79-L213 HydrophobicContact CG-CD2 3.22Å; M79-L213 HydrophobicContact SD-CD2 3.78Å
80	N	82.8	Confident	87.5	Confident	75 Å²	75	40.8 Å²	40.8	40%	0.401	23%	0.226	S	C	.	.	G	3₁₀ helix	trans	47.8	51.2	170.8	-66.5	-24.2	0	0	0	112.7	G82 E83 E84	N80-G82 PolarHBondContact O-N 3.08Å; N80-E83 HydrophobicContact CB-CB 4.43Å; N80-E83 WeakPolarHBondContact O-CG 3.25Å; N80-E83 PolarHBondContact O-N 3.19Å; N80-E83 VanDerWaalsContact O-N 3.16Å; N80-E84 HydrophobicContact CB-CG 4.39Å; N80-E84 PolarHBondContact ND2-OE2 2.9Å
81	G	79.7	Confident	88.3	Confident	94 Å²	94	39.2 Å²	39.2	97%	0.969	22%	0.219	S	C	*	.	G	3₁₀ helix	trans	69.9	-6.8	179.4	0	0	0	0	0	116.3	M79	M79-G81 VanDerWaalsContact C-N 3.3Å; M79-G81 PolarHBondContact O-N 2.87Å
82	G	80.4	Confident	88.7	Confident	28 Å²	28	37.5 Å²	37.5	29%	0.289	21%	0.21	S	C	.	.	G	3₁₀ helix	trans	135.8	-15.2	-169.2	0	0	0	0	0	114	L31 M79 N80	L31-G82 VanDerWaalsContact CD1-O 3.23Å; L31-G82 WeakPolarHBondContact CD1-O 3.47Å; L31-G82 WeakPolarHBondContact CD2-O 3.38Å; M79-G82 PolarHBondContact O-N 2.79Å; N80-G82 PolarHBondContact O-N 3.08Å
83	E	84.4	Confident	88.5	Confident	142 Å²	142	32.2 Å²	32.2	66%	0.664	19%	0.187	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-21.7	-168.4	-63.2	-172.7	164.1	0	0	114.5	P32 M79 N80	P32-E83 VanDerWaalsContact CD-O 3.28Å; P32-E83 WeakPolarHBondContact CD-O 3.18Å; P32-E83 WeakPolarHBondContact CG-O 3.4Å; M79-E83 PolarHBondContact O-N 2.76Å; N80-E83 HydrophobicContact CB-CB 4.43Å; N80-E83 WeakPolarHBondContact O-CG 3.25Å; N80-E83 PolarHBondContact O-N 3.19Å; N80-E83 VanDerWaalsContact O-N 3.16Å
84	E	87.7	Confident	87.8	Confident	55 Å²	55	32.2 Å²	32.2	26%	0.257	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	151.6	-178.9	-52.1	-169.4	141.9	0	0	111.3	P32 M79 N80	P32-E84 HydrophobicContact CG-CB 4.4Å; P32-E84 HydrophobicContact CG-CG 3.96Å; M79-E84 HydrophobicContact CB-CB 4.11Å; M79-E84 PolarHBondContact N-O 3.03Å; M79-E84 PolarHBondContact O-N 2.87Å; N80-E84 HydrophobicContact CB-CG 4.39Å; N80-E84 PolarHBondContact ND2-OE2 2.9Å
85	T	88.7	Confident	86.2	Confident	11 Å²	11	29.1 Å²	29.1	7%	0.067	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	128.3	172.6	-59.7	0	0	0	0	110	P32 I33 I34 E76 Y77	P32-T85 PolarHBondContact O-N 3.01Å; I33-T85 CarbonylContact C-O 3.57Å; I33-T85 VanDerWaalsContact CA-O 3.27Å; I33-T85 WeakPolarHBondContact CA-O 3.23Å; I34-T85 PolarHBondContact N-O 2.91Å; E76-T85 HydrophobicContact CB-CG2 4.3Å; E76-T85 HydrophobicContact CG-CG2 4.26Å; Y77-T85 CarbonylContact O-C 3.59Å; Y77-T85 WeakPolarHBondContact O-CA 3.34Å
86	L	90.2	Very high	84.7	Confident	1 Å²	1	31.1 Å²	31.1	1%	0.005	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	112.5	170.9	170.2	63.3	0	0	0	109.1	I34 V36 E76 Y77 M79 F200 L204 L205 L213	I34-L86 HydrophobicContact CB-CD1 4.42Å; I34-L86 HydrophobicContact CG2-CD1 4.21Å; I34-L86 CarbonylContact O-C 3.57Å; I34-L86 WeakPolarHBondContact O-CA 3.5Å; V36-L86 HydrophobicContact CG2-CD1 3.62Å; E76-L86 CarbonylContact C-O 3.48Å; E76-L86 WeakPolarHBondContact CA-O 3.19Å; Y77-L86 HydrophobicContact CD2-CD2 4.39Å; Y77-L86 PolarHBondContact N-O 3.42Å; Y77-L86 PolarHBondContact O-N 3.03Å; M79-L86 HydrophobicContact CG-CB 4.25Å; M79-L86 HydrophobicContact SD-CB 3.49Å; M79-L86 WeakPolarHBondContact SD-CB 3.49Å; M79-L86 HydrophobicContact SD-CD2 3.82Å; M79-L86 HydrophobicContact SD-CG 4.24Å; L86-F200 HydrophobicContact CD2-CD1 4.28Å; L86-F200 HydrophobicContact CD2-CE1 3.76Å; L86-F200 HydrophobicContact CD2-CZ 4.49Å; L86-L204 HydrophobicContact CD1-CD2 4.37Å; L86-L205 HydrophobicContact CD2-CD1 4.24Å; L86-L213 HydrophobicContact CD2-CD1 4.08Å; L86-L213 HydrophobicContact CD2-CD2 4.18Å
87	L	91.3	Very high	83.4	Confident	30 Å²	30	36.5 Å²	36.5	16%	0.157	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	105.1	171.1	179.6	63.3	0	0	0	108.6	I33 I34 K35 V36 W74 E76 E89	I33-L87 HydrophobicContact CG2-CB 3.82Å; I34-L87 PolarHBondContact O-N 3.06Å; K35-L87 WeakPolarHBondContact CA-O 3.47Å; K35-L87 HydrophobicContact CD-CD2 4.39Å; V36-L87 PolarHBondContact N-O 3.02Å; W74-L87 HydrophobicContact CB-CD1 4.02Å; W74-L87 HydrophobicContact CD2-CD1 4.37Å; W74-L87 HydrophobicContact CE3-CD1 3.97Å; W74-L87 HydrophobicContact CG-CD1 4.41Å; E76-L87 HydrophobicContact CG-CD1 3.95Å; L87-E89 HydrophobicContact CD2-CG 4.39Å; L87-E89 HydrophobicContact CG-CG 4.11Å
88	F	91.8	Very high	82.1	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	108.6	174.7	-175.5	-94.1	0	0	0	109	V36 V38 F55 W74 I75 Y77 L90 F196 L199 F200	V36-F88 HydrophobicContact CB-CD2 4.32Å; V36-F88 HydrophobicContact CG1-CD2 4.18Å; V36-F88 HydrophobicContact CG1-CE2 4.42Å; V38-F88 HydrophobicContact CB-CE1 4.27Å; V38-F88 HydrophobicContact CB-CE2 4.02Å; V38-F88 HydrophobicContact CB-CZ 3.62Å; V38-F88 HydrophobicContact CG1-CZ 4.11Å; V38-F88 HydrophobicContact CG2-CD2 4.1Å; V38-F88 HydrophobicContact CG2-CE1 4.31Å; V38-F88 HydrophobicContact CG2-CE2 3.18Å; V38-F88 HydrophobicContact CG2-CZ 3.29Å; F55-F88 HydrophobicContact CD1-CE1 4.44Å; F55-F88 HydrophobicContact CE1-CD1 4Å; F55-F88 AromaticContact CE1-CE1 3.72Å; F55-F88 HydrophobicContact CE1-CE1 3.72Å; W74-F88 CarbonylContact C-O 3.57Å; W74-F88 VanDerWaalsContact CA-O 3.24Å; W74-F88 WeakPolarHBondContact CA-O 3.42Å; I75-F88 HydrophobicContact CG2-CB 3.86Å; I75-F88 HydrophobicContact CG2-CD1 3.85Å; I75-F88 HydrophobicContact CG2-CG 4.28Å; I75-F88 PolarHBondContact N-O 3.32Å; I75-F88 PolarHBondContact O-N 2.82Å; Y77-F88 HydrophobicContact CE2-CB 4.48Å; F88-L90 HydrophobicContact CE1-CB 4.26Å; F88-L90 HydrophobicContact CE1-CD1 4.13Å; F88-F196 AromaticContact CE1-CD1 3.88Å; F88-F196 HydrophobicContact CE1-CD1 3.88Å; F88-F196 AromaticContact CE1-CE1 3.84Å; F88-F196 HydrophobicContact CE1-CE1 3.84Å; F88-F196 AromaticContact CZ-CD1 3.52Å; F88-F196 HydrophobicContact CZ-CD1 3.52Å; F88-F196 AromaticContact CZ-CE1 3.73Å; F88-F196 HydrophobicContact CZ-CE1 3.73Å; F88-L199 HydrophobicContact CE2-CD2 4.13Å; F88-F200 HydrophobicContact CB-CZ 4.23Å; F88-F200 HydrophobicContact CD1-CZ 4.46Å; F88-F200 AromaticContact CD2-CE1 3.39Å; F88-F200 HydrophobicContact CD2-CE1 3.39Å; F88-F200 HydrophobicContact CD2-CE2 4.2Å; F88-F200 AromaticContact CD2-CZ 3.16Å; F88-F200 HydrophobicContact CD2-CZ 3.16Å; F88-F200 AromaticContact CE2-CE1 3.73Å; F88-F200 HydrophobicContact CE2-CE1 3.73Å; F88-F200 HydrophobicContact CE2-CE2 4.04Å; F88-F200 AromaticContact CE2-CZ 3.39Å; F88-F200 HydrophobicContact CE2-CZ 3.39Å; F88-F200 HydrophobicContact CG-CE1 4.26Å; F88-F200 AromaticContact CG-CZ 3.73Å; F88-F200 HydrophobicContact CG-CZ 3.73Å; F88-F200 HydrophobicContact CZ-CZ 4.19Å
89	E	93.1	Very high	81.3	Confident	44 Å²	44	46 Å²	46	21%	0.206	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	133.3	174.8	-64.4	-174	-175.7	0	0	109.5	K35 V36 V38 N73 W74 L87	K35-E89 WeakPolarHBondContact CE-OE1 3.41Å; K35-E89 WeakPolarHBondContact CE-OE2 3.38Å; K35-E89 IonicContact NZ-OE1 2.74Å; K35-E89 PolarHBondContact NZ-OE1 3.48Å; K35-E89 IonicContact NZ-OE2 2.67Å; K35-E89 PolarHBondContact NZ-OE2 3Å; V36-E89 PolarHBondContact O-N 3.37Å; V38-E89 PolarHBondContact N-O 3.02Å; N73-E89 CarbonylContact O-C 3.59Å; N73-E89 WeakPolarHBondContact O-CA 3.34Å; W74-E89 HydrophobicContact CB-CG 4.15Å; L87-E89 HydrophobicContact CD2-CG 4.39Å; L87-E89 HydrophobicContact CG-CG 4.11Å
90	L	93.3	Very high	81	Confident	1 Å²	1	49.7 Å²	49.7	1%	0.005	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	112.1	-178	-170.2	62.5	0	0	0	109.2	V38 I40 A52 F55 L56 N73 F88 F196	V38-L90 HydrophobicContact CB-CD1 3.95Å; V38-L90 HydrophobicContact CG1-CD1 3.77Å; V38-L90 WeakPolarHBondContact O-CA 3.32Å; I40-L90 HydrophobicContact CD1-CD1 3.92Å; I40-L90 HydrophobicContact CD1-CD2 4.19Å; I40-L90 HydrophobicContact CD1-CG 4.21Å; I40-L90 HydrophobicContact CG1-CD1 3.71Å; I40-L90 HydrophobicContact CG1-CG 4.35Å; A52-L90 HydrophobicContact CB-CD2 3.81Å; F55-L90 HydrophobicContact CD1-CD2 4.4Å; L56-L90 HydrophobicContact CD1-CD2 4.15Å; L56-L90 HydrophobicContact CG-CD2 4.28Å; N73-L90 PolarHBondContact N-O 2.86Å; N73-L90 PolarHBondContact O-N 3.44Å; F88-L90 HydrophobicContact CE1-CB 4.26Å; F88-L90 HydrophobicContact CE1-CD1 4.13Å; L90-F196 HydrophobicContact CD1-CE1 3.96Å; L90-F196 HydrophobicContact CD1-CZ 4.32Å; L90-F196 HydrophobicContact CD2-CE1 4.37Å; L90-F196 HydrophobicContact CD2-CZ 4.21Å
91	I	92.6	Very high	81	Confident	10 Å²	10	49.9 Å²	49.9	5%	0.051	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	107.1	177	-50.6	-176.1	0	0	0	107.4	V38 V39 I40 F72 S93 Y106	V38-I91 PolarHBondContact O-N 2.95Å; V39-I91 HydrophobicContact CG1-CB 4.38Å; V39-I91 HydrophobicContact CG2-CD1 4.25Å; I40-I91 PolarHBondContact N-O 3.19Å; F72-I91 HydrophobicContact CD1-CD1 4.29Å; F72-I91 HydrophobicContact CD1-CG1 4.01Å; F72-I91 HydrophobicContact CE1-CD1 3.9Å; F72-I91 HydrophobicContact CE1-CG1 4.1Å; F72-I91 HydrophobicContact CE1-CG2 4.38Å; I91-S93 PolarHBondContact O-N 2.96Å; I91-Y106 HydrophobicContact CD1-CD1 3.54Å; I91-Y106 HydrophobicContact CD1-CE1 3.9Å; I91-Y106 HydrophobicContact CD1-CG 4.21Å; I91-Y106 HydrophobicContact CG2-CD1 4.11Å; I91-Y106 HydrophobicContact CG2-CD2 4.06Å; I91-Y106 HydrophobicContact CG2-CE1 4.01Å; I91-Y106 HydrophobicContact CG2-CE2 3.97Å; I91-Y106 HydrophobicContact CG2-CG 4.14Å
92	D	87.9	Confident	81.2	Confident	3 Å²	3	48.5 Å²	48.5	2%	0.016	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	98.5	172.2	-175.8	30.4	0	0	0	108.4	K48 T49 A52 T68 D71	K48-D92 WeakPolarHBondContact CB-OD1 3.34Å; T49-D92 WeakPolarHBondContact CA-OD2 3.25Å; T49-D92 WeakPolarHBondContact CB-OD2 3.32Å; T49-D92 WeakPolarHBondContact CG2-OD2 3.35Å; T49-D92 PolarHBondContact N-OD1 3.4Å; T49-D92 PolarHBondContact OG1-OD2 3.02Å; A52-D92 HydrophobicContact CB-CB 4.36Å; T68-D92 WeakPolarHBondContact CG2-OD2 3.27Å; D71-D92 PolarHBondContact N-O 2.85Å; D71-D92 VanDerWaalsContact N-O 3.14Å; D71-D92 PolarHBondContact O-N 2.85Å
93	S	82.1	Confident	81.4	Confident	3 Å²	3	47.8 Å²	47.8	2%	0.021	25%	0.246	C	C	.	.			trans	-70.9	149.1	-177.1	93.8	0	0	0	0	111	I40 K48 I91 G95	I40-S93 WeakPolarHBondContact O-CB 3.18Å; I40-S93 PolarHBondContact O-N 3.27Å; I40-S93 PolarHBondContact O-OG 3.3Å; K48-S93 WeakPolarHBondContact CE-O 3.37Å; I91-S93 PolarHBondContact O-N 2.96Å; S93-G95 PolarHBondContact O-N 2.87Å
94	A	77.4	Confident	81.7	Confident	8 Å²	8	46 Å²	46	7%	0.066	24%	0.237	C	C	.	.			trans	-53.7	144	161.6	0	0	0	0	0	109.7	T68 E70 S96	T68-A94 VanDerWaalsContact O-CB 3.29Å; T68-A94 WeakPolarHBondContact O-CB 3.31Å; E70-A94 HydrophobicContact CG-CB 4.04Å; A94-S96 VanDerWaalsContact C-N 3.28Å
95	G	59.8	Low	81.8	Confident	9 Å²	9	47.2 Å²	47.2	9%	0.093	24%	0.244	C	C	.	.	S	Bend	trans	-79.9	-11.3	170.1	0	0	0	0	0	113.7	S93	S93-G95 PolarHBondContact O-N 2.87Å
96	S	60.9	Low	81.9	Confident	46 Å²	46	47 Å²	47	32%	0.322	24%	0.243	S	C	.	.	S	Bend	trans	-81.3	164.6	173.4	60.3	0	0	0	0	111.4	A94 D98	A94-S96 VanDerWaalsContact C-N 3.28Å; S96-D98 VanDerWaalsContact C-N 3.31Å; S96-D98 WeakPolarHBondContact CB-OD2 3.24Å; S96-D98 VanDerWaalsContact OG-CG 3.25Å; S96-D98 PolarHBondContact OG-OD2 3.01Å
97	R	63.5	Low	82.1	Confident	142 Å²	142	47 Å²	47	54%	0.536	24%	0.242	S	C	.	.	S	Bend	trans	-93.1	8.3	-177.1	-65.2	-179.4	172.9	-158	-10.6	112.5	F99 E127 E130	R97-F99 VanDerWaalsContact C-N 3.29Å; R97-F99 PolarHBondContact O-N 3.09Å; R97-E127 IonicContact CZ-OE1 3.53Å; R97-E127 IonicContact NE-OE1 3.14Å; R97-E127 PolarHBondContact NE-OE1 3.17Å; R97-E127 IonicContact NH2-OE1 3.69Å; R97-E127 PolarHBondContact NH2-OE1 3.26Å; R97-E127 VanDerWaalsContact NH2-OE1 3.14Å; R97-E130 IonicContact CZ-OE2 2.87Å; R97-E130 IonicContact NH1-OE2 2.8Å; R97-E130 IonicContact NH2-OE2 3.8Å; R97-E130 PolarHBondContact NH2-OE2 3.05Å
98	D	63.1	Low	82.2	Confident	117 Å²	117	47.7 Å²	47.7	63%	0.626	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-26.2	-160.8	-48.4	-24.9	0	0	0	113.5	S96	S96-D98 VanDerWaalsContact C-N 3.31Å; S96-D98 WeakPolarHBondContact CB-OD2 3.24Å; S96-D98 VanDerWaalsContact OG-CG 3.25Å; S96-D98 PolarHBondContact OG-OD2 3.01Å
99	F	71.8	Confident	82.3	Confident	134 Å²	134	50.4 Å²	50.4	59%	0.588	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.1	59.2	179.6	-65.3	-79.8	0	0	0	112.5	R97 A101 M102 R103	R97-F99 VanDerWaalsContact C-N 3.29Å; R97-F99 PolarHBondContact O-N 3.09Å; F99-A101 PolarHBondContact O-N 3.41Å; F99-M102 HydrophobicContact CB-CB 4.23Å; F99-M102 HydrophobicContact CB-CG 4.34Å; F99-M102 PolarHBondContact O-N 3.3Å; F99-R103 PolarHBondContact O-N 3.17Å
100	L	77.9	Confident	82.3	Confident	91 Å²	91	48.3 Å²	48.3	48%	0.476	26%	0.256	S	S	.	.	H	α-helix	trans	-51.8	-32.3	179.9	-175.1	62.7	0	0	0	114	K104	L100-K104 WeakPolarHBondContact O-CB 3.18Å; L100-K104 WeakPolarHBondContact O-CG 3.35Å; L100-K104 PolarHBondContact O-N 3.46Å
101	A	82.9	Confident	82.3	Confident	79 Å²	79	49.4 Å²	49.4	65%	0.653	26%	0.262	S	S	*	.	H	α-helix	trans	-65.6	-45.4	176.2	0	0	0	0	0	112.6	F99 K104 L105	F99-A101 PolarHBondContact O-N 3.41Å; A101-K104 PolarHBondContact O-N 2.95Å; A101-L105 PolarHBondContact O-N 2.93Å
102	M	84.3	Confident	82.5	Confident	65 Å²	65	48.9 Å²	48.9	32%	0.32	26%	0.26	S	S	.	.	H	α-helix	trans	-67.9	-43.9	176.8	-64.7	-54.3	-64.6	0	0	111	F99 K104 L105 Y106	F99-M102 HydrophobicContact CB-CB 4.23Å; F99-M102 HydrophobicContact CB-CG 4.34Å; F99-M102 PolarHBondContact O-N 3.3Å; M102-K104 VanDerWaalsContact C-N 3.31Å; M102-K104 PolarHBondContact O-N 3.23Å; M102-L105 HydrophobicContact CE-CD2 4.11Å; M102-L105 WeakPolarHBondContact O-CA 3.43Å; M102-L105 WeakPolarHBondContact O-CB 3.35Å; M102-L105 PolarHBondContact O-N 3.45Å; M102-L105 HydrophobicContact SD-CD2 4.37Å; M102-Y106 HydrophobicContact CB-CE2 3.82Å; M102-Y106 HydrophobicContact CE-CE1 3.86Å; M102-Y106 WeakPolarHBondContact CE-OH 3.09Å; M102-Y106 WeakPolarHBondContact O-CD2 3.32Å; M102-Y106 VanDerWaalsContact O-CG 3.28Å; M102-Y106 PolarHBondContact O-N 3.02Å
103	R	85.5	Confident	82.8	Confident	12 Å²	12	48.8 Å²	48.8	5%	0.045	26%	0.259	C	S	.	.	H	α-helix	trans	-53.3	-45.6	173.3	-175.9	163.8	167.1	159	-12.1	111.9	F99 Y106 M107 E127	F99-R103 PolarHBondContact O-N 3.17Å; R103-Y106 PolarHBondContact O-N 3.42Å; R103-M107 HydrophobicContact CG-CE 3.7Å; R103-M107 HydrophobicContact CG-SD 4.08Å; R103-M107 WeakPolarHBondContact O-CB 3.49Å; R103-M107 WeakPolarHBondContact O-CG 3.44Å; R103-M107 PolarHBondContact O-N 2.88Å; R103-E127 IonicContact CZ-OE1 2.74Å; R103-E127 IonicContact NH1-OE1 2.87Å; R103-E127 IonicContact NH2-OE1 2.74Å; R103-E127 PolarHBondContact NH2-OE1 3.08Å
104	K	89.5	Confident	83.5	Confident	106 Å²	106	48.6 Å²	48.6	46%	0.461	26%	0.258	S	S	.	.	H	α-helix	trans	-64.5	-40.4	174.4	-74.8	-178	179	-174.5	0	113.1	L100 A101 M102 M107 S108 L138	L100-K104 WeakPolarHBondContact O-CB 3.18Å; L100-K104 WeakPolarHBondContact O-CG 3.35Å; L100-K104 PolarHBondContact O-N 3.46Å; A101-K104 PolarHBondContact O-N 2.95Å; M102-K104 VanDerWaalsContact C-N 3.31Å; M102-K104 PolarHBondContact O-N 3.23Å; K104-M107 PolarHBondContact O-N 3.41Å; K104-S108 PolarHBondContact O-N 3.3Å; K104-S108 PolarHBondContact O-OG 3.24Å; K104-L138 HydrophobicContact CB-CD1 4.28Å; K104-L138 HydrophobicContact CG-CD1 3.97Å
105	L	90.7	Very high	84.5	Confident	80 Å²	80	48.3 Å²	48.3	42%	0.419	26%	0.255	S	S	.	.	H	α-helix	trans	-63.4	-43.9	176.7	178.5	65.1	0	0	0	111.9	A101 M102 M107 S108 T109	A101-L105 PolarHBondContact O-N 2.93Å; M102-L105 HydrophobicContact CE-CD2 4.11Å; M102-L105 WeakPolarHBondContact O-CA 3.43Å; M102-L105 WeakPolarHBondContact O-CB 3.35Å; M102-L105 PolarHBondContact O-N 3.45Å; M102-L105 HydrophobicContact SD-CD2 4.37Å; L105-M107 VanDerWaalsContact C-N 3.35Å; L105-S108 PolarHBondContact O-N 2.73Å; L105-S108 PolarHBondContact O-OG 2.88Å; L105-T109 HydrophobicContact CD1-CG2 3.78Å; L105-T109 WeakPolarHBondContact O-CB 3.26Å; L105-T109 WeakPolarHBondContact O-CG2 3.16Å; L105-T109 PolarHBondContact O-N 3.34Å; L105-T109 PolarHBondContact O-OG1 2.96Å
106	Y	91.3	Very high	86.3	Confident	7 Å²	7	47.9 Å²	47.9	3%	0.027	25%	0.251	C	S	.	.	H	α-helix	trans	-66	-38.2	176	-54.2	-41.9	0	0	0	111.6	E70 F72 I91 M102 R103 G110	E70-Y106 WeakPolarHBondContact OE2-CE2 3.11Å; E70-Y106 PolarHBondContact OE2-OH 3.46Å; F72-Y106 AromaticContact CE1-CE1 3.83Å; F72-Y106 HydrophobicContact CE1-CE1 3.83Å; F72-Y106 AromaticContact CZ-CE1 3.59Å; F72-Y106 HydrophobicContact CZ-CE1 3.59Å; F72-Y106 AromaticContact CZ-CZ 3.72Å; F72-Y106 WeakPolarHBondContact CZ-OH 3.41Å; I91-Y106 HydrophobicContact CD1-CD1 3.54Å; I91-Y106 HydrophobicContact CD1-CE1 3.9Å; I91-Y106 HydrophobicContact CD1-CG 4.21Å; I91-Y106 HydrophobicContact CG2-CD1 4.11Å; I91-Y106 HydrophobicContact CG2-CD2 4.06Å; I91-Y106 HydrophobicContact CG2-CE1 4.01Å; I91-Y106 HydrophobicContact CG2-CE2 3.97Å; I91-Y106 HydrophobicContact CG2-CG 4.14Å; M102-Y106 HydrophobicContact CB-CE2 3.82Å; M102-Y106 HydrophobicContact CE-CE1 3.86Å; M102-Y106 WeakPolarHBondContact CE-OH 3.09Å; M102-Y106 WeakPolarHBondContact O-CD2 3.32Å; M102-Y106 VanDerWaalsContact O-CG 3.28Å; M102-Y106 PolarHBondContact O-N 3.02Å; R103-Y106 PolarHBondContact O-N 3.42Å; Y106-G110 VanDerWaalsContact O-CA 3.25Å; Y106-G110 WeakPolarHBondContact O-CA 3.29Å; Y106-G110 PolarHBondContact O-N 3.04Å
107	M	93	Very high	88.1	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-64.2	-40.6	174.6	-71.9	166.3	170.2	0	0	112.8	L41 R103 K104 L105 F113 L131 Q134 V135 L138 N139	L41-M107 HydrophobicContact CD1-CE 3.92Å; L41-M107 HydrophobicContact CD1-CG 4.22Å; L41-M107 HydrophobicContact CD2-CE 4.3Å; R103-M107 HydrophobicContact CG-CE 3.7Å; R103-M107 HydrophobicContact CG-SD 4.08Å; R103-M107 WeakPolarHBondContact O-CB 3.49Å; R103-M107 WeakPolarHBondContact O-CG 3.44Å; R103-M107 PolarHBondContact O-N 2.88Å; K104-M107 PolarHBondContact O-N 3.41Å; L105-M107 VanDerWaalsContact C-N 3.35Å; M107-F113 VanDerWaalsContact O-CZ 3.27Å; M107-F113 WeakPolarHBondContact O-CZ 3.48Å; M107-L131 HydrophobicContact CE-CD2 3.33Å; M107-Q134 HydrophobicContact CE-CB 3.96Å; M107-Q134 HydrophobicContact SD-CB 3.77Å; M107-V135 HydrophobicContact CB-CG2 4.47Å; M107-V135 HydrophobicContact CG-CG2 3.93Å; M107-L138 HydrophobicContact CB-CB 4.1Å; M107-L138 HydrophobicContact CB-CD1 3.78Å; M107-L138 HydrophobicContact CG-CD1 4.44Å; M107-L138 HydrophobicContact SD-CD1 3.78Å; M107-N139 WeakPolarHBondContact O-CB 3.22Å; M107-N139 PolarHBondContact O-ND2 2.96Å
108	S	93.9	Very high	89.7	Confident	45 Å²	45	39 Å²	39	32%	0.315	21%	0.211	S	C	.	.	H	α-helix	trans	-79.1	-33.4	-179.8	64.9	0	0	0	0	113.8	K104 L105 L138	K104-S108 PolarHBondContact O-N 3.3Å; K104-S108 PolarHBondContact O-OG 3.24Å; L105-S108 PolarHBondContact O-N 2.73Å; L105-S108 PolarHBondContact O-OG 2.88Å; S108-L138 WeakPolarHBondContact CA-O 3.04Å; S108-L138 WeakPolarHBondContact CB-O 3.49Å
109	T	93.1	Very high	91.4	Very high	56 Å²	56	33.6 Å²	33.6	34%	0.344	18%	0.182	S	C	.	.	H	α-helix	trans	-94.9	-20.3	-177.6	61.7	0	0	0	0	114.2	L105 K141	L105-T109 HydrophobicContact CD1-CG2 3.78Å; L105-T109 WeakPolarHBondContact O-CB 3.26Å; L105-T109 WeakPolarHBondContact O-CG2 3.16Å; L105-T109 PolarHBondContact O-N 3.34Å; L105-T109 PolarHBondContact O-OG1 2.96Å; T109-K141 PolarHBondContact O-NZ 2.89Å
110	G	93.9	Very high	92.6	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	17%	0.17	C	C	.	.			trans	-55.6	145.2	-178.4	0	0	0	0	0	112.9	Y106 N139	Y106-G110 VanDerWaalsContact O-CA 3.25Å; Y106-G110 WeakPolarHBondContact O-CA 3.29Å; Y106-G110 PolarHBondContact O-N 3.04Å; G110-N139 PolarHBondContact O-ND2 3.31Å
111	D	94.1	Very high	93.6	Very high	24 Å²	24	28.7 Å²	28.7	13%	0.128	16%	0.162	C	C	.	.	S	Bend	trans	-100.6	-26	-175.1	-89.1	-49.7	0	0	0	113.1	V36 N37 K141 A143 K203	V36-D111 HydrophobicContact CG1-CB 4.24Å; N37-D111 HydrophobicContact CB-CB 4.36Å; N37-D111 PolarHBondContact N-OD2 3.45Å; N37-D111 WeakPolarHBondContact O-CA 3.46Å; N37-D111 WeakPolarHBondContact O-CB 3.48Å; N37-D111 PolarHBondContact O-N 3.18Å; D111-K141 IonicContact OD1-NZ 3.64Å; D111-K141 PolarHBondContact OD1-NZ 2.85Å; D111-K141 IonicContact OD2-NZ 2.65Å; D111-A143 WeakPolarHBondContact O-CB 3.27Å; D111-K203 HydrophobicContact CB-CD 4.18Å; D111-K203 VanDerWaalsContact CB-CE 3.5Å; D111-K203 VanDerWaalsContact CB-NZ 3.27Å; D111-K203 WeakPolarHBondContact O-CD 3.46Å; D111-K203 PolarHBondContact O-NZ 2.73Å; D111-K203 IonicContact OD1-NZ 2.74Å; D111-K203 PolarHBondContact OD1-NZ 3.16Å
112	A	94.9	Very high	94.3	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157	159	166	0	0	0	0	0	109.1	N37 V38 V39 P144 L199	N37-A112 PolarHBondContact O-N 3.48Å; V38-A112 WeakPolarHBondContact CA-O 3.41Å; V38-A112 HydrophobicContact CG2-CB 4.2Å; V39-A112 PolarHBondContact N-O 2.59Å; V39-A112 VanDerWaalsContact N-O 3.09Å; A112-P144 WeakPolarHBondContact CA-O 2.9Å; A112-P144 HydrophobicContact CB-CG 3.86Å; A112-L199 HydrophobicContact CB-CD1 3.71Å; A112-L199 HydrophobicContact CB-CD2 3.69Å; A112-L199 HydrophobicContact CB-CG 3.65Å
113	F	95.8	Very high	94.9	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	136.6	-172.6	-63.9	-84.1	0	0	0	111.7	V39 L41 M107 V135 N139 A143 P144 V145 I146	V39-F113 HydrophobicContact CB-CD1 3.76Å; V39-F113 HydrophobicContact CB-CE1 3.77Å; V39-F113 HydrophobicContact CG1-CD1 4.49Å; V39-F113 HydrophobicContact CG1-CE1 4.43Å; V39-F113 HydrophobicContact CG2-CD1 4.24Å; V39-F113 HydrophobicContact CG2-CE1 3.77Å; V39-F113 WeakPolarHBondContact O-CA 3.27Å; L41-F113 HydrophobicContact CD1-CD1 3.7Å; L41-F113 HydrophobicContact CD1-CE1 4.28Å; M107-F113 VanDerWaalsContact O-CZ 3.27Å; M107-F113 WeakPolarHBondContact O-CZ 3.48Å; F113-V135 HydrophobicContact CD1-CG1 4.46Å; F113-V135 HydrophobicContact CD1-CG2 3.89Å; F113-V135 HydrophobicContact CD2-CG1 3.54Å; F113-V135 HydrophobicContact CD2-CG2 4.43Å; F113-V135 HydrophobicContact CE1-CG2 4.12Å; F113-V135 HydrophobicContact CE2-CG1 3.7Å; F113-V135 HydrophobicContact CG-CG1 3.97Å; F113-V135 HydrophobicContact CG-CG2 4.08Å; F113-V135 HydrophobicContact CZ-CG1 4.24Å; F113-V135 HydrophobicContact CZ-CG2 4.48Å; F113-N139 HydrophobicContact CE2-CB 4.34Å; F113-N139 WeakPolarHBondContact CE2-ND2 3.36Å; F113-A143 HydrophobicContact CD2-CB 3.93Å; F113-A143 HydrophobicContact CE2-CB 3.66Å; F113-P144 PolarHBondContact N-O 2.76Å; F113-V145 HydrophobicContact CB-CG1 4.14Å; F113-V145 HydrophobicContact CB-CG2 4.2Å; F113-V145 HydrophobicContact CD2-CG2 4.42Å; F113-V145 WeakPolarHBondContact O-CA 3.46Å; F113-I146 PolarHBondContact O-N 3.24Å
114	V	97.1	Very high	95.5	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	106.8	169.1	-178.2	0	0	0	0	107	V38 V39 I40 L41 V116 I146 V148 I195 L199	V38-V114 HydrophobicContact CG1-CG2 4.05Å; V39-V114 PolarHBondContact O-N 3.16Å; I40-V114 CarbonylContact C-O 3.51Å; I40-V114 WeakPolarHBondContact CA-O 3.19Å; I40-V114 HydrophobicContact CG1-CB 4.4Å; I40-V114 HydrophobicContact CG2-CB 4.32Å; I40-V114 HydrophobicContact CG2-CG1 4.36Å; L41-V114 PolarHBondContact N-O 2.56Å; V114-V116 HydrophobicContact CG1-CG2 3.96Å; V114-I146 CarbonylContact C-O 3.59Å; V114-I146 WeakPolarHBondContact CA-O 3.36Å; V114-V148 HydrophobicContact CG1-CG2 3.67Å; V114-I195 HydrophobicContact CG1-CG2 3.88Å; V114-I195 HydrophobicContact CG2-CG2 3.79Å; V114-L199 HydrophobicContact CG2-CD1 3.94Å
115	I	97.2	Very high	95.9	Very high	2 Å²	2	24.8 Å²	24.8	1%	0.01	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	112.1	179.6	-54.7	-176.6	0	0	0	108.1	L41 A128 L131 R132 V145 I146 L147 V148	L41-I115 HydrophobicContact CB-CG1 4.35Å; L41-I115 WeakPolarHBondContact O-CA 3.4Å; I115-A128 HydrophobicContact CG2-CB 3.6Å; I115-L131 HydrophobicContact CD1-CB 4.27Å; I115-L131 HydrophobicContact CG2-CB 4.1Å; I115-L131 HydrophobicContact CG2-CD1 4.22Å; I115-R132 HydrophobicContact CD1-CB 3.81Å; I115-V145 HydrophobicContact CD1-CG1 3.56Å; I115-V145 HydrophobicContact CG1-CG1 3.77Å; I115-I146 PolarHBondContact N-O 3.32Å; I115-L147 CarbonylContact O-C 3.57Å; I115-L147 WeakPolarHBondContact O-CA 3.09Å; I115-V148 PolarHBondContact O-N 3.37Å
116	V	98	Very high	96.3	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	128.6	-173.6	-169	0	0	0	0	110.3	I40 L41 G42 V46 K48 I51 V114 V148 N150	I40-V116 HydrophobicContact CG2-CG2 3.66Å; L41-V116 PolarHBondContact O-N 2.68Å; G42-V116 VanDerWaalsContact CA-O 3.25Å; G42-V116 WeakPolarHBondContact CA-O 3.27Å; V46-V116 HydrophobicContact CB-CG1 4.08Å; V46-V116 HydrophobicContact CG2-CB 3.82Å; V46-V116 HydrophobicContact CG2-CG1 3.76Å; K48-V116 HydrophobicContact CG-CB 4.29Å; K48-V116 HydrophobicContact CG-CG2 4.28Å; I51-V116 HydrophobicContact CD1-CG1 3.83Å; I51-V116 HydrophobicContact CD1-CG2 3.85Å; V114-V116 HydrophobicContact CG1-CG2 3.96Å; V116-V148 WeakPolarHBondContact CA-O 3.46Å; V116-V148 HydrophobicContact CG1-CB 4.48Å; V116-V148 HydrophobicContact CG1-CG1 4.38Å; V116-V148 HydrophobicContact CG2-CB 4.3Å; V116-N150 HydrophobicContact CG1-CB 3.73Å
117	H	98.2	Very high	96.5	Very high	1 Å²	1	24.8 Å²	24.8	1%	0.005	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	168.8	160.2	79.3	98.8	0	0	0	109.1	S124 F125 A128 V148 T149 N150	H117-S124 WeakPolarHBondContact CB-OG 3.26Å; H117-F125 HydrophobicContact CB-CB 4.25Å; H117-F125 AromaticContact CD2-CD2 3.81Å; H117-F125 AromaticContact CE1-CD2 3.92Å; H117-F125 AromaticContact CG-CD2 3.94Å; H117-F125 AromaticContact NE2-CD2 3.8Å; H117-A128 HydrophobicContact CB-CB 4.13Å; H117-V148 PolarHBondContact CD2-O 3.32Å; H117-V148 PolarHBondContact N-O 3.02Å; H117-V148 VanDerWaalsContact O-O 3.13Å; H117-T149 VanDerWaalsContact CE1-CG2 3.47Å; H117-T149 WeakPolarHBondContact CE1-CG2 3.45Å; H117-T149 PolarHBondContact CE1-OG1 3.36Å; H117-T149 VanDerWaalsContact CE1-OG1 3.24Å; H117-T149 PolarHBondContact NE2-OG1 3.41Å; H117-N150 PolarHBondContact O-N 3.42Å
118	A	98	Very high	96.7	Very high	1 Å²	1	24.8 Å²	24.8	1%	0.008	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	149.2	177.8	0	0	0	0	0	111.7	V46 D120 D121 S124 N150 K151	V46-A118 HydrophobicContact CB-CB 4.35Å; V46-A118 HydrophobicContact CG1-CB 4.36Å; A118-D120 WeakPolarHBondContact CB-OD1 3.41Å; A118-D120 PolarHBondContact O-N 3Å; A118-D121 HydrophobicContact CB-CB 4.43Å; A118-D121 PolarHBondContact O-N 2.89Å; A118-S124 PolarHBondContact N-OG 2.95Å; A118-N150 WeakPolarHBondContact CA-O 3.43Å; A118-K151 HydrophobicContact CB-CD 4Å; A118-K151 HydrophobicContact CB-CG 4.2Å
119	V	98.3	Very high	96.9	Very high	2 Å²	2	24.7 Å²	24.7	1%	0.012	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-23.9	-179.4	70.8	0	0	0	0	113	T149 N150 K151 M152 L154 I160 R163 A164	V119-T149 HydrophobicContact CB-CG2 3.8Å; V119-T149 HydrophobicContact CG2-CG2 4.2Å; V119-N150 PolarHBondContact N-O 2.97Å; V119-K151 HydrophobicContact CG1-CB 4.27Å; V119-K151 WeakPolarHBondContact CG1-O 3.48Å; V119-M152 HydrophobicContact CB-SD 3.97Å; V119-M152 HydrophobicContact CG1-SD 4.49Å; V119-M152 HydrophobicContact CG2-SD 3.76Å; V119-L154 HydrophobicContact CG1-CB 4.47Å; V119-I160 HydrophobicContact CG1-CD1 3.85Å; V119-I160 HydrophobicContact CG2-CD1 4.39Å; V119-R163 HydrophobicContact CG2-CB 3.8Å; V119-R163 HydrophobicContact CG2-CG 3.56Å; V119-A164 WeakPolarHBondContact O-CB 3.25Å; V119-A164 PolarHBondContact O-N 3.25Å
120	D	97.7	Very high	97	Very high	65 Å²	65	26.4 Å²	26.4	35%	0.348	14%	0.135	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90	-7.9	180	60.7	-29.8	0	0	0	114	A118 K151 L154 I160	A118-D120 WeakPolarHBondContact CB-OD1 3.41Å; A118-D120 PolarHBondContact O-N 3Å; D120-K151 WeakPolarHBondContact OD1-CD 3.31Å; D120-K151 IonicContact OD1-NZ 3.48Å; D120-K151 PolarHBondContact OD1-NZ 3.48Å; D120-K151 IonicContact OD2-NZ 2.75Å; D120-K151 PolarHBondContact OD2-NZ 2.93Å; D120-L154 HydrophobicContact CB-CD1 3.85Å; D120-L154 WeakPolarHBondContact OD2-CD1 3.49Å; D120-I160 HydrophobicContact CB-CD1 4.14Å; D120-I160 HydrophobicContact CB-CG2 4.37Å
121	D	97.6	Very high	97.1	Very high	57 Å²	57	26.4 Å²	26.4	31%	0.305	14%	0.135	S	C	.	.			trans	-132.8	105.4	-170.7	-178.5	-2.2	0	0	0	113.3	A118 A123 S124 F125	A118-D121 HydrophobicContact CB-CB 4.43Å; A118-D121 PolarHBondContact O-N 2.89Å; D121-A123 WeakPolarHBondContact OD1-CA 3.3Å; D121-A123 WeakPolarHBondContact OD1-CB 3.42Å; D121-A123 PolarHBondContact OD1-N 3.31Å; D121-S124 PolarHBondContact O-N 2.76Å; D121-S124 PolarHBondContact O-OG 3.14Å; D121-S124 PolarHBondContact OD1-N 3.45Å; D121-S124 WeakPolarHBondContact OD2-CB 3.17Å; D121-F125 PolarHBondContact O-N 3.48Å
122	R	98	Very high	97.2	Very high	109 Å²	109	26.3 Å²	26.3	41%	0.411	13%	0.133	S	C	.	.	H	α-helix	trans	-67.2	-33.3	175.1	-175.6	169.2	-163.1	-58.4	-20	113.2	S124 F125 E126 A164 V165 E169	R122-S124 VanDerWaalsContact C-N 3.31Å; R122-S124 PolarHBondContact O-N 2.93Å; R122-F125 WeakPolarHBondContact O-CB 3.39Å; R122-F125 PolarHBondContact O-N 3.19Å; R122-E126 IonicContact CZ-OE1 2.75Å; R122-E126 IonicContact NH1-OE1 3.48Å; R122-E126 PolarHBondContact NH1-OE1 3.39Å; R122-E126 IonicContact NH2-OE1 2.69Å; R122-E126 PolarHBondContact NH2-OE1 3.04Å; R122-E126 PolarHBondContact O-N 3.4Å; R122-E126 VanDerWaalsContact O-N 3.15Å; R122-A164 HydrophobicContact CB-CB 4.14Å; R122-V165 HydrophobicContact CB-CG2 4.13Å; R122-V165 HydrophobicContact CG-CG2 3.97Å; R122-E169 IonicContact NH2-OE1 2.69Å; R122-E169 PolarHBondContact NH2-OE1 3.41Å; R122-E169 IonicContact NH2-OE2 3.09Å
123	A	97.8	Very high	97.2	Very high	70 Å²	70	29.6 Å²	29.6	58%	0.579	15%	0.148	S	C	*	.	H	α-helix	trans	-67.5	-35.9	177.8	0	0	0	0	0	110.9	D121 F125 E126 E127	D121-A123 WeakPolarHBondContact OD1-CA 3.3Å; D121-A123 WeakPolarHBondContact OD1-CB 3.42Å; D121-A123 PolarHBondContact OD1-N 3.31Å; A123-F125 PolarHBondContact O-N 2.61Å; A123-E126 PolarHBondContact O-N 2.88Å; A123-E127 PolarHBondContact O-N 2.91Å
124	S	97.3	Very high	97.2	Very high	1 Å²	1	32.4 Å²	32.4	1%	0.007	16%	0.162	C	C	.	.	H	α-helix	trans	-61.9	-31.3	172.4	79.3	0	0	0	0	113.4	H117 A118 D121 R122 A128	H117-S124 WeakPolarHBondContact CB-OG 3.26Å; A118-S124 PolarHBondContact N-OG 2.95Å; D121-S124 PolarHBondContact O-N 2.76Å; D121-S124 PolarHBondContact O-OG 3.14Å; D121-S124 PolarHBondContact OD1-N 3.45Å; D121-S124 WeakPolarHBondContact OD2-CB 3.17Å; R122-S124 VanDerWaalsContact C-N 3.31Å; R122-S124 PolarHBondContact O-N 2.93Å; S124-A128 WeakPolarHBondContact O-CB 3.22Å; S124-A128 PolarHBondContact O-N 3.09Å
125	F	98.4	Very high	97.1	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-72.3	-41.9	174.9	-179.4	-125.1	0	0	0	111.7	H117 D121 R122 A123 A128 K129 L147 V165 E169 V170 Y173	H117-F125 HydrophobicContact CB-CB 4.25Å; H117-F125 AromaticContact CD2-CD2 3.81Å; H117-F125 AromaticContact CE1-CD2 3.92Å; H117-F125 AromaticContact CG-CD2 3.94Å; H117-F125 AromaticContact NE2-CD2 3.8Å; D121-F125 PolarHBondContact O-N 3.48Å; R122-F125 WeakPolarHBondContact O-CB 3.39Å; R122-F125 PolarHBondContact O-N 3.19Å; A123-F125 PolarHBondContact O-N 2.61Å; F125-A128 WeakPolarHBondContact O-CA 3.17Å; F125-A128 VanDerWaalsContact O-CB 3.31Å; F125-A128 WeakPolarHBondContact O-CB 3.38Å; F125-A128 PolarHBondContact O-N 2.95Å; F125-A128 VanDerWaalsContact O-N 3.1Å; F125-K129 HydrophobicContact CE1-CD 4.49Å; F125-K129 VanDerWaalsContact CZ-CE 3.42Å; F125-K129 WeakPolarHBondContact O-CG 3.09Å; F125-K129 PolarHBondContact O-N 3.4Å; F125-L147 HydrophobicContact CE2-CD2 4.21Å; F125-V165 HydrophobicContact CB-CG2 3.85Å; F125-V165 HydrophobicContact CD1-CB 4.23Å; F125-V165 HydrophobicContact CD1-CG1 3.58Å; F125-V165 HydrophobicContact CD1-CG2 3.65Å; F125-V165 HydrophobicContact CE1-CG1 3.54Å; F125-V165 HydrophobicContact CE1-CG2 4.46Å; F125-V165 HydrophobicContact CG-CG1 4.33Å; F125-V165 HydrophobicContact CG-CG2 3.97Å; F125-V165 HydrophobicContact CZ-CG1 4.3Å; F125-E169 HydrophobicContact CE1-CG 4.04Å; F125-E169 WeakPolarHBondContact CE1-OE1 3.48Å; F125-V170 HydrophobicContact CD2-CG2 4.48Å; F125-V170 HydrophobicContact CE1-CG2 4.39Å; F125-V170 HydrophobicContact CE2-CB 4.45Å; F125-V170 HydrophobicContact CE2-CG1 4.19Å; F125-V170 HydrophobicContact CE2-CG2 3.99Å; F125-V170 HydrophobicContact CZ-CB 4.39Å; F125-V170 HydrophobicContact CZ-CG2 3.93Å; F125-Y173 HydrophobicContact CE2-CD1 4.16Å; F125-Y173 HydrophobicContact CE2-CG 4.47Å; F125-Y173 HydrophobicContact CZ-CD1 4.23Å; F125-Y173 HydrophobicContact CZ-CG 4.08Å
126	E	98.1	Very high	97	Very high	61 Å²	61	37.7 Å²	37.7	29%	0.285	18%	0.182	S	C	.	.	H	α-helix	trans	-64.5	-39.9	175.2	-57.1	-65.3	-168.3	0	0	111.9	R122 A123 A128 K129 E130	R122-E126 IonicContact CZ-OE1 2.75Å; R122-E126 IonicContact NH1-OE1 3.48Å; R122-E126 PolarHBondContact NH1-OE1 3.39Å; R122-E126 IonicContact NH2-OE1 2.69Å; R122-E126 PolarHBondContact NH2-OE1 3.04Å; R122-E126 PolarHBondContact O-N 3.4Å; R122-E126 VanDerWaalsContact O-N 3.15Å; A123-E126 PolarHBondContact O-N 2.88Å; E126-A128 VanDerWaalsContact C-N 3.29Å; E126-A128 PolarHBondContact O-N 3.04Å; E126-K129 WeakPolarHBondContact O-CB 3.47Å; E126-K129 PolarHBondContact O-N 3.37Å; E126-K129 VanDerWaalsContact O-N 3.1Å; E126-K129 IonicContact OE1-NZ 3.19Å; E126-K129 PolarHBondContact OE1-NZ 3.02Å; E126-K129 WeakPolarHBondContact OE2-CD 3.41Å; E126-K129 WeakPolarHBondContact OE2-CE 3.15Å; E126-K129 IonicContact OE2-NZ 2.65Å; E126-K129 PolarHBondContact OE2-NZ 3.41Å; E126-E130 PolarHBondContact O-N 3.41Å
127	E	96.3	Very high	96.8	Very high	26 Å²	26	40.5 Å²	40.5	12%	0.121	20%	0.201	C	C	.	.	H	α-helix	trans	-64.4	-32.9	171.1	178.5	160.8	-149.1	0	0	112	A43 R97 R103 A123 K129 E130 L131	A43-E127 WeakPolarHBondContact CA-OE2 3.44Å; A43-E127 HydrophobicContact CB-CB 4.44Å; A43-E127 WeakPolarHBondContact CB-OE2 3.4Å; R97-E127 IonicContact CZ-OE1 3.53Å; R97-E127 IonicContact NE-OE1 3.14Å; R97-E127 PolarHBondContact NE-OE1 3.17Å; R97-E127 IonicContact NH2-OE1 3.69Å; R97-E127 PolarHBondContact NH2-OE1 3.26Å; R97-E127 VanDerWaalsContact NH2-OE1 3.14Å; R103-E127 IonicContact CZ-OE1 2.74Å; R103-E127 IonicContact NH1-OE1 2.87Å; R103-E127 IonicContact NH2-OE1 2.74Å; R103-E127 PolarHBondContact NH2-OE1 3.08Å; A123-E127 PolarHBondContact O-N 2.91Å; E127-K129 VanDerWaalsContact C-N 3.3Å; E127-K129 PolarHBondContact O-N 3.34Å; E127-E130 PolarHBondContact O-N 3.21Å; E127-L131 HydrophobicContact CG-CD1 3.97Å; E127-L131 HydrophobicContact CG-CG 4.25Å; E127-L131 VanDerWaalsContact O-CB 3.31Å; E127-L131 WeakPolarHBondContact O-CB 3.49Å; E127-L131 WeakPolarHBondContact O-CD1 3.34Å; E127-L131 VanDerWaalsContact O-CG 3.25Å; E127-L131 WeakPolarHBondContact O-CG 3.44Å; E127-L131 PolarHBondContact O-N 2.81Å
128	A	97.2	Very high	96.7	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-62.7	-34.9	171.9	0	0	0	0	0	112.4	I115 H117 S124 F125 E126 L131 R132 L147	I115-A128 HydrophobicContact CG2-CB 3.6Å; H117-A128 HydrophobicContact CB-CB 4.13Å; S124-A128 WeakPolarHBondContact O-CB 3.22Å; S124-A128 PolarHBondContact O-N 3.09Å; F125-A128 WeakPolarHBondContact O-CA 3.17Å; F125-A128 VanDerWaalsContact O-CB 3.31Å; F125-A128 WeakPolarHBondContact O-CB 3.38Å; F125-A128 PolarHBondContact O-N 2.95Å; F125-A128 VanDerWaalsContact O-N 3.1Å; E126-A128 VanDerWaalsContact C-N 3.29Å; E126-A128 PolarHBondContact O-N 3.04Å; A128-L131 PolarHBondContact O-N 2.98Å; A128-R132 PolarHBondContact O-N 2.96Å; A128-L147 HydrophobicContact CB-CD1 4.15Å
129	K	98	Very high	96.5	Very high	43 Å²	43	43.8 Å²	43.8	19%	0.187	22%	0.218	C	C	.	.	H	α-helix	trans	-66.8	-47	172.5	-54.6	-174.3	-167.2	154.6	0	111.6	F125 E126 E127 L131 R132 E133 E169 Y173	F125-K129 HydrophobicContact CE1-CD 4.49Å; F125-K129 VanDerWaalsContact CZ-CE 3.42Å; F125-K129 WeakPolarHBondContact O-CG 3.09Å; F125-K129 PolarHBondContact O-N 3.4Å; E126-K129 WeakPolarHBondContact O-CB 3.47Å; E126-K129 PolarHBondContact O-N 3.37Å; E126-K129 VanDerWaalsContact O-N 3.1Å; E126-K129 IonicContact OE1-NZ 3.19Å; E126-K129 PolarHBondContact OE1-NZ 3.02Å; E126-K129 WeakPolarHBondContact OE2-CD 3.41Å; E126-K129 WeakPolarHBondContact OE2-CE 3.15Å; E126-K129 IonicContact OE2-NZ 2.65Å; E126-K129 PolarHBondContact OE2-NZ 3.41Å; E127-K129 VanDerWaalsContact C-N 3.3Å; E127-K129 PolarHBondContact O-N 3.34Å; K129-L131 VanDerWaalsContact C-N 3.28Å; K129-L131 PolarHBondContact O-N 3.13Å; K129-R132 PolarHBondContact O-N 3.1Å; K129-E133 PolarHBondContact O-N 2.84Å; K129-E169 IonicContact NZ-OE1 3.17Å; K129-E169 PolarHBondContact NZ-OE1 3.22Å; K129-Y173 WeakPolarHBondContact CA-OH 3.32Å; K129-Y173 HydrophobicContact CB-CE1 4.5Å; K129-Y173 HydrophobicContact CB-CE2 3.86Å; K129-Y173 HydrophobicContact CD-CD2 3.74Å; K129-Y173 HydrophobicContact CD-CE2 3.68Å; K129-Y173 HydrophobicContact CD-CG 4.39Å; K129-Y173 HydrophobicContact CG-CD1 4.32Å; K129-Y173 HydrophobicContact CG-CD2 3.89Å; K129-Y173 HydrophobicContact CG-CE1 3.98Å; K129-Y173 HydrophobicContact CG-CE2 3.5Å; K129-Y173 VanDerWaalsContact CG-CE2 3.5Å; K129-Y173 HydrophobicContact CG-CG 4.31Å
130	E	96	Very high	96.2	Very high	93 Å²	93	50.4 Å²	50.4	44%	0.435	26%	0.258	S	S	.	.	H	α-helix	trans	-56.6	-41.7	174.5	-67.6	-177.8	176.6	0	0	111.9	R97 E126 E127 Q134	R97-E130 IonicContact CZ-OE2 2.87Å; R97-E130 IonicContact NH1-OE2 2.8Å; R97-E130 IonicContact NH2-OE2 3.8Å; R97-E130 PolarHBondContact NH2-OE2 3.05Å; E126-E130 PolarHBondContact O-N 3.41Å; E127-E130 PolarHBondContact O-N 3.21Å; E130-Q134 VanDerWaalsContact O-CG 3.3Å; E130-Q134 WeakPolarHBondContact O-CG 3.38Å; E130-Q134 PolarHBondContact O-N 2.79Å; E130-Q134 PolarHBondContact O-NE2 2.85Å
131	L	94.9	Very high	95.9	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-64.7	-44.4	177.9	-82.6	166.4	0	0	0	112.8	L41 G42 M107 I115 E127 A128 K129 E133 Q134 V135	L41-L131 HydrophobicContact CB-CD1 4.14Å; L41-L131 HydrophobicContact CB-CD2 4.06Å; L41-L131 HydrophobicContact CD1-CD2 4.28Å; L41-L131 HydrophobicContact CD2-CD2 4.4Å; L41-L131 HydrophobicContact CG-CD2 4.49Å; G42-L131 VanDerWaalsContact CA-CD1 3.4Å; M107-L131 HydrophobicContact CE-CD2 3.33Å; I115-L131 HydrophobicContact CD1-CB 4.27Å; I115-L131 HydrophobicContact CG2-CB 4.1Å; I115-L131 HydrophobicContact CG2-CD1 4.22Å; E127-L131 HydrophobicContact CG-CD1 3.97Å; E127-L131 HydrophobicContact CG-CG 4.25Å; E127-L131 VanDerWaalsContact O-CB 3.31Å; E127-L131 WeakPolarHBondContact O-CB 3.49Å; E127-L131 WeakPolarHBondContact O-CD1 3.34Å; E127-L131 VanDerWaalsContact O-CG 3.25Å; E127-L131 WeakPolarHBondContact O-CG 3.44Å; E127-L131 PolarHBondContact O-N 2.81Å; A128-L131 PolarHBondContact O-N 2.98Å; K129-L131 VanDerWaalsContact C-N 3.28Å; K129-L131 PolarHBondContact O-N 3.13Å; L131-E133 VanDerWaalsContact C-N 3.28Å; L131-E133 PolarHBondContact O-N 3.03Å; L131-Q134 PolarHBondContact O-N 3.27Å; L131-V135 WeakPolarHBondContact O-CG2 3.32Å; L131-V135 PolarHBondContact O-N 3.13Å
132	R	96.5	Very high	95.3	Very high	22 Å²	22	54.8 Å²	54.8	8%	0.083	28%	0.277	C	S	.	.	H	α-helix	trans	-61.5	-39.7	178.6	172.1	58.5	-171.7	117	-11.4	111.6	I115 A128 K129 V135 R136 Y173 H177 C179	I115-R132 HydrophobicContact CD1-CB 3.81Å; A128-R132 PolarHBondContact O-N 2.96Å; K129-R132 PolarHBondContact O-N 3.1Å; R132-V135 PolarHBondContact O-N 3.42Å; R132-R136 PolarHBondContact O-N 3.35Å; R132-Y173 WeakPolarHBondContact CB-OH 3.41Å; R132-Y173 WeakPolarHBondContact CG-OH 3.42Å; R132-H177 HydrophobicContact CG-CB 4.1Å; R132-H177 PolarHBondContact NE-O 3.34Å; R132-H177 VanDerWaalsContact NE-O 3.1Å; R132-H177 PolarHBondContact NH2-O 3.27Å; R132-C179 WeakPolarHBondContact CD-SG 3.34Å; R132-C179 PolarHBondContact NE-SG 3.44Å
133	E	95.5	Very high	95.1	Very high	68 Å²	68	49.9 Å²	49.9	32%	0.318	26%	0.26	S	S	.	.	H	α-helix	trans	-69.5	-41.6	177.7	-178.1	60.9	-173.9	0	0	111.8	K129 L131 V135 R136 C137	K129-E133 PolarHBondContact O-N 2.84Å; L131-E133 VanDerWaalsContact C-N 3.28Å; L131-E133 PolarHBondContact O-N 3.03Å; E133-V135 VanDerWaalsContact C-N 3.35Å; E133-V135 PolarHBondContact O-N 3.11Å; E133-R136 WeakPolarHBondContact O-CB 3.44Å; E133-R136 PolarHBondContact O-N 3.02Å; E133-R136 VanDerWaalsContact O-N 3.14Å; E133-R136 IonicContact OE1-CZ 3.32Å; E133-R136 IonicContact OE1-NE 2.89Å; E133-R136 PolarHBondContact OE1-NE 3.09Å; E133-R136 IonicContact OE1-NH2 3.32Å; E133-R136 PolarHBondContact OE1-NH2 3.28Å; E133-R136 IonicContact OE2-CZ 4Å; E133-R136 IonicContact OE2-NE 3.71Å; E133-R136 PolarHBondContact OE2-NE 3.06Å; E133-R136 IonicContact OE2-NH2 2.74Å; E133-C137 PolarHBondContact O-N 2.97Å
134	Q	94.3	Very high	94.9	Very high	60 Å²	60	47.8 Å²	47.8	28%	0.28	24%	0.24	S	C	.	.	H	α-helix	trans	-59.8	-43.5	171.8	-72.4	167.4	38.4	0	0	111.9	M107 E130 L131 R136 C137 L138	M107-Q134 HydrophobicContact CE-CB 3.96Å; M107-Q134 HydrophobicContact SD-CB 3.77Å; E130-Q134 VanDerWaalsContact O-CG 3.3Å; E130-Q134 WeakPolarHBondContact O-CG 3.38Å; E130-Q134 PolarHBondContact O-N 2.79Å; E130-Q134 PolarHBondContact O-NE2 2.85Å; L131-Q134 PolarHBondContact O-N 3.27Å; Q134-R136 VanDerWaalsContact C-N 3.35Å; Q134-R136 PolarHBondContact O-N 3.43Å; Q134-C137 PolarHBondContact O-N 3.07Å; Q134-L138 VanDerWaalsContact O-CB 3.26Å; Q134-L138 WeakPolarHBondContact O-CB 3.5Å; Q134-L138 VanDerWaalsContact O-CG 3.22Å; Q134-L138 WeakPolarHBondContact O-CG 3.15Å; Q134-L138 PolarHBondContact O-N 2.82Å
135	V	95.4	Very high	94.8	Very high	2 Å²	2	47.8 Å²	47.8	1%	0.012	24%	0.24	C	C	.	.	H	α-helix	trans	-60.4	-43.7	173	169.7	0	0	0	0	110.9	L41 M107 F113 L131 R132 E133 C137 L138 N139 V145	L41-V135 HydrophobicContact CD1-CG2 3.73Å; M107-V135 HydrophobicContact CB-CG2 4.47Å; M107-V135 HydrophobicContact CG-CG2 3.93Å; F113-V135 HydrophobicContact CD1-CG1 4.46Å; F113-V135 HydrophobicContact CD1-CG2 3.89Å; F113-V135 HydrophobicContact CD2-CG1 3.54Å; F113-V135 HydrophobicContact CD2-CG2 4.43Å; F113-V135 HydrophobicContact CE1-CG2 4.12Å; F113-V135 HydrophobicContact CE2-CG1 3.7Å; F113-V135 HydrophobicContact CG-CG1 3.97Å; F113-V135 HydrophobicContact CG-CG2 4.08Å; F113-V135 HydrophobicContact CZ-CG1 4.24Å; F113-V135 HydrophobicContact CZ-CG2 4.48Å; L131-V135 WeakPolarHBondContact O-CG2 3.32Å; L131-V135 PolarHBondContact O-N 3.13Å; R132-V135 PolarHBondContact O-N 3.42Å; E133-V135 VanDerWaalsContact C-N 3.35Å; E133-V135 PolarHBondContact O-N 3.11Å; V135-C137 VanDerWaalsContact C-N 3.34Å; V135-C137 PolarHBondContact O-N 3Å; V135-L138 PolarHBondContact O-N 3.35Å; V135-N139 HydrophobicContact CG1-CB 4.24Å; V135-N139 WeakPolarHBondContact O-CB 3.43Å; V135-N139 PolarHBondContact O-N 3.31Å; V135-V145 HydrophobicContact CG1-CG2 4.13Å
136	R	95	Very high	94.8	Very high	111 Å²	111	47.8 Å²	47.8	42%	0.419	24%	0.24	S	C	.	.	H	α-helix	trans	-58.8	-42.5	178.9	-168.6	-175.8	70.4	82.7	-4.3	112.5	C6 R132 E133 Q134	C6-R136 PolarHBondContact O-NH2 2.88Å; R132-R136 PolarHBondContact O-N 3.35Å; E133-R136 WeakPolarHBondContact O-CB 3.44Å; E133-R136 PolarHBondContact O-N 3.02Å; E133-R136 VanDerWaalsContact O-N 3.14Å; E133-R136 IonicContact OE1-CZ 3.32Å; E133-R136 IonicContact OE1-NE 2.89Å; E133-R136 PolarHBondContact OE1-NE 3.09Å; E133-R136 IonicContact OE1-NH2 3.32Å; E133-R136 PolarHBondContact OE1-NH2 3.28Å; E133-R136 IonicContact OE2-CZ 4Å; E133-R136 IonicContact OE2-NE 3.71Å; E133-R136 PolarHBondContact OE2-NE 3.06Å; E133-R136 IonicContact OE2-NH2 2.74Å; Q134-R136 VanDerWaalsContact C-N 3.35Å; Q134-R136 PolarHBondContact O-N 3.43Å
137	C	94.6	Very high	94.8	Very high	59 Å²	59	45 Å²	45	40%	0.399	23%	0.228	S	C	.	.	H	α-helix	trans	-85.4	-17.3	-177.3	-60.9	0	0	0	0	114	C6 E133 Q134 V135	C6-C137 HydrophobicContact CB-CB 4.34Å; C6-C137 WeakPolarHBondContact CB-SG 3.46Å; C6-C137 WeakPolarHBondContact SG-CB 3.49Å; C6-C137 CovalentContact SG-SG 2.04Å; C6-C137 PolarHBondContact SG-SG 2.81Å; E133-C137 PolarHBondContact O-N 2.97Å; Q134-C137 PolarHBondContact O-N 3.07Å; V135-C137 VanDerWaalsContact C-N 3.34Å; V135-C137 PolarHBondContact O-N 3Å
138	L	94.9	Very high	94.9	Very high	58 Å²	58	43.8 Å²	43.8	30%	0.304	22%	0.222	S	C	.	.	H	α-helix	trans	-104	-27.2	-178.8	-65.5	172	0	0	0	114.1	K104 M107 S108 Q134 V135	K104-L138 HydrophobicContact CB-CD1 4.28Å; K104-L138 HydrophobicContact CG-CD1 3.97Å; M107-L138 HydrophobicContact CB-CB 4.1Å; M107-L138 HydrophobicContact CB-CD1 3.78Å; M107-L138 HydrophobicContact CG-CD1 4.44Å; M107-L138 HydrophobicContact SD-CD1 3.78Å; S108-L138 WeakPolarHBondContact CA-O 3.04Å; S108-L138 WeakPolarHBondContact CB-O 3.49Å; Q134-L138 VanDerWaalsContact O-CB 3.26Å; Q134-L138 WeakPolarHBondContact O-CB 3.5Å; Q134-L138 VanDerWaalsContact O-CG 3.22Å; Q134-L138 WeakPolarHBondContact O-CG 3.15Å; Q134-L138 PolarHBondContact O-N 2.82Å; V135-L138 PolarHBondContact O-N 3.35Å
139	N	95.2	Very high	94.9	Very high	12 Å²	12	43.8 Å²	43.8	6%	0.064	22%	0.222	C	C	.	.			trans	-97.4	100.7	-174.9	-162.6	-80.9	0	0	0	111.9	M107 G110 F113 V135 K141 A143	M107-N139 WeakPolarHBondContact O-CB 3.22Å; M107-N139 PolarHBondContact O-ND2 2.96Å; G110-N139 PolarHBondContact O-ND2 3.31Å; F113-N139 HydrophobicContact CE2-CB 4.34Å; F113-N139 WeakPolarHBondContact CE2-ND2 3.36Å; V135-N139 HydrophobicContact CG1-CB 4.24Å; V135-N139 WeakPolarHBondContact O-CB 3.43Å; V135-N139 PolarHBondContact O-N 3.31Å; N139-K141 PolarHBondContact O-N 2.81Å; N139-K141 WeakPolarHBondContact OD1-CB 3.46Å; N139-K141 PolarHBondContact OD1-N 2.81Å; N139-K141 VanDerWaalsContact OD1-N 3.17Å; N139-A143 VanDerWaalsContact OD1-CB 3.3Å; N139-A143 WeakPolarHBondContact OD1-CB 3.45Å; N139-A143 PolarHBondContact OD1-N 2.8Å
140	T	91.8	Very high	95	Very high	142 Å²	142	41.9 Å²	41.9	87%	0.871	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.6	5.4	179.5	59.2	0	0	0	0	114.3
141	K	90.1	Very high	95	Very high	101 Å²	101	39.6 Å²	39.6	44%	0.439	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.8	-3.5	-178.1	-53.7	176.5	174.3	178.7	0	114.1	T109 D111 N139 A143	T109-K141 PolarHBondContact O-NZ 2.89Å; D111-K141 IonicContact OD1-NZ 3.64Å; D111-K141 PolarHBondContact OD1-NZ 2.85Å; D111-K141 IonicContact OD2-NZ 2.65Å; N139-K141 PolarHBondContact O-N 2.81Å; N139-K141 WeakPolarHBondContact OD1-CB 3.46Å; N139-K141 PolarHBondContact OD1-N 2.81Å; N139-K141 VanDerWaalsContact OD1-N 3.17Å; K141-A143 PolarHBondContact O-N 3.14Å
142	D	86.7	Confident	95.1	Very high	112 Å²	112	39.9 Å²	39.9	60%	0.599	20%	0.204	S	C	*	.			trans	49.5	46.5	-165.8	-164.3	33.8	0	0	0	112.2
143	A	92.5	Very high	95.1	Very high	7 Å²	7	40.1 Å²	40.1	6%	0.058	21%	0.206	C	C	.	.			trans	-62.9	133.7	-178.5	0	0	0	0	0	111.5	D111 F113 N139 K141	D111-A143 WeakPolarHBondContact O-CB 3.27Å; F113-A143 HydrophobicContact CD2-CB 3.93Å; F113-A143 HydrophobicContact CE2-CB 3.66Å; N139-A143 VanDerWaalsContact OD1-CB 3.3Å; N139-A143 WeakPolarHBondContact OD1-CB 3.45Å; N139-A143 PolarHBondContact OD1-N 2.8Å; K141-A143 PolarHBondContact O-N 3.14Å
144	P	94.2	Very high	95.1	Very high	25 Å²	25	38.5 Å²	38.5	16%	0.162	20%	0.2	C	C	.	.			trans	-64.2	141.4	-178.7	25.3	-33	0	0	0	111.3	A112 F113 Q202 K203	A112-P144 WeakPolarHBondContact CA-O 2.9Å; A112-P144 HydrophobicContact CB-CG 3.86Å; F113-P144 PolarHBondContact N-O 2.76Å; P144-Q202 HydrophobicContact CB-CB 3.93Å; P144-Q202 HydrophobicContact CG-CB 4.15Å; P144-K203 HydrophobicContact CG-CB 4.17Å
145	V	95.7	Very high	95.2	Very high	1 Å²	1	38.1 Å²	38.1	1%	0.006	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	128.5	179.1	-170.6	0	0	0	0	109.9	F113 I115 V135 C179 R180	F113-V145 HydrophobicContact CB-CG1 4.14Å; F113-V145 HydrophobicContact CB-CG2 4.2Å; F113-V145 HydrophobicContact CD2-CG2 4.42Å; F113-V145 WeakPolarHBondContact O-CA 3.46Å; I115-V145 HydrophobicContact CD1-CG1 3.56Å; I115-V145 HydrophobicContact CG1-CG1 3.77Å; V135-V145 HydrophobicContact CG1-CG2 4.13Å; V145-C179 WeakPolarHBondContact O-CA 3.48Å; V145-R180 PolarHBondContact O-N 3.37Å
146	I	97.2	Very high	95.2	Very high	1 Å²	1	44 Å²	44	1%	0.005	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	121.2	168.6	-52.9	-175.9	0	0	0	108.4	F113 V114 I115 V148 R180 I182 I195 T198 L199	F113-I146 PolarHBondContact O-N 3.24Å; V114-I146 CarbonylContact C-O 3.59Å; V114-I146 WeakPolarHBondContact CA-O 3.36Å; I115-I146 PolarHBondContact N-O 3.32Å; I146-V148 HydrophobicContact CG2-CG2 3.91Å; I146-R180 CarbonylContact C-O 3.35Å; I146-R180 WeakPolarHBondContact CA-O 3.36Å; I146-R180 HydrophobicContact CG1-CB 4.35Å; I146-I182 HydrophobicContact CD1-CD1 4.5Å; I146-I182 HydrophobicContact CG2-CD1 3.82Å; I146-I182 HydrophobicContact CG2-CG1 4.03Å; I146-I195 HydrophobicContact CD1-CG2 4.12Å; I146-I195 WeakPolarHBondContact CD1-O 3.16Å; I146-I195 HydrophobicContact CG2-CG2 4.35Å; I146-T198 HydrophobicContact CD1-CG2 3.86Å; I146-L199 HydrophobicContact CD1-CB 3.75Å
147	L	98.3	Very high	95.2	Very high	3 Å²	3	43.7 Å²	43.7	2%	0.016	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	124.7	167.8	-178.7	67.4	0	0	0	108.7	I115 F125 A128 V170 Y173 A174 C179 R180 W181 I182	I115-L147 CarbonylContact O-C 3.57Å; I115-L147 WeakPolarHBondContact O-CA 3.09Å; F125-L147 HydrophobicContact CE2-CD2 4.21Å; A128-L147 HydrophobicContact CB-CD1 4.15Å; L147-V170 HydrophobicContact CD2-CG1 3.75Å; L147-Y173 HydrophobicContact CD2-CD1 3.96Å; L147-Y173 HydrophobicContact CD2-CE1 4.49Å; L147-A174 HydrophobicContact CD2-CB 4.14Å; L147-C179 HydrophobicContact CB-CB 4.23Å; L147-R180 PolarHBondContact N-O 2.89Å; L147-W181 WeakPolarHBondContact O-CA 3.37Å; L147-I182 PolarHBondContact O-N 3.27Å
148	V	98.5	Very high	95.2	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	122.4	-177.6	176.6	0	0	0	0	109.9	I51 V114 I115 V116 H117 I146 N150 I182 V184 I195	I51-V148 HydrophobicContact CD1-CG1 4.21Å; V114-V148 HydrophobicContact CG1-CG2 3.67Å; I115-V148 PolarHBondContact O-N 3.37Å; V116-V148 WeakPolarHBondContact CA-O 3.46Å; V116-V148 HydrophobicContact CG1-CB 4.48Å; V116-V148 HydrophobicContact CG1-CG1 4.38Å; V116-V148 HydrophobicContact CG2-CB 4.3Å; H117-V148 PolarHBondContact CD2-O 3.32Å; H117-V148 PolarHBondContact N-O 3.02Å; H117-V148 VanDerWaalsContact O-O 3.13Å; I146-V148 HydrophobicContact CG2-CG2 3.91Å; V148-N150 HydrophobicContact CG1-CB 4.37Å; V148-I182 WeakPolarHBondContact CA-O 3.14Å; V148-V184 HydrophobicContact CG1-CB 3.77Å; V148-V184 HydrophobicContact CG1-CG2 3.64Å; V148-I195 HydrophobicContact CG1-CD1 4.27Å; V148-I195 HydrophobicContact CG2-CD1 4.05Å; V148-I195 HydrophobicContact CG2-CG1 4.07Å; V148-I195 HydrophobicContact CG2-CG2 4.19Å
149	T	98.5	Very high	95.3	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	103.5	165.1	-51.1	0	0	0	0	108.5	H117 V119 M152 W181 I182 V184	H117-T149 VanDerWaalsContact CE1-CG2 3.47Å; H117-T149 WeakPolarHBondContact CE1-CG2 3.45Å; H117-T149 PolarHBondContact CE1-OG1 3.36Å; H117-T149 VanDerWaalsContact CE1-OG1 3.24Å; H117-T149 PolarHBondContact NE2-OG1 3.41Å; V119-T149 HydrophobicContact CB-CG2 3.8Å; V119-T149 HydrophobicContact CG2-CG2 4.2Å; T149-M152 HydrophobicContact CG2-SD 4.03Å; T149-W181 PolarHBondContact OG1-NE1 3.39Å; T149-I182 PolarHBondContact N-O 3.1Å; T149-V184 PolarHBondContact O-N 2.94Å
150	N	98.3	Very high	95.4	Very high	3 Å²	3	45.8 Å²	45.8	2%	0.016	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	170	-178	-169.2	31.9	0	0	0	112.9	V46 I51 V116 H117 A118 V119 V148 V184 A186	V46-N150 PolarHBondContact O-ND2 3.35Å; I51-N150 HydrophobicContact CD1-CB 4.28Å; V116-N150 HydrophobicContact CG1-CB 3.73Å; H117-N150 PolarHBondContact O-N 3.42Å; A118-N150 WeakPolarHBondContact CA-O 3.43Å; V119-N150 PolarHBondContact N-O 2.97Å; V148-N150 HydrophobicContact CG1-CB 4.37Å; N150-V184 CarbonylContact C-O 3.56Å; N150-V184 VanDerWaalsContact CA-O 3.27Å; N150-V184 WeakPolarHBondContact CA-O 3.27Å; N150-V184 PolarHBondContact OD1-O 3.49Å; N150-A186 WeakPolarHBondContact OD1-CB 3Å; N150-A186 PolarHBondContact OD1-N 2.9Å
151	K	97	Very high	95.6	Very high	45 Å²	45	47.1 Å²	47.1	20%	0.196	25%	0.249	C	C	.	.			trans	67	30.9	-178.8	-41.3	-175.6	-160	150	0	114.1	Q45 A118 V119 D120 D153 L154 V184	Q45-K151 WeakPolarHBondContact O-CE 3.43Å; A118-K151 HydrophobicContact CB-CD 4Å; A118-K151 HydrophobicContact CB-CG 4.2Å; V119-K151 HydrophobicContact CG1-CB 4.27Å; V119-K151 WeakPolarHBondContact CG1-O 3.48Å; D120-K151 WeakPolarHBondContact OD1-CD 3.31Å; D120-K151 IonicContact OD1-NZ 3.48Å; D120-K151 PolarHBondContact OD1-NZ 3.48Å; D120-K151 IonicContact OD2-NZ 2.75Å; D120-K151 PolarHBondContact OD2-NZ 2.93Å; K151-D153 VanDerWaalsContact C-OD1 3.25Å; K151-D153 WeakPolarHBondContact CA-OD1 3.01Å; K151-D153 PolarHBondContact O-N 2.88Å; K151-D153 VanDerWaalsContact O-N 3.09Å; K151-L154 HydrophobicContact CB-CD1 3.78Å; K151-L154 HydrophobicContact CB-CG 4Å; K151-L154 HydrophobicContact CD-CD1 3.67Å; K151-L154 HydrophobicContact CG-CD1 4.44Å; K151-L154 WeakPolarHBondContact O-CB 3.25Å; K151-L154 WeakPolarHBondContact O-CG 3.39Å; K151-L154 PolarHBondContact O-N 3.03Å; K151-V184 PolarHBondContact N-O 3.19Å
152	M	97.4	Very high	95.8	Very high	6 Å²	6	52.3 Å²	52.3	3%	0.03	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-24.4	-179.9	-69.3	-61.5	-58.9	0	0	113.5	V119 T149 L154 L155 H156 E183 V184	V119-M152 HydrophobicContact CB-SD 3.97Å; V119-M152 HydrophobicContact CG1-SD 4.49Å; V119-M152 HydrophobicContact CG2-SD 3.76Å; T149-M152 HydrophobicContact CG2-SD 4.03Å; M152-L154 PolarHBondContact O-N 3.45Å; M152-L155 HydrophobicContact CE-CD2 4.14Å; M152-L155 WeakPolarHBondContact O-CB 3.47Å; M152-L155 PolarHBondContact O-N 2.85Å; M152-H156 PolarHBondContact O-N 3.43Å; M152-E183 HydrophobicContact CE-CB 4.44Å; M152-E183 VanDerWaalsContact CE-CD 3.47Å; M152-E183 HydrophobicContact CE-CG 4.39Å; M152-E183 WeakPolarHBondContact CE-OE1 3.3Å; M152-E183 HydrophobicContact CG-CB 3.92Å; M152-E183 HydrophobicContact SD-CB 4.21Å; M152-E183 HydrophobicContact SD-CG 4.22Å; M152-V184 WeakPolarHBondContact CG-O 3.48Å; M152-V184 PolarHBondContact N-O 2.74Å; M152-V184 VanDerWaalsContact N-O 3.12Å
153	D	95.9	Very high	96.3	Very high	26 Å²	26	48.7 Å²	48.7	14%	0.139	24%	0.243	C	C	.	.	H	α-helix	trans	-57.8	-27.2	170.4	61.2	-55.6	0	0	0	114.3	K151 L155 H156 D157 T185 K187	K151-D153 VanDerWaalsContact C-OD1 3.25Å; K151-D153 WeakPolarHBondContact CA-OD1 3.01Å; K151-D153 PolarHBondContact O-N 2.88Å; K151-D153 VanDerWaalsContact O-N 3.09Å; D153-L155 PolarHBondContact O-N 3.14Å; D153-H156 PolarHBondContact O-N 3.5Å; D153-D157 WeakPolarHBondContact O-CA 3.27Å; D153-D157 WeakPolarHBondContact O-CB 3.48Å; D153-D157 PolarHBondContact O-N 2.04Å; D153-T185 HydrophobicContact CB-CG2 3.7Å; D153-T185 PolarHBondContact N-OG1 2.74Å; D153-K187 HydrophobicContact CB-CD 4.49Å; D153-K187 VanDerWaalsContact CB-CE 3.43Å; D153-K187 WeakPolarHBondContact OD2-CE 3.48Å; D153-K187 IonicContact OD2-NZ 3.55Å; D153-K187 PolarHBondContact OD2-NZ 3.22Å
154	L	96.3	Very high	96.6	Very high	34 Å²	34	50.2 Å²	50.2	18%	0.178	26%	0.256	C	S	.	.	H	α-helix	trans	-62	-32.9	171.9	-62.9	178.7	0	0	0	112.3	V119 D120 K151 M152 V159 I160	V119-L154 HydrophobicContact CG1-CB 4.47Å; D120-L154 HydrophobicContact CB-CD1 3.85Å; D120-L154 WeakPolarHBondContact OD2-CD1 3.49Å; K151-L154 HydrophobicContact CB-CD1 3.78Å; K151-L154 HydrophobicContact CB-CG 4Å; K151-L154 HydrophobicContact CD-CD1 3.67Å; K151-L154 HydrophobicContact CG-CD1 4.44Å; K151-L154 WeakPolarHBondContact O-CB 3.25Å; K151-L154 WeakPolarHBondContact O-CG 3.39Å; K151-L154 PolarHBondContact O-N 3.03Å; M152-L154 PolarHBondContact O-N 3.45Å; L154-V159 HydrophobicContact CB-CB 4.39Å; L154-V159 HydrophobicContact CD2-CB 4.06Å; L154-V159 HydrophobicContact CD2-CG1 4Å; L154-V159 HydrophobicContact CD2-CG2 4.31Å; L154-V159 WeakPolarHBondContact O-CA 3.34Å; L154-V159 WeakPolarHBondContact O-CB 3.41Å; L154-V159 PolarHBondContact O-N 3.45Å; L154-I160 HydrophobicContact CB-CD1 4.18Å; L154-I160 HydrophobicContact CB-CG1 4.11Å; L154-I160 HydrophobicContact CB-CG2 4.42Å; L154-I160 PolarHBondContact O-N 3.17Å
155	L	95.4	Very high	96.7	Very high	52 Å²	52	49.3 Å²	49.3	27%	0.272	25%	0.25	S	C	.	.	H	α-helix	trans	-81.4	-44.3	176.3	-172.6	72.5	0	0	0	110.8	M152 D153 G158 I160 R163	M152-L155 HydrophobicContact CE-CD2 4.14Å; M152-L155 WeakPolarHBondContact O-CB 3.47Å; M152-L155 PolarHBondContact O-N 2.85Å; D153-L155 PolarHBondContact O-N 3.14Å; L155-G158 PolarHBondContact O-N 2.75Å; L155-I160 HydrophobicContact CB-CG1 4.25Å; L155-I160 HydrophobicContact CD1-CG1 4.16Å; L155-R163 HydrophobicContact CD1-CG 4.39Å; L155-R163 HydrophobicContact CD2-CG 3.79Å
156	H	94.8	Very high	96.8	Very high	127 Å²	127	51.8 Å²	51.8	59%	0.588	27%	0.267	S	S	*	.	H	α-helix	trans	-67.4	-40.2	-178.6	-57.3	165.7	0	0	0	112.7	M152 D153 G158	M152-H156 PolarHBondContact O-N 3.43Å; D153-H156 PolarHBondContact O-N 3.5Å; H156-G158 PolarHBondContact O-N 3.48Å
157	D	95.6	Very high	96.7	Very high	103 Å²	103	55.6 Å²	55.6	55%	0.551	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.4	3.4	178.3	-57.1	-21.4	0	0	0	111.7	D153 V159 K187	D153-D157 WeakPolarHBondContact O-CA 3.27Å; D153-D157 WeakPolarHBondContact O-CB 3.48Å; D153-D157 PolarHBondContact O-N 2.04Å; D157-V159 VanDerWaalsContact C-N 3.28Å; D157-V159 HydrophobicContact CB-CG2 4.28Å; D157-V159 PolarHBondContact O-N 3.01Å; D157-K187 IonicContact OD2-NZ 3.48Å; D157-K187 PolarHBondContact OD2-NZ 3.12Å
158	G	95.7	Very high	96.7	Very high	36 Å²	36	61.3 Å²	61.3	37%	0.371	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.7	7.5	175.2	0	0	0	0	0	116.2	L155 H156 I160 Q161	L155-G158 PolarHBondContact O-N 2.75Å; H156-G158 PolarHBondContact O-N 3.48Å; G158-I160 VanDerWaalsContact C-N 3.28Å; G158-I160 PolarHBondContact O-N 3.43Å; G158-Q161 PolarHBondContact O-NE2 3.24Å
159	V	96.3	Very high	96.7	Very high	102 Å²	102	64.1 Å²	64.1	62%	0.618	33%	0.325	S	S	*	.	S	Bend	trans	-61.9	-36.7	178.6	-174.7	0	0	0	0	111.3	L154 D157	L154-V159 HydrophobicContact CB-CB 4.39Å; L154-V159 HydrophobicContact CD2-CB 4.06Å; L154-V159 HydrophobicContact CD2-CG1 4Å; L154-V159 HydrophobicContact CD2-CG2 4.31Å; L154-V159 WeakPolarHBondContact O-CA 3.34Å; L154-V159 WeakPolarHBondContact O-CB 3.41Å; L154-V159 PolarHBondContact O-N 3.45Å; D157-V159 VanDerWaalsContact C-N 3.28Å; D157-V159 HydrophobicContact CB-CG2 4.28Å; D157-V159 PolarHBondContact O-N 3.01Å
160	I	96.7	Very high	96.6	Very high	35 Å²	35	64.1 Å²	64.1	18%	0.179	33%	0.325	C	S	.	.	S	Bend	trans	-116.6	139.9	166.5	69.5	179.6	0	0	0	109.8	V119 D120 L154 L155 G158 R162	V119-I160 HydrophobicContact CG1-CD1 3.85Å; V119-I160 HydrophobicContact CG2-CD1 4.39Å; D120-I160 HydrophobicContact CB-CD1 4.14Å; D120-I160 HydrophobicContact CB-CG2 4.37Å; L154-I160 HydrophobicContact CB-CD1 4.18Å; L154-I160 HydrophobicContact CB-CG1 4.11Å; L154-I160 HydrophobicContact CB-CG2 4.42Å; L154-I160 PolarHBondContact O-N 3.17Å; L155-I160 HydrophobicContact CB-CG1 4.25Å; L155-I160 HydrophobicContact CD1-CG1 4.16Å; G158-I160 VanDerWaalsContact C-N 3.28Å; G158-I160 PolarHBondContact O-N 3.43Å; I160-R162 WeakPolarHBondContact CD1-O 3.5Å
161	Q	95.8	Very high	96.6	Very high	171 Å²	171	66.8 Å²	66.8	80%	0.799	34%	0.338	S	S	*	.	S	Bend	trans	-86	-14.7	-179.2	-62.3	-64.4	-55.4	0	0	113.2	G158	G158-Q161 PolarHBondContact O-NE2 3.24Å
162	R	95.7	Very high	96.6	Very high	210 Å²	210	71.5 Å²	71.5	79%	0.792	36%	0.361	S	S	*	.	S	Bend	trans	-153	150.9	179	64.7	-178.8	-177.5	179.9	1	110.5	I160	I160-R162 WeakPolarHBondContact CD1-O 3.5Å
163	R	97.4	Very high	96.7	Very high	36 Å²	36	72.3 Å²	72.3	14%	0.136	36%	0.364	C	S	.	.			trans	-65.1	145.2	169.1	-51.1	175.5	85.7	-109.4	14.5	109.3	V119 L155 V165 S166 E183	V119-R163 HydrophobicContact CG2-CB 3.8Å; V119-R163 HydrophobicContact CG2-CG 3.56Å; L155-R163 HydrophobicContact CD1-CG 4.39Å; L155-R163 HydrophobicContact CD2-CG 3.79Å; R163-V165 WeakPolarHBondContact CB-O 3.43Å; R163-V165 PolarHBondContact NH1-O 3.42Å; R163-V165 PolarHBondContact O-N 3.11Å; R163-S166 PolarHBondContact NH1-O 3.47Å; R163-E183 IonicContact CZ-OE1 3.95Å; R163-E183 IonicContact NE-OE1 3.51Å; R163-E183 PolarHBondContact NE-OE1 3.35Å; R163-E183 IonicContact NH2-OE1 3.35Å; R163-E183 PolarHBondContact NH2-OE1 2.69Å
164	A	97.5	Very high	96.8	Very high	38 Å²	38	71.1 Å²	71.1	31%	0.314	36%	0.358	S	S	.	.	S	Bend	trans	-72.2	-15.1	176.2	0	0	0	0	0	113.3	V119 R122	V119-A164 WeakPolarHBondContact O-CB 3.25Å; V119-A164 PolarHBondContact O-N 3.25Å; R122-A164 HydrophobicContact CB-CB 4.14Å
165	V	96.9	Very high	96.8	Very high	6 Å²	6	75.1 Å²	75.1	4%	0.036	38%	0.379	C	S	.	.	S	Bend	trans	-137.2	139.4	177.1	-174.5	0	0	0	0	106.9	R122 F125 R163 E169 V170	R122-V165 HydrophobicContact CB-CG2 4.13Å; R122-V165 HydrophobicContact CG-CG2 3.97Å; F125-V165 HydrophobicContact CB-CG2 3.85Å; F125-V165 HydrophobicContact CD1-CB 4.23Å; F125-V165 HydrophobicContact CD1-CG1 3.58Å; F125-V165 HydrophobicContact CD1-CG2 3.65Å; F125-V165 HydrophobicContact CE1-CG1 3.54Å; F125-V165 HydrophobicContact CE1-CG2 4.46Å; F125-V165 HydrophobicContact CG-CG1 4.33Å; F125-V165 HydrophobicContact CG-CG2 3.97Å; F125-V165 HydrophobicContact CZ-CG1 4.3Å; R163-V165 WeakPolarHBondContact CB-O 3.43Å; R163-V165 PolarHBondContact NH1-O 3.42Å; R163-V165 PolarHBondContact O-N 3.11Å; V165-E169 HydrophobicContact CG1-CB 3.93Å; V165-E169 HydrophobicContact CG1-CG 4.05Å; V165-E169 WeakPolarHBondContact CG1-OE2 3.46Å; V165-V170 HydrophobicContact CB-CG2 4.16Å; V165-V170 HydrophobicContact CG1-CG2 3.56Å
166	S	97	Very high	96.8	Very high	53 Å²	53	76.5 Å²	76.5	37%	0.371	39%	0.393	S	S	.	.			trans	-68	162.9	179.2	84.4	0	0	0	0	111.6	R163 E168 E169 V170	R163-S166 PolarHBondContact NH1-O 3.47Å; S166-E168 VanDerWaalsContact C-N 3.27Å; S166-E168 WeakPolarHBondContact CB-OE2 3.33Å; S166-E168 PolarHBondContact OG-N 3.48Å; S166-E168 PolarHBondContact OG-OE2 3.17Å; S166-E169 PolarHBondContact OG-N 3.46Å; S166-E169 VanDerWaalsContact OG-N 3.09Å; S166-V170 WeakPolarHBondContact O-CG2 3.46Å; S166-V170 PolarHBondContact O-N 2.89Å
167	Q	96.6	Very high	96.9	Very high	82 Å²	82	73.4 Å²	73.4	38%	0.383	38%	0.379	S	S	.	.	H	α-helix	trans	-68	-36.6	176.7	173.4	160.6	10.8	0	0	110.4	V170 I171 W181	Q167-V170 PolarHBondContact O-N 3.06Å; Q167-I171 HydrophobicContact CG-CD1 3.61Å; Q167-I171 HydrophobicContact CG-CG1 4.36Å; Q167-I171 VanDerWaalsContact O-CG1 3.27Å; Q167-I171 WeakPolarHBondContact O-CG1 3.33Å; Q167-I171 PolarHBondContact O-N 3.39Å; Q167-W181 HydrophobicContact CG-CH2 3.67Å; Q167-W181 HydrophobicContact CG-CZ3 4.15Å
168	E	97.4	Very high	96.8	Very high	123 Å²	123	74.1 Å²	74.1	58%	0.575	38%	0.383	S	S	*	.	H	α-helix	trans	-64.1	-47.4	180	-57	68.8	-148.4	0	0	111.4	S166 V170 I171 E172	S166-E168 VanDerWaalsContact C-N 3.27Å; S166-E168 WeakPolarHBondContact CB-OE2 3.33Å; S166-E168 PolarHBondContact OG-N 3.48Å; S166-E168 PolarHBondContact OG-OE2 3.17Å; E168-V170 VanDerWaalsContact C-N 3.29Å; E168-V170 PolarHBondContact O-N 3.07Å; E168-I171 PolarHBondContact O-N 2.8Å; E168-E172 WeakPolarHBondContact O-CB 3.32Å; E168-E172 PolarHBondContact O-N 3.23Å
169	E	98	Very high	96.7	Very high	59 Å²	59	72.9 Å²	72.9	28%	0.276	37%	0.369	S	S	.	.	H	α-helix	trans	-60.4	-38.8	177.8	-174	-173.5	161.5	0	0	111.1	R122 F125 K129 V165 S166 Y173	R122-E169 IonicContact NH2-OE1 2.69Å; R122-E169 PolarHBondContact NH2-OE1 3.41Å; R122-E169 IonicContact NH2-OE2 3.09Å; F125-E169 HydrophobicContact CE1-CG 4.04Å; F125-E169 WeakPolarHBondContact CE1-OE1 3.48Å; K129-E169 IonicContact NZ-OE1 3.17Å; K129-E169 PolarHBondContact NZ-OE1 3.22Å; V165-E169 HydrophobicContact CG1-CB 3.93Å; V165-E169 HydrophobicContact CG1-CG 4.05Å; V165-E169 WeakPolarHBondContact CG1-OE2 3.46Å; S166-E169 PolarHBondContact OG-N 3.46Å; S166-E169 VanDerWaalsContact OG-N 3.09Å; E169-Y173 VanDerWaalsContact O-CB 3.23Å; E169-Y173 WeakPolarHBondContact O-CB 3.4Å; E169-Y173 PolarHBondContact O-N 3.21Å
170	V	97.9	Very high	96.7	Very high	0 Å²	0	75.3 Å²	75.3	0%	0	37%	0.366	C	S	.	.	H	α-helix	trans	-72.5	-40.9	178.9	-175.2	0	0	0	0	111.7	F125 L147 V165 S166 Q167 E168 A174 W181	F125-V170 HydrophobicContact CD2-CG2 4.48Å; F125-V170 HydrophobicContact CE1-CG2 4.39Å; F125-V170 HydrophobicContact CE2-CB 4.45Å; F125-V170 HydrophobicContact CE2-CG1 4.19Å; F125-V170 HydrophobicContact CE2-CG2 3.99Å; F125-V170 HydrophobicContact CZ-CB 4.39Å; F125-V170 HydrophobicContact CZ-CG2 3.93Å; L147-V170 HydrophobicContact CD2-CG1 3.75Å; V165-V170 HydrophobicContact CB-CG2 4.16Å; V165-V170 HydrophobicContact CG1-CG2 3.56Å; S166-V170 WeakPolarHBondContact O-CG2 3.46Å; S166-V170 PolarHBondContact O-N 2.89Å; Q167-V170 PolarHBondContact O-N 3.06Å; E168-V170 VanDerWaalsContact C-N 3.29Å; E168-V170 PolarHBondContact O-N 3.07Å; V170-A174 VanDerWaalsContact O-CB 3.28Å; V170-A174 WeakPolarHBondContact O-CB 3.31Å; V170-A174 PolarHBondContact O-N 3.22Å; V170-W181 VanDerWaalsContact CG1-CD1 3.47Å; V170-W181 HydrophobicContact CG1-CD2 4.13Å; V170-W181 HydrophobicContact CG1-CG 3.99Å; V170-W181 HydrophobicContact CG1-CZ2 4.36Å; V170-W181 VanDerWaalsContact CG1-NE1 3.26Å
171	I	97.5	Very high	96.7	Very high	59 Å²	59	76.2 Å²	76.2	30%	0.303	37%	0.368	S	S	.	.	H	α-helix	trans	-64.2	-47.1	175.9	-70.9	167.2	0	0	0	111	Q167 E168 A174 N175 W181	Q167-I171 HydrophobicContact CG-CD1 3.61Å; Q167-I171 HydrophobicContact CG-CG1 4.36Å; Q167-I171 VanDerWaalsContact O-CG1 3.27Å; Q167-I171 WeakPolarHBondContact O-CG1 3.33Å; Q167-I171 PolarHBondContact O-N 3.39Å; E168-I171 PolarHBondContact O-N 2.8Å; I171-A174 PolarHBondContact O-N 2.91Å; I171-N175 WeakPolarHBondContact CG2-ND2 3.46Å; I171-N175 WeakPolarHBondContact O-CB 3.36Å; I171-N175 VanDerWaalsContact O-CG 3.29Å; I171-N175 PolarHBondContact O-N 2.82Å; I171-N175 PolarHBondContact O-ND2 2.87Å; I171-W181 HydrophobicContact CD1-CE3 4.22Å; I171-W181 HydrophobicContact CD1-CH2 4.44Å; I171-W181 HydrophobicContact CD1-CZ3 3.69Å; I171-W181 HydrophobicContact CG1-CD2 4.35Å; I171-W181 HydrophobicContact CG1-CE3 3.47Å; I171-W181 VanDerWaalsContact CG1-CE3 3.47Å; I171-W181 HydrophobicContact CG1-CH2 4.25Å; I171-W181 HydrophobicContact CG1-CZ3 3.42Å; I171-W181 VanDerWaalsContact CG1-CZ3 3.42Å
172	E	98	Very high	96.8	Very high	143 Å²	143	68.8 Å²	68.8	67%	0.668	33%	0.333	S	S	*	.	H	α-helix	trans	-61.4	-45.1	178.6	-176.2	176.9	-171.4	0	0	111	E168 S176	E168-E172 WeakPolarHBondContact O-CB 3.32Å; E168-E172 PolarHBondContact O-N 3.23Å; E172-S176 WeakPolarHBondContact O-CB 3.5Å; E172-S176 PolarHBondContact O-N 3.03Å; E172-S176 PolarHBondContact O-OG 3.03Å
173	Y	98.4	Very high	96.9	Very high	23 Å²	23	61.8 Å²	61.8	9%	0.09	31%	0.309	C	S	.	.	H	α-helix	trans	-60.8	-46.3	174.5	-178.3	-95.9	0	0	0	112.3	F125 K129 R132 L147 E169 S176 H177	F125-Y173 HydrophobicContact CE2-CD1 4.16Å; F125-Y173 HydrophobicContact CE2-CG 4.47Å; F125-Y173 HydrophobicContact CZ-CD1 4.23Å; F125-Y173 HydrophobicContact CZ-CG 4.08Å; K129-Y173 WeakPolarHBondContact CA-OH 3.32Å; K129-Y173 HydrophobicContact CB-CE1 4.5Å; K129-Y173 HydrophobicContact CB-CE2 3.86Å; K129-Y173 HydrophobicContact CD-CD2 3.74Å; K129-Y173 HydrophobicContact CD-CE2 3.68Å; K129-Y173 HydrophobicContact CD-CG 4.39Å; K129-Y173 HydrophobicContact CG-CD1 4.32Å; K129-Y173 HydrophobicContact CG-CD2 3.89Å; K129-Y173 HydrophobicContact CG-CE1 3.98Å; K129-Y173 HydrophobicContact CG-CE2 3.5Å; K129-Y173 VanDerWaalsContact CG-CE2 3.5Å; K129-Y173 HydrophobicContact CG-CG 4.31Å; R132-Y173 WeakPolarHBondContact CB-OH 3.41Å; R132-Y173 WeakPolarHBondContact CG-OH 3.42Å; L147-Y173 HydrophobicContact CD2-CD1 3.96Å; L147-Y173 HydrophobicContact CD2-CE1 4.49Å; E169-Y173 VanDerWaalsContact O-CB 3.23Å; E169-Y173 WeakPolarHBondContact O-CB 3.4Å; E169-Y173 PolarHBondContact O-N 3.21Å; Y173-S176 WeakPolarHBondContact CA-OG 3.35Å; Y173-S176 PolarHBondContact O-N 2.77Å; Y173-S176 PolarHBondContact O-OG 3.1Å; Y173-H177 AromaticContact CD2-CE1 3.59Å; Y173-H177 AromaticContact CD2-ND1 3.59Å; Y173-H177 HydrophobicContact CE1-CB 4.5Å; Y173-H177 AromaticContact CE2-CD2 3.82Å; Y173-H177 AromaticContact CE2-CE1 3.16Å; Y173-H177 WeakPolarHBondContact CE2-CE1 3.48Å; Y173-H177 AromaticContact CE2-CG 3.74Å; Y173-H177 AromaticContact CE2-ND1 3.31Å; Y173-H177 VanDerWaalsContact CE2-ND1 3.31Å; Y173-H177 WeakPolarHBondContact CE2-ND1 3.31Å; Y173-H177 AromaticContact CE2-NE2 3.46Å; Y173-H177 WeakPolarHBondContact CE2-NE2 3.45Å; Y173-H177 AromaticContact CZ-CD2 3.78Å; Y173-H177 AromaticContact CZ-CE1 3.88Å; Y173-H177 AromaticContact CZ-CG 3.64Å; Y173-H177 AromaticContact CZ-ND1 3.69Å; Y173-H177 AromaticContact CZ-NE2 3.91Å; Y173-H177 WeakPolarHBondContact O-CB 3.19Å; Y173-H177 PolarHBondContact O-N 3.4Å; Y173-H177 VanDerWaalsContact O-N 3.16Å; Y173-H177 PolarHBondContact O-ND1 3.32Å; Y173-H177 PolarHBondContact OH-CD2 2.87Å
174	A	97.6	Very high	96.9	Very high	1 Å²	1	60 Å²	60	1%	0.008	30%	0.303	C	S	.	.	H	α-helix	trans	-63	-46.8	-179.5	0	0	0	0	0	112.2	L147 V170 I171 H177 N178 C179 W181	L147-A174 HydrophobicContact CD2-CB 4.14Å; V170-A174 VanDerWaalsContact O-CB 3.28Å; V170-A174 WeakPolarHBondContact O-CB 3.31Å; V170-A174 PolarHBondContact O-N 3.22Å; I171-A174 PolarHBondContact O-N 2.91Å; A174-H177 PolarHBondContact O-N 2.92Å; A174-N178 PolarHBondContact O-N 3.32Å; A174-C179 HydrophobicContact CB-CB 4.2Å; A174-C179 PolarHBondContact O-N 3.1Å; A174-W181 HydrophobicContact CB-CB 3.74Å
175	N	96.4	Very high	96.9	Very high	119 Å²	119	58.4 Å²	58.4	64%	0.636	29%	0.289	S	S	*	.	H	α-helix	trans	-62.8	-45	178.5	-72.5	-26.7	0	0	0	111.8	I171 H177 N178	I171-N175 WeakPolarHBondContact CG2-ND2 3.46Å; I171-N175 WeakPolarHBondContact O-CB 3.36Å; I171-N175 VanDerWaalsContact O-CG 3.29Å; I171-N175 PolarHBondContact O-N 2.82Å; I171-N175 PolarHBondContact O-ND2 2.87Å; N175-H177 VanDerWaalsContact C-N 3.25Å; N175-H177 PolarHBondContact O-N 3.07Å; N175-N178 PolarHBondContact O-N 3.05Å
176	S	96.8	Very high	96.8	Very high	81 Å²	81	58.3 Å²	58.3	57%	0.566	29%	0.289	S	S	*	.	H	α-helix	trans	-66.1	-24.1	179.7	52.7	0	0	0	0	113.9	E172 Y173	E172-S176 WeakPolarHBondContact O-CB 3.5Å; E172-S176 PolarHBondContact O-N 3.03Å; E172-S176 PolarHBondContact O-OG 3.03Å; Y173-S176 WeakPolarHBondContact CA-OG 3.35Å; Y173-S176 PolarHBondContact O-N 2.77Å; Y173-S176 PolarHBondContact O-OG 3.1Å
177	H	95.7	Very high	96.6	Very high	61 Å²	61	59.6 Å²	59.6	28%	0.282	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.5	13.8	-178.7	-64.4	70.2	0	0	0	113.9	R132 Y173 A174 N175 C179	R132-H177 HydrophobicContact CG-CB 4.1Å; R132-H177 PolarHBondContact NE-O 3.34Å; R132-H177 VanDerWaalsContact NE-O 3.1Å; R132-H177 PolarHBondContact NH2-O 3.27Å; Y173-H177 AromaticContact CD2-CE1 3.59Å; Y173-H177 AromaticContact CD2-ND1 3.59Å; Y173-H177 HydrophobicContact CE1-CB 4.5Å; Y173-H177 AromaticContact CE2-CD2 3.82Å; Y173-H177 AromaticContact CE2-CE1 3.16Å; Y173-H177 WeakPolarHBondContact CE2-CE1 3.48Å; Y173-H177 AromaticContact CE2-CG 3.74Å; Y173-H177 AromaticContact CE2-ND1 3.31Å; Y173-H177 VanDerWaalsContact CE2-ND1 3.31Å; Y173-H177 WeakPolarHBondContact CE2-ND1 3.31Å; Y173-H177 AromaticContact CE2-NE2 3.46Å; Y173-H177 WeakPolarHBondContact CE2-NE2 3.45Å; Y173-H177 AromaticContact CZ-CD2 3.78Å; Y173-H177 AromaticContact CZ-CE1 3.88Å; Y173-H177 AromaticContact CZ-CG 3.64Å; Y173-H177 AromaticContact CZ-ND1 3.69Å; Y173-H177 AromaticContact CZ-NE2 3.91Å; Y173-H177 WeakPolarHBondContact O-CB 3.19Å; Y173-H177 PolarHBondContact O-N 3.4Å; Y173-H177 VanDerWaalsContact O-N 3.16Å; Y173-H177 PolarHBondContact O-ND1 3.32Å; Y173-H177 PolarHBondContact OH-CD2 2.87Å; A174-H177 PolarHBondContact O-N 2.92Å; N175-H177 VanDerWaalsContact C-N 3.25Å; N175-H177 PolarHBondContact O-N 3.07Å; H177-C179 VanDerWaalsContact C-N 3.26Å; H177-C179 PolarHBondContact O-N 3.32Å
178	N	93	Very high	96.5	Very high	118 Å²	118	59.8 Å²	59.8	63%	0.631	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.3	40.7	-177.6	-166.9	31.6	0	0	0	113.4	A174 N175	A174-N178 PolarHBondContact O-N 3.32Å; N175-N178 PolarHBondContact O-N 3.05Å
179	C	94.7	Very high	96.3	Very high	11 Å²	11	57.2 Å²	57.2	7%	0.074	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	141.2	174.9	-60.6	0	0	0	0	110.1	R132 V145 L147 A174 H177	R132-C179 WeakPolarHBondContact CD-SG 3.34Å; R132-C179 PolarHBondContact NE-SG 3.44Å; V145-C179 WeakPolarHBondContact O-CA 3.48Å; L147-C179 HydrophobicContact CB-CB 4.23Å; A174-C179 HydrophobicContact CB-CB 4.2Å; A174-C179 PolarHBondContact O-N 3.1Å; H177-C179 VanDerWaalsContact C-N 3.26Å; H177-C179 PolarHBondContact O-N 3.32Å
180	R	95.2	Very high	96.1	Very high	152 Å²	152	58.3 Å²	58.3	57%	0.574	29%	0.29	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.6	139.6	158.7	-71.4	-67.6	-179.8	167.1	-2.9	108.4	V145 I146 L147 T198	V145-R180 PolarHBondContact O-N 3.37Å; I146-R180 CarbonylContact C-O 3.35Å; I146-R180 WeakPolarHBondContact CA-O 3.36Å; I146-R180 HydrophobicContact CG1-CB 4.35Å; L147-R180 PolarHBondContact N-O 2.89Å; R180-T198 HydrophobicContact CB-CG2 4.12Å; R180-T198 HydrophobicContact CG-CG2 4.04Å
181	W	97.4	Very high	96	Very high	55 Å²	55	59.3 Å²	59.3	21%	0.208	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	135.7	176.4	172.5	59.2	0	0	0	110.9	L147 T149 Q167 V170 I171 A174 E183	L147-W181 WeakPolarHBondContact O-CA 3.37Å; T149-W181 PolarHBondContact OG1-NE1 3.39Å; Q167-W181 HydrophobicContact CG-CH2 3.67Å; Q167-W181 HydrophobicContact CG-CZ3 4.15Å; V170-W181 VanDerWaalsContact CG1-CD1 3.47Å; V170-W181 HydrophobicContact CG1-CD2 4.13Å; V170-W181 HydrophobicContact CG1-CG 3.99Å; V170-W181 HydrophobicContact CG1-CZ2 4.36Å; V170-W181 VanDerWaalsContact CG1-NE1 3.26Å; I171-W181 HydrophobicContact CD1-CE3 4.22Å; I171-W181 HydrophobicContact CD1-CH2 4.44Å; I171-W181 HydrophobicContact CD1-CZ3 3.69Å; I171-W181 HydrophobicContact CG1-CD2 4.35Å; I171-W181 HydrophobicContact CG1-CE3 3.47Å; I171-W181 VanDerWaalsContact CG1-CE3 3.47Å; I171-W181 HydrophobicContact CG1-CH2 4.25Å; I171-W181 HydrophobicContact CG1-CZ3 3.42Å; I171-W181 VanDerWaalsContact CG1-CZ3 3.42Å; A174-W181 HydrophobicContact CB-CB 3.74Å; W181-E183 HydrophobicContact CH2-CG 3.61Å; W181-E183 HydrophobicContact CZ2-CG 3.18Å; W181-E183 WeakPolarHBondContact CZ2-OE1 3.48Å
182	I	97.5	Very high	95.9	Very high	14 Å²	14	56.5 Å²	56.5	7%	0.072	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	134.3	179.9	-54.3	177.2	0	0	0	109.4	I146 L147 V148 T149 V184 T198	I146-I182 HydrophobicContact CD1-CD1 4.5Å; I146-I182 HydrophobicContact CG2-CD1 3.82Å; I146-I182 HydrophobicContact CG2-CG1 4.03Å; L147-I182 PolarHBondContact O-N 3.27Å; V148-I182 WeakPolarHBondContact CA-O 3.14Å; T149-I182 PolarHBondContact N-O 3.1Å; I182-V184 HydrophobicContact CG2-CG2 3.83Å; I182-T198 HydrophobicContact CD1-CG2 4.22Å
183	E	97.8	Very high	95.8	Very high	63 Å²	63	51.9 Å²	51.9	29%	0.294	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	133.1	170.8	-69.1	-162.2	127.1	0	0	110.7	M152 R163 W181	M152-E183 HydrophobicContact CE-CB 4.44Å; M152-E183 VanDerWaalsContact CE-CD 3.47Å; M152-E183 HydrophobicContact CE-CG 4.39Å; M152-E183 WeakPolarHBondContact CE-OE1 3.3Å; M152-E183 HydrophobicContact CG-CB 3.92Å; M152-E183 HydrophobicContact SD-CB 4.21Å; M152-E183 HydrophobicContact SD-CG 4.22Å; R163-E183 IonicContact CZ-OE1 3.95Å; R163-E183 IonicContact NE-OE1 3.51Å; R163-E183 PolarHBondContact NE-OE1 3.35Å; R163-E183 IonicContact NH2-OE1 3.35Å; R163-E183 PolarHBondContact NH2-OE1 2.69Å; W181-E183 HydrophobicContact CH2-CG 3.61Å; W181-E183 HydrophobicContact CZ2-CG 3.18Å; W181-E183 WeakPolarHBondContact CZ2-OE1 3.48Å
184	V	97.8	Very high	95.6	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	28%	0.275	C	S	.	.			trans	-136.7	141.7	-169.4	176.9	0	0	0	0	113.7	V148 T149 N150 K151 M152 I182 S191 V192 I195	V148-V184 HydrophobicContact CG1-CB 3.77Å; V148-V184 HydrophobicContact CG1-CG2 3.64Å; T149-V184 PolarHBondContact O-N 2.94Å; N150-V184 CarbonylContact C-O 3.56Å; N150-V184 VanDerWaalsContact CA-O 3.27Å; N150-V184 WeakPolarHBondContact CA-O 3.27Å; N150-V184 PolarHBondContact OD1-O 3.49Å; K151-V184 PolarHBondContact N-O 3.19Å; M152-V184 WeakPolarHBondContact CG-O 3.48Å; M152-V184 PolarHBondContact N-O 2.74Å; M152-V184 VanDerWaalsContact N-O 3.12Å; I182-V184 HydrophobicContact CG2-CG2 3.83Å; V184-S191 VanDerWaalsContact CA-OG 3.27Å; V184-S191 WeakPolarHBondContact CA-OG 3.39Å; V184-V192 HydrophobicContact CG1-CG2 3.95Å; V184-I195 HydrophobicContact CG1-CD1 4.35Å; V184-I195 HydrophobicContact CG2-CD1 3.94Å; V184-I195 HydrophobicContact CG2-CG1 3.84Å
185	T	96.9	Very high	95.4	Very high	3 Å²	3	54.1 Å²	54.1	2%	0.018	27%	0.274	C	S	.	.			trans	-112.8	104.7	165.4	-71.1	0	0	0	0	107.9	D153 K187 E188 S191	D153-T185 HydrophobicContact CB-CG2 3.7Å; D153-T185 PolarHBondContact N-OG1 2.74Å; T185-K187 HydrophobicContact CG2-CB 4.46Å; T185-K187 HydrophobicContact CG2-CD 4.15Å; T185-K187 HydrophobicContact CG2-CG 3.32Å; T185-K187 PolarHBondContact O-N 3.09Å; T185-E188 HydrophobicContact CG2-CB 4.22Å; T185-E188 HydrophobicContact CG2-CG 3.78Å; T185-E188 VanDerWaalsContact CG2-OE1 3.31Å; T185-E188 WeakPolarHBondContact CG2-OE1 3.34Å; T185-E188 WeakPolarHBondContact O-CB 3.47Å; T185-E188 PolarHBondContact O-N 3.01Å; T185-S191 PolarHBondContact N-OG 3.47Å; T185-S191 VanDerWaalsContact N-OG 3.07Å
186	A	95	Very high	95.2	Very high	5 Å²	5	48.4 Å²	48.4	4%	0.041	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-17	-173.7	0	0	0	0	0	115.1	A50 I51 Q54 F60 N150 E188	A50-A186 HydrophobicContact CB-CB 3.9Å; I51-A186 HydrophobicContact CG1-CB 4.02Å; Q54-A186 WeakPolarHBondContact CG-O 3.21Å; F60-A186 HydrophobicContact CD2-CB 4.37Å; F60-A186 WeakPolarHBondContact CD2-O 3.26Å; F60-A186 HydrophobicContact CE2-CB 4.1Å; N150-A186 WeakPolarHBondContact OD1-CB 3Å; N150-A186 PolarHBondContact OD1-N 2.9Å; A186-E188 VanDerWaalsContact C-N 3.29Å
187	K	92.6	Very high	94.9	Very high	80 Å²	80	45.8 Å²	45.8	35%	0.348	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-13.1	171.2	62.7	-178.3	-173.3	-154.1	0	113.6	Q54 F60 D153 D157 T185	Q54-K187 PolarHBondContact NE2-O 2.78Å; F60-K187 HydrophobicContact CB-CB 4.44Å; F60-K187 HydrophobicContact CD1-CB 3.88Å; F60-K187 HydrophobicContact CD2-CB 3.97Å; F60-K187 HydrophobicContact CE1-CB 4.05Å; F60-K187 HydrophobicContact CE2-CB 4.14Å; F60-K187 HydrophobicContact CG-CB 3.83Å; F60-K187 HydrophobicContact CZ-CB 4.18Å; D153-K187 HydrophobicContact CB-CD 4.49Å; D153-K187 VanDerWaalsContact CB-CE 3.43Å; D153-K187 WeakPolarHBondContact OD2-CE 3.48Å; D153-K187 IonicContact OD2-NZ 3.55Å; D153-K187 PolarHBondContact OD2-NZ 3.22Å; D157-K187 IonicContact OD2-NZ 3.48Å; D157-K187 PolarHBondContact OD2-NZ 3.12Å; T185-K187 HydrophobicContact CG2-CB 4.46Å; T185-K187 HydrophobicContact CG2-CD 4.15Å; T185-K187 HydrophobicContact CG2-CG 3.32Å; T185-K187 PolarHBondContact O-N 3.09Å
188	E	94.4	Very high	94.7	Very high	85 Å²	85	44.3 Å²	44.3	40%	0.397	22%	0.218	S	C	.	.			trans	-105	117.9	-179.4	-70.5	168.6	-147.4	0	0	111	T185 A186 S190 S191 V192	T185-E188 HydrophobicContact CG2-CB 4.22Å; T185-E188 HydrophobicContact CG2-CG 3.78Å; T185-E188 VanDerWaalsContact CG2-OE1 3.31Å; T185-E188 WeakPolarHBondContact CG2-OE1 3.34Å; T185-E188 WeakPolarHBondContact O-CB 3.47Å; T185-E188 PolarHBondContact O-N 3.01Å; A186-E188 VanDerWaalsContact C-N 3.29Å; E188-S190 PolarHBondContact O-N 2.8Å; E188-S191 PolarHBondContact O-N 2.97Å; E188-V192 PolarHBondContact O-N 2.74Å
189	F	94.5	Very high	94.5	Very high	69 Å²	69	38.7 Å²	38.7	30%	0.303	19%	0.188	S	C	.	.	H	α-helix	trans	-63.3	-44	-176.7	-179.3	-92.4	0	0	0	112.8	Q54 N58 S191 V192 E193	Q54-F189 HydrophobicContact CG-CB 4.45Å; Q54-F189 HydrophobicContact CG-CD2 4.29Å; Q54-F189 VanDerWaalsContact NE2-N 3.17Å; Q54-F189 VanDerWaalsContact O-CD2 3.31Å; Q54-F189 WeakPolarHBondContact O-CD2 3.4Å; Q54-F189 WeakPolarHBondContact O-CE2 3.43Å; N58-F189 HydrophobicContact CB-CD2 4.1Å; N58-F189 HydrophobicContact CB-CE2 4.42Å; N58-F189 WeakPolarHBondContact OD1-CB 3.42Å; N58-F189 WeakPolarHBondContact OD1-CD2 3.43Å; F189-S191 VanDerWaalsContact C-N 3.28Å; F189-S191 PolarHBondContact O-N 2.74Å; F189-V192 PolarHBondContact O-N 2.91Å; F189-E193 HydrophobicContact CD1-CB 4.38Å; F189-E193 HydrophobicContact CE1-CB 4.01Å; F189-E193 HydrophobicContact CE1-CG 3.99Å; F189-E193 HydrophobicContact CZ-CB 4.45Å; F189-E193 HydrophobicContact CZ-CG 4.26Å; F189-E193 WeakPolarHBondContact O-CB 3.48Å; F189-E193 PolarHBondContact O-N 2.84Å
190	S	94.4	Very high	94.1	Very high	82 Å²	82	38.2 Å²	38.2	57%	0.573	19%	0.185	S	C	*	.	H	α-helix	trans	-58.3	-39.4	178.9	46.5	0	0	0	0	112.9	E188 E193 N194	E188-S190 PolarHBondContact O-N 2.8Å; S190-E193 PolarHBondContact O-N 2.99Å; S190-N194 PolarHBondContact O-N 2.68Å; S190-N194 VanDerWaalsContact O-N 3.17Å
191	S	95	Very high	93.6	Very high	21 Å²	21	33.6 Å²	33.6	15%	0.147	18%	0.179	C	C	.	.	H	α-helix	trans	-65.2	-45.3	177.6	-171.2	0	0	0	0	111.4	V184 T185 E188 F189 N194	V184-S191 VanDerWaalsContact CA-OG 3.27Å; V184-S191 WeakPolarHBondContact CA-OG 3.39Å; T185-S191 PolarHBondContact N-OG 3.47Å; T185-S191 VanDerWaalsContact N-OG 3.07Å; E188-S191 PolarHBondContact O-N 2.97Å; F189-S191 VanDerWaalsContact C-N 3.28Å; F189-S191 PolarHBondContact O-N 2.74Å; S191-N194 WeakPolarHBondContact O-CB 3.34Å
192	V	96.1	Very high	92.9	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-66.3	-42.8	174.3	168.8	0	0	0	0	111.9	I51 Q54 F55 V184 E188 F189 N194 I195 F196	I51-V192 HydrophobicContact CG1-CG2 4.42Å; I51-V192 HydrophobicContact CG2-CG1 4.13Å; I51-V192 WeakPolarHBondContact O-CG1 3.41Å; Q54-V192 HydrophobicContact CB-CB 4.43Å; Q54-V192 HydrophobicContact CB-CG1 4.24Å; Q54-V192 HydrophobicContact CB-CG2 4.11Å; Q54-V192 HydrophobicContact CG-CB 4.11Å; Q54-V192 HydrophobicContact CG-CG1 4.36Å; Q54-V192 HydrophobicContact CG-CG2 3.92Å; F55-V192 HydrophobicContact CB-CG1 3.84Å; V184-V192 HydrophobicContact CG1-CG2 3.95Å; E188-V192 PolarHBondContact O-N 2.74Å; F189-V192 PolarHBondContact O-N 2.91Å; V192-N194 PolarHBondContact O-N 3.4Å; V192-I195 VanDerWaalsContact O-CB 3.32Å; V192-I195 WeakPolarHBondContact O-CB 3.46Å; V192-I195 WeakPolarHBondContact O-CG1 3.45Å; V192-I195 PolarHBondContact O-N 3.34Å; V192-I195 VanDerWaalsContact O-N 3.1Å; V192-F196 HydrophobicContact CG1-CD2 4.26Å; V192-F196 HydrophobicContact CG1-CE2 3.91Å; V192-F196 WeakPolarHBondContact O-CD2 3.31Å
193	E	94	Very high	91.7	Very high	46 Å²	46	37.5 Å²	37.5	22%	0.215	20%	0.198	C	C	.	.	H	α-helix	trans	-59.7	-34.9	-179.5	-156.3	-161.6	159.6	0	0	112	F189 S190 I195 F196 Q197 Y210	F189-E193 HydrophobicContact CD1-CB 4.38Å; F189-E193 HydrophobicContact CE1-CB 4.01Å; F189-E193 HydrophobicContact CE1-CG 3.99Å; F189-E193 HydrophobicContact CZ-CB 4.45Å; F189-E193 HydrophobicContact CZ-CG 4.26Å; F189-E193 WeakPolarHBondContact O-CB 3.48Å; F189-E193 PolarHBondContact O-N 2.84Å; S190-E193 PolarHBondContact O-N 2.99Å; E193-I195 VanDerWaalsContact C-N 3.25Å; E193-I195 PolarHBondContact O-N 2.79Å; E193-F196 PolarHBondContact O-N 2.74Å; E193-F196 VanDerWaalsContact O-N 3.07Å; E193-Q197 HydrophobicContact CG-CG 4.37Å; E193-Q197 WeakPolarHBondContact O-CB 3.28Å; E193-Q197 WeakPolarHBondContact O-CG 3.4Å; E193-Q197 PolarHBondContact O-N 3.34Å; E193-Q197 PolarHBondContact OE1-NE2 3.24Å; E193-Y210 WeakPolarHBondContact CG-OH 3.21Å; E193-Y210 VanDerWaalsContact OE1-CE1 3.32Å; E193-Y210 WeakPolarHBondContact OE1-CE1 3.22Å; E193-Y210 PolarHBondContact OE1-OH 2.86Å
194	N	94.1	Very high	90.3	Very high	71 Å²	71	36.9 Å²	36.9	38%	0.38	20%	0.196	S	C	.	.	H	α-helix	trans	-58.9	-33.3	176.9	-170	29.9	0	0	0	113.3	S190 S191 V192 T198	S190-N194 PolarHBondContact O-N 2.68Å; S190-N194 VanDerWaalsContact O-N 3.17Å; S191-N194 WeakPolarHBondContact O-CB 3.34Å; V192-N194 PolarHBondContact O-N 3.4Å; N194-T198 WeakPolarHBondContact O-CB 3.46Å; N194-T198 PolarHBondContact O-N 3.17Å; N194-T198 PolarHBondContact O-OG1 3.02Å
195	I	94.9	Very high	89	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-58.1	-53.9	172.5	-52.6	167.6	0	0	0	109.4	I51 V114 I146 V148 V184 V192 E193 T198 L199	I51-I195 HydrophobicContact CD1-CD1 4.41Å; I51-I195 HydrophobicContact CG2-CD1 3.66Å; V114-I195 HydrophobicContact CG1-CG2 3.88Å; V114-I195 HydrophobicContact CG2-CG2 3.79Å; I146-I195 HydrophobicContact CD1-CG2 4.12Å; I146-I195 WeakPolarHBondContact CD1-O 3.16Å; I146-I195 HydrophobicContact CG2-CG2 4.35Å; V148-I195 HydrophobicContact CG1-CD1 4.27Å; V148-I195 HydrophobicContact CG2-CD1 4.05Å; V148-I195 HydrophobicContact CG2-CG1 4.07Å; V148-I195 HydrophobicContact CG2-CG2 4.19Å; V184-I195 HydrophobicContact CG1-CD1 4.35Å; V184-I195 HydrophobicContact CG2-CD1 3.94Å; V184-I195 HydrophobicContact CG2-CG1 3.84Å; V192-I195 VanDerWaalsContact O-CB 3.32Å; V192-I195 WeakPolarHBondContact O-CB 3.46Å; V192-I195 WeakPolarHBondContact O-CG1 3.45Å; V192-I195 PolarHBondContact O-N 3.34Å; V192-I195 VanDerWaalsContact O-N 3.1Å; E193-I195 VanDerWaalsContact C-N 3.25Å; E193-I195 PolarHBondContact O-N 2.79Å; I195-T198 PolarHBondContact O-N 3.25Å; I195-L199 PolarHBondContact O-N 3Å
196	F	91.4	Very high	87.9	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-72	-40.5	-173.1	-65.2	-80	0	0	0	111.3	I51 F55 F88 L90 V192 E193 T198 L199 F200	I51-F196 HydrophobicContact CG2-CE2 4.13Å; I51-F196 HydrophobicContact CG2-CZ 4.37Å; F55-F196 HydrophobicContact CB-CD2 3.9Å; F55-F196 HydrophobicContact CB-CE2 3.48Å; F55-F196 VanDerWaalsContact CB-CE2 3.48Å; F55-F196 HydrophobicContact CB-CZ 4.01Å; F55-F196 AromaticContact CD1-CD1 3.98Å; F55-F196 HydrophobicContact CD1-CD1 3.98Å; F55-F196 AromaticContact CD1-CD2 4Å; F55-F196 HydrophobicContact CD1-CD2 4Å; F55-F196 AromaticContact CD1-CE1 3.89Å; F55-F196 HydrophobicContact CD1-CE1 3.89Å; F55-F196 AromaticContact CD1-CE2 3.91Å; F55-F196 HydrophobicContact CD1-CE2 3.91Å; F55-F196 HydrophobicContact CD1-CG 4.04Å; F55-F196 AromaticContact CD1-CZ 3.85Å; F55-F196 HydrophobicContact CD1-CZ 3.85Å; F55-F196 HydrophobicContact CD2-CB 4Å; F55-F196 HydrophobicContact CD2-CD1 4.36Å; F55-F196 AromaticContact CD2-CD2 3.25Å; F55-F196 HydrophobicContact CD2-CD2 3.25Å; F55-F196 AromaticContact CD2-CE2 3.79Å; F55-F196 HydrophobicContact CD2-CE2 3.79Å; F55-F196 AromaticContact CD2-CG 3.6Å; F55-F196 HydrophobicContact CD2-CG 3.6Å; F55-F196 AromaticContact CE1-CD1 3.8Å; F55-F196 HydrophobicContact CE1-CD1 3.8Å; F55-F196 HydrophobicContact CE1-CD2 4.36Å; F55-F196 HydrophobicContact CE1-CE1 4.08Å; F55-F196 AromaticContact CE1-CG 3.95Å; F55-F196 HydrophobicContact CE1-CG 3.95Å; F55-F196 HydrophobicContact CE1-CZ 4.48Å; F55-F196 HydrophobicContact CE2-CB 3.48Å; F55-F196 VanDerWaalsContact CE2-CB 3.48Å; F55-F196 HydrophobicContact CE2-CD1 4.2Å; F55-F196 AromaticContact CE2-CD2 3.69Å; F55-F196 HydrophobicContact CE2-CD2 3.69Å; F55-F196 AromaticContact CE2-CG 3.5Å; F55-F196 HydrophobicContact CE2-CG 3.5Å; F55-F196 HydrophobicContact CG-CD1 4.26Å; F55-F196 AromaticContact CG-CD2 3.43Å; F55-F196 HydrophobicContact CG-CD2 3.43Å; F55-F196 VanDerWaalsContact CG-CD2 3.43Å; F55-F196 HydrophobicContact CG-CE1 4.26Å; F55-F196 AromaticContact CG-CE2 3.44Å; F55-F196 HydrophobicContact CG-CE2 3.44Å; F55-F196 VanDerWaalsContact CG-CE2 3.44Å; F55-F196 AromaticContact CG-CG 3.87Å; F55-F196 HydrophobicContact CG-CG 3.87Å; F55-F196 AromaticContact CG-CZ 3.87Å; F55-F196 HydrophobicContact CG-CZ 3.87Å; F55-F196 HydrophobicContact CZ-CB 3.77Å; F55-F196 AromaticContact CZ-CD1 3.91Å; F55-F196 HydrophobicContact CZ-CD1 3.91Å; F55-F196 HydrophobicContact CZ-CD2 4.22Å; F55-F196 AromaticContact CZ-CG 3.68Å; F55-F196 HydrophobicContact CZ-CG 3.68Å; F88-F196 AromaticContact CE1-CD1 3.88Å; F88-F196 HydrophobicContact CE1-CD1 3.88Å; F88-F196 AromaticContact CE1-CE1 3.84Å; F88-F196 HydrophobicContact CE1-CE1 3.84Å; F88-F196 AromaticContact CZ-CD1 3.52Å; F88-F196 HydrophobicContact CZ-CD1 3.52Å; F88-F196 AromaticContact CZ-CE1 3.73Å; F88-F196 HydrophobicContact CZ-CE1 3.73Å; L90-F196 HydrophobicContact CD1-CE1 3.96Å; L90-F196 HydrophobicContact CD1-CZ 4.32Å; L90-F196 HydrophobicContact CD2-CE1 4.37Å; L90-F196 HydrophobicContact CD2-CZ 4.21Å; V192-F196 HydrophobicContact CG1-CD2 4.26Å; V192-F196 HydrophobicContact CG1-CE2 3.91Å; V192-F196 WeakPolarHBondContact O-CD2 3.31Å; E193-F196 PolarHBondContact O-N 2.74Å; E193-F196 VanDerWaalsContact O-N 3.07Å; F196-T198 VanDerWaalsContact C-N 3.29Å; F196-T198 PolarHBondContact O-N 3.15Å; F196-L199 WeakPolarHBondContact O-CB 3.35Å; F196-L199 PolarHBondContact O-N 3.03Å; F196-L199 VanDerWaalsContact O-N 3.11Å; F196-F200 HydrophobicContact CB-CD2 4.4Å; F196-F200 HydrophobicContact CB-CE2 4.23Å; F196-F200 WeakPolarHBondContact O-CD2 3.13Å; F196-F200 PolarHBondContact O-N 2.92Å
197	Q	90.3	Very high	86.7	Confident	26 Å²	26	44.2 Å²	44.2	12%	0.121	23%	0.231	C	C	.	.	H	α-helix	trans	-52.1	-47.2	170.2	-77.3	-178.8	16.2	0	0	111.8	E193 A201 Y210	E193-Q197 HydrophobicContact CG-CG 4.37Å; E193-Q197 WeakPolarHBondContact O-CB 3.28Å; E193-Q197 WeakPolarHBondContact O-CG 3.4Å; E193-Q197 PolarHBondContact O-N 3.34Å; E193-Q197 PolarHBondContact OE1-NE2 3.24Å; Q197-A201 VanDerWaalsContact O-CB 3.27Å; Q197-A201 WeakPolarHBondContact O-CB 3.49Å; Q197-A201 PolarHBondContact O-N 2.99Å; Q197-Y210 HydrophobicContact CG-CD1 3.66Å; Q197-Y210 HydrophobicContact CG-CE1 3.28Å; Q197-Y210 HydrophobicContact CG-CE2 4.34Å; Q197-Y210 HydrophobicContact CG-CG 4.35Å
198	T	91.3	Very high	85.7	Confident	29 Å²	29	47 Å²	47	18%	0.178	25%	0.246	C	C	.	.	H	α-helix	trans	-65.1	-40.4	177.7	-61	0	0	0	0	111.9	I146 R180 I182 N194 I195 F196 A201 Q202	I146-T198 HydrophobicContact CD1-CG2 3.86Å; R180-T198 HydrophobicContact CB-CG2 4.12Å; R180-T198 HydrophobicContact CG-CG2 4.04Å; I182-T198 HydrophobicContact CD1-CG2 4.22Å; N194-T198 WeakPolarHBondContact O-CB 3.46Å; N194-T198 PolarHBondContact O-N 3.17Å; N194-T198 PolarHBondContact O-OG1 3.02Å; I195-T198 PolarHBondContact O-N 3.25Å; F196-T198 VanDerWaalsContact C-N 3.29Å; F196-T198 PolarHBondContact O-N 3.15Å; T198-A201 WeakPolarHBondContact O-CB 3.44Å; T198-A201 PolarHBondContact O-N 3.16Å; T198-Q202 WeakPolarHBondContact O-CG 3.42Å; T198-Q202 PolarHBondContact O-N 3.5Å; T198-Q202 VanDerWaalsContact O-N 3.09Å
199	L	90	Very high	85	Confident	1 Å²	1	46.5 Å²	46.5	1%	0.005	24%	0.243	C	C	.	.	H	α-helix	trans	-65.4	-47.9	179.6	-169.7	157.2	0	0	0	111.9	V38 F88 A112 V114 I146 I195 F196 A201 Q202 K203	V38-L199 HydrophobicContact CB-CD1 4.36Å; V38-L199 HydrophobicContact CG1-CD1 3.59Å; V38-L199 HydrophobicContact CG2-CD1 3.77Å; V38-L199 HydrophobicContact CG2-CD2 3.74Å; V38-L199 HydrophobicContact CG2-CG 4.42Å; F88-L199 HydrophobicContact CE2-CD2 4.13Å; A112-L199 HydrophobicContact CB-CD1 3.71Å; A112-L199 HydrophobicContact CB-CD2 3.69Å; A112-L199 HydrophobicContact CB-CG 3.65Å; V114-L199 HydrophobicContact CG2-CD1 3.94Å; I146-L199 HydrophobicContact CD1-CB 3.75Å; I195-L199 PolarHBondContact O-N 3Å; F196-L199 WeakPolarHBondContact O-CB 3.35Å; F196-L199 PolarHBondContact O-N 3.03Å; F196-L199 VanDerWaalsContact O-N 3.11Å; L199-A201 VanDerWaalsContact C-N 3.29Å; L199-A201 PolarHBondContact O-N 3.31Å; L199-Q202 PolarHBondContact O-N 2.91Å; L199-K203 PolarHBondContact O-N 2.95Å; L199-K203 VanDerWaalsContact O-N 3.14Å
200	F	85.1	Confident	84.2	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-60.8	-40.3	175.1	-73.5	-65.4	0	0	0	111.4	F55 Y77 L86 F88 F196 Q202 K203 L204 L205 Y210	F55-F200 HydrophobicContact CZ-CE2 4.35Å; Y77-F200 HydrophobicContact CE2-CZ 4.33Å; L86-F200 HydrophobicContact CD2-CD1 4.28Å; L86-F200 HydrophobicContact CD2-CE1 3.76Å; L86-F200 HydrophobicContact CD2-CZ 4.49Å; F88-F200 HydrophobicContact CB-CZ 4.23Å; F88-F200 HydrophobicContact CD1-CZ 4.46Å; F88-F200 AromaticContact CD2-CE1 3.39Å; F88-F200 HydrophobicContact CD2-CE1 3.39Å; F88-F200 HydrophobicContact CD2-CE2 4.2Å; F88-F200 AromaticContact CD2-CZ 3.16Å; F88-F200 HydrophobicContact CD2-CZ 3.16Å; F88-F200 AromaticContact CE2-CE1 3.73Å; F88-F200 HydrophobicContact CE2-CE1 3.73Å; F88-F200 HydrophobicContact CE2-CE2 4.04Å; F88-F200 AromaticContact CE2-CZ 3.39Å; F88-F200 HydrophobicContact CE2-CZ 3.39Å; F88-F200 HydrophobicContact CG-CE1 4.26Å; F88-F200 AromaticContact CG-CZ 3.73Å; F88-F200 HydrophobicContact CG-CZ 3.73Å; F88-F200 HydrophobicContact CZ-CZ 4.19Å; F196-F200 HydrophobicContact CB-CD2 4.4Å; F196-F200 HydrophobicContact CB-CE2 4.23Å; F196-F200 WeakPolarHBondContact O-CD2 3.13Å; F196-F200 PolarHBondContact O-N 2.92Å; F200-Q202 VanDerWaalsContact C-N 3.28Å; F200-Q202 PolarHBondContact O-N 3.33Å; F200-K203 PolarHBondContact O-N 3.2Å; F200-L204 HydrophobicContact CD1-CB 4.46Å; F200-L204 HydrophobicContact CD1-CD1 3.69Å; F200-L204 HydrophobicContact CE1-CD1 4.1Å; F200-L204 PolarHBondContact O-N 3.3Å; F200-L205 PolarHBondContact O-N 2.74Å; F200-Y210 HydrophobicContact CB-CD2 3.92Å; F200-Y210 AromaticContact CD2-CD2 3.31Å; F200-Y210 HydrophobicContact CD2-CD2 3.31Å; F200-Y210 AromaticContact CD2-CE2 3.33Å; F200-Y210 HydrophobicContact CD2-CE2 3.33Å; F200-Y210 HydrophobicContact CE2-CD2 4Å; F200-Y210 AromaticContact CE2-CE2 3.65Å; F200-Y210 HydrophobicContact CE2-CE2 3.65Å; F200-Y210 AromaticContact CG-CD2 3.79Å; F200-Y210 HydrophobicContact CG-CD2 3.79Å; F200-Y210 HydrophobicContact CG-CE2 4.26Å
201	A	85	Confident	83.6	Confident	55 Å²	55	46 Å²	46	46%	0.455	23%	0.23	S	C	.	.	H	α-helix	trans	-60.5	-32.6	175.7	0	0	0	0	0	113.9	Q197 T198 L199 L205	Q197-A201 VanDerWaalsContact O-CB 3.27Å; Q197-A201 WeakPolarHBondContact O-CB 3.49Å; Q197-A201 PolarHBondContact O-N 2.99Å; T198-A201 WeakPolarHBondContact O-CB 3.44Å; T198-A201 PolarHBondContact O-N 3.16Å; L199-A201 VanDerWaalsContact C-N 3.29Å; L199-A201 PolarHBondContact O-N 3.31Å; A201-L205 VanDerWaalsContact CA-O 3.26Å; A201-L205 WeakPolarHBondContact CA-O 3.41Å
202	Q	82.3	Confident	83	Confident	76 Å²	76	48.3 Å²	48.3	36%	0.355	25%	0.246	S	C	.	.	H	α-helix	trans	-82.3	-35.9	178.7	-72	-174.6	-77.8	0	0	113.8	P144 T198 L199 F200	P144-Q202 HydrophobicContact CB-CB 3.93Å; P144-Q202 HydrophobicContact CG-CB 4.15Å; T198-Q202 WeakPolarHBondContact O-CG 3.42Å; T198-Q202 PolarHBondContact O-N 3.5Å; T198-Q202 VanDerWaalsContact O-N 3.09Å; L199-Q202 PolarHBondContact O-N 2.91Å; F200-Q202 VanDerWaalsContact C-N 3.28Å; F200-Q202 PolarHBondContact O-N 3.33Å
203	K	73.1	Confident	82.5	Confident	75 Å²	75	49.4 Å²	49.4	33%	0.326	25%	0.252	S	S	.	.	H	α-helix	trans	-103.8	-36.7	-169.8	-164	-168.5	169.8	84.6	0	115	V36 D111 P144 L199 F200	V36-K203 HydrophobicContact CG1-CD 4.17Å; D111-K203 HydrophobicContact CB-CD 4.18Å; D111-K203 VanDerWaalsContact CB-CE 3.5Å; D111-K203 VanDerWaalsContact CB-NZ 3.27Å; D111-K203 WeakPolarHBondContact O-CD 3.46Å; D111-K203 PolarHBondContact O-NZ 2.73Å; D111-K203 IonicContact OD1-NZ 2.74Å; D111-K203 PolarHBondContact OD1-NZ 3.16Å; P144-K203 HydrophobicContact CG-CB 4.17Å; L199-K203 PolarHBondContact O-N 2.95Å; L199-K203 VanDerWaalsContact O-N 3.14Å; F200-K203 PolarHBondContact O-N 3.2Å
204	L	68.6	Low	82.2	Confident	50 Å²	50	54.6 Å²	54.6	26%	0.262	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-130.6	-45	-154.3	-73.5	140.6	0	0	0	114.7	I34 V36 L86 F200	I34-L204 HydrophobicContact CG2-CD2 4.01Å; V36-L204 HydrophobicContact CB-CD1 4.23Å; V36-L204 HydrophobicContact CG1-CD1 3.76Å; V36-L204 HydrophobicContact CG2-CD1 3.51Å; V36-L204 HydrophobicContact CG2-CD2 3.44Å; V36-L204 VanDerWaalsContact CG2-CD2 3.44Å; V36-L204 HydrophobicContact CG2-CG 4.06Å; L86-L204 HydrophobicContact CD1-CD2 4.37Å; F200-L204 HydrophobicContact CD1-CB 4.46Å; F200-L204 HydrophobicContact CD1-CD1 3.69Å; F200-L204 HydrophobicContact CE1-CD1 4.1Å; F200-L204 PolarHBondContact O-N 3.3Å
205	L	70.7	Confident	81.9	Confident	14 Å²	14	57 Å²	57	7%	0.073	28%	0.281	C	S	.	.			trans	-143	151.6	-161.8	-72.9	175.7	0	0	0	111.1	M79 L86 F200 A201 E209 L213	M79-L205 HydrophobicContact CE-CD1 4.07Å; M79-L205 HydrophobicContact CE-CD2 3.4Å; M79-L205 VanDerWaalsContact CE-CD2 3.4Å; M79-L205 HydrophobicContact CE-CG 4.22Å; M79-L205 HydrophobicContact SD-CD1 3.98Å; M79-L205 HydrophobicContact SD-CD2 4.4Å; L86-L205 HydrophobicContact CD2-CD1 4.24Å; F200-L205 PolarHBondContact O-N 2.74Å; A201-L205 VanDerWaalsContact CA-O 3.26Å; A201-L205 WeakPolarHBondContact CA-O 3.41Å; L205-E209 HydrophobicContact CB-CB 3.86Å; L205-E209 HydrophobicContact CD1-CB 4.29Å; L205-E209 HydrophobicContact CD2-CB 3.59Å; L205-E209 HydrophobicContact CD2-CG 4.2Å; L205-E209 HydrophobicContact CG-CB 4.1Å; L205-L213 HydrophobicContact CD1-CD1 4.18Å; L205-L213 HydrophobicContact CD1-CD2 3.84Å; L205-L213 HydrophobicContact CD1-CG 4.26Å
206	S	72.7	Confident	81.6	Confident	44 Å²	44	63.7 Å²	63.7	31%	0.308	31%	0.306	S	S	.	.			trans	-66.2	159.9	160.5	68.5	0	0	0	0	110.8	Q208 E209 Y210	S206-Q208 PolarHBondContact O-N 3Å; S206-Q208 VanDerWaalsContact O-N 3.16Å; S206-E209 WeakPolarHBondContact CA-OE2 3.5Å; S206-E209 WeakPolarHBondContact CB-OE2 3.48Å; S206-E209 PolarHBondContact N-OE2 3.48Å; S206-E209 PolarHBondContact O-N 3.31Å; S206-E209 WeakPolarHBondContact OG-CG 3.17Å; S206-E209 PolarHBondContact OG-N 3.38Å; S206-E209 PolarHBondContact OG-OE2 2.8Å; S206-Y210 PolarHBondContact O-N 2.96Å
207	Y	70.2	Confident	81.5	Confident	105 Å²	105	70.7 Å²	70.7	41%	0.412	33%	0.332	S	S	.	.	H	α-helix	trans	-55.9	-30.9	175.1	-174.9	-106.7	0	0	0	113.5	K211	Y207-K211 HydrophobicContact CE1-CD 4.03Å; Y207-K211 VanDerWaalsContact CE1-NZ 3.32Å; Y207-K211 PolarHBondContact O-N 2.94Å; Y207-K211 WeakPolarHBondContact OH-CE 3.1Å; Y207-K211 PolarHBondContact OH-NZ 3.35Å
208	Q	72.7	Confident	81.5	Confident	139 Å²	139	71.2 Å²	71.2	65%	0.65	34%	0.335	S	S	*	.	H	α-helix	trans	-74	-37.5	176.6	-59.9	-61.9	-8.8	0	0	112.1	S206 K211 S212	S206-Q208 PolarHBondContact O-N 3Å; S206-Q208 VanDerWaalsContact O-N 3.16Å; Q208-K211 PolarHBondContact O-N 3.24Å; Q208-S212 PolarHBondContact O-N 3.32Å
209	E	77.9	Confident	81.5	Confident	74 Å²	74	70.4 Å²	70.4	35%	0.346	33%	0.33	S	S	.	.	H	α-helix	trans	-69.7	-35.7	174.5	-72.2	158.7	126.3	0	0	111.7	L205 S206 K211 S212 L213	L205-E209 HydrophobicContact CB-CB 3.86Å; L205-E209 HydrophobicContact CD1-CB 4.29Å; L205-E209 HydrophobicContact CD2-CB 3.59Å; L205-E209 HydrophobicContact CD2-CG 4.2Å; L205-E209 HydrophobicContact CG-CB 4.1Å; S206-E209 WeakPolarHBondContact CA-OE2 3.5Å; S206-E209 WeakPolarHBondContact CB-OE2 3.48Å; S206-E209 PolarHBondContact N-OE2 3.48Å; S206-E209 PolarHBondContact O-N 3.31Å; S206-E209 WeakPolarHBondContact OG-CG 3.17Å; S206-E209 PolarHBondContact OG-N 3.38Å; S206-E209 PolarHBondContact OG-OE2 2.8Å; E209-K211 VanDerWaalsContact C-N 3.31Å; E209-K211 PolarHBondContact O-N 3.03Å; E209-S212 PolarHBondContact O-N 2.65Å; E209-S212 PolarHBondContact O-OG 3.37Å; E209-L213 PolarHBondContact O-N 2.83Å
210	Y	79.7	Confident	81.4	Confident	19 Å²	19	77.6 Å²	77.6	8%	0.075	37%	0.366	C	S	.	.	H	α-helix	trans	-58.7	-43.9	169.4	174.4	-88.2	0	0	0	111.4	E193 Q197 F200 S206 S212 L213	E193-Y210 WeakPolarHBondContact CG-OH 3.21Å; E193-Y210 VanDerWaalsContact OE1-CE1 3.32Å; E193-Y210 WeakPolarHBondContact OE1-CE1 3.22Å; E193-Y210 PolarHBondContact OE1-OH 2.86Å; Q197-Y210 HydrophobicContact CG-CD1 3.66Å; Q197-Y210 HydrophobicContact CG-CE1 3.28Å; Q197-Y210 HydrophobicContact CG-CE2 4.34Å; Q197-Y210 HydrophobicContact CG-CG 4.35Å; F200-Y210 HydrophobicContact CB-CD2 3.92Å; F200-Y210 AromaticContact CD2-CD2 3.31Å; F200-Y210 HydrophobicContact CD2-CD2 3.31Å; F200-Y210 AromaticContact CD2-CE2 3.33Å; F200-Y210 HydrophobicContact CD2-CE2 3.33Å; F200-Y210 HydrophobicContact CE2-CD2 4Å; F200-Y210 AromaticContact CE2-CE2 3.65Å; F200-Y210 HydrophobicContact CE2-CE2 3.65Å; F200-Y210 AromaticContact CG-CD2 3.79Å; F200-Y210 HydrophobicContact CG-CD2 3.79Å; F200-Y210 HydrophobicContact CG-CE2 4.26Å; S206-Y210 PolarHBondContact O-N 2.96Å; Y210-S212 PolarHBondContact O-N 2.88Å; Y210-L213 HydrophobicContact CD2-CD1 3.77Å; Y210-L213 HydrophobicContact CE2-CD1 4.22Å; Y210-L213 HydrophobicContact CG-CD1 4.44Å; Y210-L213 VanDerWaalsContact O-CB 3.27Å; Y210-L213 WeakPolarHBondContact O-CB 3.39Å; Y210-L213 VanDerWaalsContact O-CG 3.24Å; Y210-L213 WeakPolarHBondContact O-CG 3.47Å; Y210-L213 PolarHBondContact O-N 2.79Å
211	K	80.8	Confident	81.1	Confident	122 Å²	122	79 Å²	79	53%	0.53	38%	0.375	S	S	.	.	H	α-helix	trans	-68.8	-17.7	178.7	-76.4	-171.8	173.8	-179.6	0	114.6	Y207 Q208 E209	Y207-K211 HydrophobicContact CE1-CD 4.03Å; Y207-K211 VanDerWaalsContact CE1-NZ 3.32Å; Y207-K211 PolarHBondContact O-N 2.94Å; Y207-K211 WeakPolarHBondContact OH-CE 3.1Å; Y207-K211 PolarHBondContact OH-NZ 3.35Å; Q208-K211 PolarHBondContact O-N 3.24Å; E209-K211 VanDerWaalsContact C-N 3.31Å; E209-K211 PolarHBondContact O-N 3.03Å
212	S	82.8	Confident	80.4	Confident	68 Å²	68	82.1 Å²	82.1	48%	0.476	38%	0.384	S	S	.	.	H	α-helix	trans	-90.7	-6.4	175.3	73.2	0	0	0	0	113.6	Q208 E209 Y210 K214	Q208-S212 PolarHBondContact O-N 3.32Å; E209-S212 PolarHBondContact O-N 2.65Å; E209-S212 PolarHBondContact O-OG 3.37Å; Y210-S212 PolarHBondContact O-N 2.88Å; S212-K214 PolarHBondContact O-N 3.2Å
213	L	85.2	Confident	79.6	Confident	23 Å²	23	84.4 Å²	84.4	12%	0.12	41%	0.405	C	S	.	.			trans	-59.3	124.3	176	-65.4	-176.2	0	0	0	111.7	Y77 M79 L86 L205 E209 Y210	Y77-L213 HydrophobicContact CD1-CB 3.67Å; Y77-L213 HydrophobicContact CD1-CD1 4.23Å; Y77-L213 HydrophobicContact CD1-CG 4.49Å; Y77-L213 HydrophobicContact CD2-CD1 4.22Å; Y77-L213 HydrophobicContact CE1-CB 4.3Å; Y77-L213 HydrophobicContact CG-CB 4.03Å; Y77-L213 HydrophobicContact CG-CD1 4.05Å; Y77-L213 HydrophobicContact CG-CG 4.44Å; M79-L213 HydrophobicContact CG-CD2 3.22Å; M79-L213 HydrophobicContact SD-CD2 3.78Å; L86-L213 HydrophobicContact CD2-CD1 4.08Å; L86-L213 HydrophobicContact CD2-CD2 4.18Å; L205-L213 HydrophobicContact CD1-CD1 4.18Å; L205-L213 HydrophobicContact CD1-CD2 3.84Å; L205-L213 HydrophobicContact CD1-CG 4.26Å; E209-L213 PolarHBondContact O-N 2.83Å; Y210-L213 HydrophobicContact CD2-CD1 3.77Å; Y210-L213 HydrophobicContact CE2-CD1 4.22Å; Y210-L213 HydrophobicContact CG-CD1 4.44Å; Y210-L213 VanDerWaalsContact O-CB 3.27Å; Y210-L213 WeakPolarHBondContact O-CB 3.39Å; Y210-L213 VanDerWaalsContact O-CG 3.24Å; Y210-L213 WeakPolarHBondContact O-CG 3.47Å; Y210-L213 PolarHBondContact O-N 2.79Å
214	K	86.5	Confident	78.8	Confident	156 Å²	156	85.8 Å²	85.8	68%	0.678	41%	0.412	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.9	107.7	173.6	-67	-178.3	-177.8	178.3	0	109.9	Y77 T78 S212 R216	Y77-K214 CarbonylContact C-O 3.51Å; Y77-K214 WeakPolarHBondContact CA-O 3.27Å; T78-K214 PolarHBondContact N-O 2.96Å; T78-K214 PolarHBondContact O-N 2.75Å; S212-K214 PolarHBondContact O-N 3.2Å; K214-R216 PolarHBondContact O-N 3.49Å
215	K	89	Confident	77.9	Confident	122 Å²	122	87.8 Å²	87.8	53%	0.53	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-54.1	122	173.6	166.9	176.1	159.3	161.9	0	110	I75 Y77	I75-K215 HydrophobicContact CD1-CB 4.42Å; I75-K215 HydrophobicContact CD1-CD 3.81Å; I75-K215 HydrophobicContact CD1-CG 3.94Å; I75-K215 HydrophobicContact CG1-CG 4.36Å; Y77-K215 HydrophobicContact CD1-CB 4.09Å; Y77-K215 HydrophobicContact CE1-CB 4.07Å
216	R	87.7	Confident	76.7	Confident	139 Å²	139	92.5 Å²	92.5	53%	0.525	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	-52.7	-175.4	-160.6	-172.5	85.9	121.3	-5.3	112	E76 K214	E76-R216 HydrophobicContact CB-CB 4.26Å; E76-R216 PolarHBondContact O-N 3.36Å; E76-R216 IonicContact OE1-NH2 3.71Å; E76-R216 IonicContact OE2-CZ 3.14Å; E76-R216 IonicContact OE2-NE 2.74Å; E76-R216 PolarHBondContact OE2-NE 3.28Å; E76-R216 IonicContact OE2-NH2 2.7Å; E76-R216 PolarHBondContact OE2-NH2 3.34Å; K214-R216 PolarHBondContact O-N 3.49Å
217	R	90.6	Very high	75.9	Confident	147 Å²	147	95.8 Å²	95.8	56%	0.555	48%	0.48	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-151.4	164.7	-177.1	-57.1	-179.4	80.9	-159.6	8.8	109.3	W74 E76	W74-R217 HydrophobicContact CH2-CB 3.89Å; W74-R217 HydrophobicContact CZ3-CB 3.74Å; E76-R217 HydrophobicContact CB-CB 4.34Å; E76-R217 PolarHBondContact N-O 3.02Å; E76-R217 WeakPolarHBondContact OE2-CD 3.47Å
218	Q	90.7	Very high	75.1	Confident	37 Å²	37	95.7 Å²	95.7	17%	0.173	50%	0.495	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.8	168.5	174.2	57.7	-178.9	51.4	0	0	111.1	L56 W74 I75	L56-Q218 VanDerWaalsContact O-CD 3.31Å; L56-Q218 PolarHBondContact O-NE2 2.86Å; L56-Q218 PolarHBondContact O-OE1 3.29Å; L56-Q218 VanDerWaalsContact O-OE1 3.05Å; W74-Q218 VanDerWaalsContact CZ3-CA 3.43Å; W74-Q218 CarbonylContact O-C 3.37Å; W74-Q218 WeakPolarHBondContact O-CA 3.44Å; W74-Q218 WeakPolarHBondContact O-CB 3.23Å; I75-Q218 HydrophobicContact CB-CB 4.04Å; I75-Q218 HydrophobicContact CG1-CB 4.2Å
219	S	91	Very high	73.7	Confident	12 Å²	12	100.9 Å²	100.9	8%	0.084	51%	0.509	C	S	.	.	P	Polyproline II helix	trans	-59.4	147.9	165.9	55.8	0	0	0	0	111.3	W57 N73 W74	W57-S219 PolarHBondContact NE1-O 2.69Å; N73-S219 WeakPolarHBondContact CA-OG 3.41Å; N73-S219 WeakPolarHBondContact CB-OG 3.18Å; N73-S219 WeakPolarHBondContact OD1-CB 3.33Å; N73-S219 PolarHBondContact OD1-OG 3.48Å; W74-S219 PolarHBondContact N-OG 3.19Å; W74-S219 VanDerWaalsContact N-OG 3.16Å; W74-S219 PolarHBondContact O-N 2.75Å; W74-S219 PolarHBondContact O-OG 3.17Å
220	M	86.5	Confident	72.4	Confident	152 Å²	152	101.9 Å²	101.9	75%	0.749	53%	0.529	S	S	*	.	P	Polyproline II helix	trans	-87.9	147.8	169	-70.5	-62.2	-69.9	0	0	109.2	L222	M220-L222 PolarHBondContact O-N 3.27Å
221	P	78.5	Confident	70.8	Confident	30 Å²	30	106.3 Å²	106.3	20%	0.195	56%	0.563	C	S	.	*	P	Polyproline II helix	trans	-63	139.4	172.2	2.8	8.3	0	0	0	109	W57	W57-P221 HydrophobicContact CD2-CB 3.96Å; W57-P221 HydrophobicContact CD2-CG 3.63Å; W57-P221 HydrophobicContact CE3-CB 3.97Å; W57-P221 HydrophobicContact CE3-CG 4.1Å; W57-P221 HydrophobicContact CG-CG 3.84Å; W57-P221 HydrophobicContact CH2-CB 3.99Å; W57-P221 VanDerWaalsContact CZ2-CA 3.48Å; W57-P221 HydrophobicContact CZ2-CB 3.95Å; W57-P221 HydrophobicContact CZ2-CG 4.19Å; W57-P221 HydrophobicContact CZ3-CB 3.99Å
222	L	70.6	Confident	68.9	Low	121 Å²	121	104 Å²	104	63%	0.634	57%	0.574	S	S	*	*	P	Polyproline II helix	trans	-55.9	135.5	172.9	-67.3	174.8	0	0	0	109.9	M220 Q224	M220-L222 PolarHBondContact O-N 3.27Å; L222-Q224 PolarHBondContact O-N 3.37Å
223	P	65.1	Low	67.2	Low	123 Å²	123	110.4 Å²	110.4	80%	0.799	59%	0.593	S	S	*	*			trans	-57.8	115.9	179.2	-25.1	34.2	0	0	0	110.9
224	Q	58	Low	65.3	Low	105 Å²	105	116.1 Å²	116.1	49%	0.491	63%	0.629	S	S	.	*	P	Polyproline II helix	trans	-71.9	133	171.6	-63.1	-162.3	21.8	0	0	109	L222	L222-Q224 PolarHBondContact O-N 3.37Å
225	P	49.3	Very low	63.2	Low	92 Å²	92	112.1 Å²	112.1	60%	0.597	63%	0.632	S	S	*	*	P	Polyproline II helix	trans	-60.3	141.5	171	25.9	-33.5	0	0	0	109.1
226	P	45.8	Very low	61	Low	112 Å²	112	117.7 Å²	117.7	73%	0.727	65%	0.65	S	S	*	*	P	Polyproline II helix	trans	-58	146.8	-177.1	24.4	-34.2	0	0	0	110.7	S228	P226-S228 PolarHBondContact O-N 3.29Å; P226-S228 VanDerWaalsContact O-N 3.15Å
227	P	54.6	Low	59	Low	113 Å²	113	116.2 Å²	116.2	73%	0.734	66%	0.661	S	S	*	*	P	Polyproline II helix	trans	-57.9	123.3	178.9	23.9	-33.2	0	0	0	109.5	R229	P227-R229 PolarHBondContact O-N 3.41Å; P227-R229 VanDerWaalsContact O-N 3.09Å
228	S	53	Low	56.9	Low	104 Å²	104	114.5 Å²	114.5	73%	0.727	68%	0.678	S	S	*	*			trans	-62.9	116	177.1	46	0	0	0	0	108.9	P226 A230	P226-S228 PolarHBondContact O-N 3.29Å; P226-S228 VanDerWaalsContact O-N 3.15Å; S228-A230 PolarHBondContact O-N 3.05Å
229	R	45.3	Very low	54.7	Low	248 Å²	248	118.6 Å²	118.6	94%	0.936	71%	0.711	S	S	*	*			trans	-54.2	115	172.7	-86.1	-177.3	166.6	-178.3	-4.3	108.1	P227 S231	P227-R229 PolarHBondContact O-N 3.41Å; P227-R229 VanDerWaalsContact O-N 3.09Å; R229-S231 PolarHBondContact O-N 3.04Å
230	A	49.6	Very low	52.7	Low	95 Å²	95	123.1 Å²	123.1	79%	0.785	75%	0.749	S	S	*	*			trans	-59.6	114	176.1	0	0	0	0	0	108.8	S228 G232	S228-A230 PolarHBondContact O-N 3.05Å; A230-G232 PolarHBondContact O-N 3.47Å
231	S	45.7	Very low	50.7	Low	111 Å²	111	121.2 Å²	121.2	78%	0.776	75%	0.751	S	S	*	*			trans	-69.9	93.5	175.1	57.8	0	0	0	0	109.2	R229 K233	R229-S231 PolarHBondContact O-N 3.04Å; S231-K233 PolarHBondContact O-N 3.09Å; S231-K233 VanDerWaalsContact O-N 3.08Å
232	G	40.4	Very low	49.2	Very low	74 Å²	74	129 Å²	129	76%	0.763	78%	0.784	S	S	*	*			trans	-63.6	108.4	170.5	0	0	0	0	0	110.3	A230	A230-G232 PolarHBondContact O-N 3.47Å
233	K	48.1	Very low	48	Very low	203 Å²	203	130.1 Å²	130.1	88%	0.883	80%	0.796	S	S	*	*			trans	-105	96.9	163.1	-88.8	-171.8	172.5	-176.2	0	109.1	S231	S231-K233 PolarHBondContact O-N 3.09Å; S231-K233 VanDerWaalsContact O-N 3.08Å
234	T	45.8	Very low	46.9	Very low	142 Å²	142	129.3 Å²	129.3	87%	0.871	79%	0.793	S	S	*	*			trans	-82	140.4	166.9	44.3	0	0	0	0	110.3
235	G	42.1	Very low	46.5	Very low	72 Å²	72	134 Å²	134	74%	0.742	82%	0.815	S	S	*	*			trans	112.6	120.3	146.9	0	0	0	0	0	119.7
236	R	42.3	Very low	46.3	Very low	239 Å²	239	134.4 Å²	134.4	90%	0.902	82%	0.821	S	S	*	*			trans	73.2	94.4	138.6	-75.9	-179.1	158.9	174.3	-7.1	121.6
237	S	46.5	Very low	46.5	Very low	109 Å²	109	138.2 Å²	138.2	76%	0.762	83%	0.826	S	S	*	*				47.6	121.4	112.7	64.6	0	0	0	0	122
238	A	46	Very low	46.2	Very low	111 Å²	111	138 Å²	138	92%	0.917	83%	0.827	S	S	*	*			trans	-158.9	148.7	134	0	0	0	0	0	110.3
239	S	44.2	Very low	45.9	Very low	122 Å²	122	137.6 Å²	137.6	85%	0.853	82%	0.824	S	S	*	*			trans	-120.9	140.5	-178.6	51.9	0	0	0	0	111.4
240	A	48.5	Very low	46.1	Very low	108 Å²	108	131.7 Å²	131.7	89%	0.893	82%	0.821	S	S	*	*			trans	-151.3	155.2	169.7	0	0	0	0	0	111.1
241	S	44.6	Very low	46.2	Very low	112 Å²	112	132.6 Å²	132.6	78%	0.783	82%	0.821	S	S	*	*			trans	-149	125.5	-167.4	56.2	0	0	0	0	113.2
242	E	47.9	Very low	46	Very low	192 Å²	192	133 Å²	133	90%	0.897	82%	0.823	S	S	*	*			trans	-148.1	120.1	167	-77	174.7	123	0	0	105.9
243	V	44.8	Very low	46.4	Very low	145 Å²	145	136.6 Å²	136.6	88%	0.879	82%	0.823	S	S	*	*				78.9	131.7	56.4	-177.2	0	0	0	0	113.7
244	S	43.2	Very low	46.3	Very low	106 Å²	106	134.9 Å²	134.9	74%	0.741	82%	0.823	S	S	*	*			trans	-92.5	155.7	-157.1	53.5	0	0	0	0	116.8
245	Q	48	Very low	46.6	Very low	203 Å²	203	137.2 Å²	137.2	95%	0.949	85%	0.845	S	S	*	*			trans	-137.2	166.8	153.6	-73.8	-161.7	5.2	0	0	113
246	S	46.9	Very low	46.9	Very low	102 Å²	102	140.5 Å²	140.5	71%	0.713	85%	0.85	S	S	*	*			trans	-134.7	175	-151.6	56.6	0	0	0	0	114.6
247	K	49.8	Very low	47.1	Very low	191 Å²	191	135.3 Å²	135.3	83%	0.83	85%	0.847	S	S	*	*			trans	110.6	118	162.4	-63.7	168.5	-178.2	179.2	0	114.1
248	S	47.9	Very low	47.1	Very low	109 Å²	109	136.7 Å²	136.7	76%	0.762	85%	0.852	S	S	*	*				91.5	143.3	80.2	-179.1	0	0	0	0	111.8
249	S	46.1	Very low	47.2	Very low	96 Å²	96	138.2 Å²	138.2	67%	0.671	85%	0.848	S	S	*	*			cis	-168.3	172.5	-18.2	-78.5	0	0	0	0	107.6
250	S	50.8	Low	47.4	Very low	123 Å²	123	139.3 Å²	139.3	86%	0.86	85%	0.848	S	S	*	*			trans	74.3	143.6	167.4	-48.7	0	0	0	0	115.8
251	S	50.9	Low	47.3	Very low	114 Å²	114	141.3 Å²	141.3	80%	0.797	85%	0.845	S	S	*	*			cis	-151	-177.5	-8.9	61.4	0	0	0	0	107.5
252	C	41.7	Very low	47.5	Very low	120 Å²	120	143.4 Å²	143.4	81%	0.811	85%	0.849	S	S	*	*			cis	-151.9	-162.8	6.3	-152.6	0	0	0	0	110.1
253	I	47.6	Very low	47.5	Very low	150 Å²	150	139.7 Å²	139.7	77%	0.769	85%	0.845	S	S	*	*			trans	-132.8	144.2	174.3	-63.8	170.7	0	0	0	109.5
254	L	46.5	Very low	47.7	Very low	166 Å²	166	139.3 Å²	139.3	87%	0.869	84%	0.842	S	S	*	*			trans	-145.7	128.1	153.4	-94.8	174.9	0	0	0	110.3
255	S	52.8	Low	48.1	Very low	191 Å²	191	142.3 Å²	142.3	100%	1.336	85%	0.852	S	S	*	*			trans	62.4	0	170.7	-59	0	0	0	0	118.4

Retrieved 255 of 255 residues in 135.3 ms (Link to these results)

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