X5D9J9_HUMAN Loading...

Neuroligin 3 isoform E

AlphaFold DB , UniProt , Accession X5D9J9, Species HUMAN (Homo sapiens, Human), Gene NLGN3, Length 324 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	40.3	Very low	41.9	Very low	236 Å²	236	165.7 Å²	165.7	100%	1.163	89%	0.892	S	S	*	*				0	100.7	0	-169.8	162.1	165	0	0	107.1
2	W	35.6	Very low	42.1	Very low	258 Å²	258	165.8 Å²	165.8	98%	0.977	89%	0.89	S	S	*	*	P	Polyproline II helix	trans	-95.1	127.5	-172.5	-74.9	58.7	0	0	0	109.6
3	L	38.3	Very low	42.7	Very low	176 Å²	176	160.6 Å²	160.6	92%	0.921	87%	0.874	S	S	*	*	P	Polyproline II helix	trans	-88.9	123.8	175.7	-80.7	155.2	0	0	0	109.9
4	R	39	Very low	43.2	Very low	252 Å²	252	157.6 Å²	157.6	95%	0.951	87%	0.867	S	S	*	*	P	Polyproline II helix	trans	-84.7	123.3	172.7	-77.4	-173.8	173.3	-159.2	-1.1	110
5	L	41.4	Very low	43.8	Very low	176 Å²	176	159.9 Å²	159.9	92%	0.921	87%	0.865	S	S	*	*	P	Polyproline II helix	trans	-86	128.7	164.7	-77.3	154.1	0	0	0	109.1
6	G	42.4	Very low	43.9	Very low	68 Å²	68	157.2 Å²	157.2	70%	0.701	86%	0.858	S	S	*	*	P	Polyproline II helix	trans	-86.4	158.9	170.8	0	0	0	0	0	112.1
7	P	46.2	Very low	44.6	Very low	126 Å²	126	155.1 Å²	155.1	82%	0.818	85%	0.851	S	S	*	*	P	Polyproline II helix	trans	-80.2	160.5	-176.4	33.7	-33.5	0	0	0	112.5
8	P	45.7	Very low	45.2	Very low	125 Å²	125	152.7 Å²	152.7	81%	0.812	84%	0.842	S	S	*	*	P	Polyproline II helix	trans	-80.2	148.4	-178.5	32.8	-32.6	0	0	0	112.1
9	S	46.8	Very low	45.5	Very low	122 Å²	122	147.5 Å²	147.5	85%	0.853	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-75.3	126.3	173.3	40.6	0	0	0	0	111.4
10	L	41.6	Very low	46	Very low	169 Å²	169	150.5 Å²	150.5	89%	0.885	82%	0.824	S	S	*	*			trans	-82.8	115.7	170.7	-82.9	157.9	0	0	0	109.8
11	S	44.3	Very low	46.5	Very low	115 Å²	115	146.9 Å²	146.9	80%	0.804	81%	0.81	S	S	*	*			trans	-85	111	169.6	159.8	0	0	0	0	109.9	S13	S11-S13 PolarHBondContact O-N 2.93Å
12	L	44.3	Very low	47.4	Very low	167 Å²	167	141 Å²	141	87%	0.874	78%	0.783	S	S	*	*			trans	-74.6	113.6	169.3	-110.6	87	0	0	0	109.9
13	S	49.8	Very low	48.6	Very low	98 Å²	98	132.7 Å²	132.7	69%	0.685	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-84.9	131.4	165.8	178.2	0	0	0	0	110.2	S11 K15	S11-S13 PolarHBondContact O-N 2.93Å; S13-K15 PolarHBondContact O-N 3.06Å
14	P	48.7	Very low	49.7	Very low	119 Å²	119	129.4 Å²	129.4	77%	0.773	75%	0.746	S	S	*	*	P	Polyproline II helix	trans	-73	120.7	176	27.6	-29.9	0	0	0	110.5
15	K	53	Low	51	Low	191 Å²	191	121.1 Å²	121.1	83%	0.83	72%	0.724	S	S	*	*	P	Polyproline II helix	trans	-69	143.5	170.9	-71.3	-177.1	179.1	178	0	110.2	S13 T17	S13-K15 PolarHBondContact O-N 3.06Å; K15-T17 PolarHBondContact O-N 3.14Å; K15-T17 VanDerWaalsContact O-N 3.15Å
16	P	45.8	Very low	52.1	Low	117 Å²	117	117.6 Å²	117.6	76%	0.76	71%	0.705	S	S	*	*			trans	-70	113.2	-175.9	28.2	-32.8	0	0	0	110.7	V18	P16-V18 PolarHBondContact O-N 3.29Å
17	T	54.9	Low	53.1	Low	121 Å²	121	122.9 Å²	122.9	74%	0.742	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.5	-5.6	176	15.9	0	0	0	0	113.7	K15 G19	K15-T17 PolarHBondContact O-N 3.14Å; K15-T17 VanDerWaalsContact O-N 3.15Å; T17-G19 PolarHBondContact O-N 2.81Å
18	V	55	Low	53.9	Low	112 Å²	112	123.7 Å²	123.7	68%	0.679	70%	0.695	S	S	*	*	H	α-helix	trans	-67.8	-34.6	-170.9	-179.8	0	0	0	0	113	P16 R20 L22	P16-V18 PolarHBondContact O-N 3.29Å; V18-R20 PolarHBondContact O-N 2.84Å; V18-L22 PolarHBondContact O-N 2.71Å
19	G	52	Low	54.6	Low	54 Å²	54	123.6 Å²	123.6	56%	0.557	69%	0.687	S	S	*	*	H	α-helix	trans	-69.5	-28.5	-177.3	0	0	0	0	0	115.2	T17 C23	T17-G19 PolarHBondContact O-N 2.81Å; G19-C23 PolarHBondContact O-N 2.89Å
20	R	54.6	Low	55.2	Low	207 Å²	207	120.4 Å²	120.4	78%	0.781	67%	0.665	S	S	*	*	H	α-helix	trans	-78	-32.8	-180	-76.7	177.1	118.2	179.1	0.5	112.5	V18 L24	V18-R20 PolarHBondContact O-N 2.84Å; R20-L24 WeakPolarHBondContact O-CD1 3.43Å; R20-L24 WeakPolarHBondContact O-CG 3.4Å; R20-L24 PolarHBondContact O-N 2.88Å
21	S	57.3	Low	56	Low	75 Å²	75	116.9 Å²	116.9	52%	0.524	65%	0.646	S	S	.	*	H	α-helix	trans	-71.4	-36.9	178.9	-172.4	0	0	0	0	111.8	T25	S21-T25 WeakPolarHBondContact O-CG2 2.93Å; S21-T25 PolarHBondContact O-N 3.16Å; S21-T25 PolarHBondContact O-OG1 2.78Å
22	L	58.1	Low	56.6	Low	112 Å²	112	114.6 Å²	114.6	59%	0.586	64%	0.635	S	S	*	*	H	α-helix	trans	-68.8	-39.9	176.7	-144.5	82.3	0	0	0	112.5	V18 T25 L26	V18-L22 PolarHBondContact O-N 2.71Å; L22-T25 WeakPolarHBondContact CA-OG1 3.34Å; L22-T25 PolarHBondContact O-OG1 3.5Å; L22-L26 WeakPolarHBondContact O-CB 3.32Å; L22-L26 WeakPolarHBondContact O-CD1 3.4Å; L22-L26 VanDerWaalsContact O-CG 3.26Å; L22-L26 WeakPolarHBondContact O-CG 3.39Å; L22-L26 PolarHBondContact O-N 3.03Å
23	C	60.7	Low	57	Low	85 Å²	85	114.2 Å²	114.2	57%	0.574	63%	0.632	S	S	*	*	H	α-helix	trans	-65.8	-41.9	175.5	-98.1	0	0	0	0	112.6	G19 L26 W27	G19-C23 PolarHBondContact O-N 2.89Å; C23-L26 PolarHBondContact O-N 2.76Å; C23-W27 WeakPolarHBondContact O-CB 3.28Å; C23-W27 PolarHBondContact O-N 2.68Å
24	L	62.5	Low	57.1	Low	106 Å²	106	119.3 Å²	119.3	56%	0.555	64%	0.637	S	S	*	*	H	α-helix	trans	-66.1	-41.4	178.5	-74.4	165.4	0	0	0	111.5	R20 W27 F28	R20-L24 WeakPolarHBondContact O-CD1 3.43Å; R20-L24 WeakPolarHBondContact O-CG 3.4Å; R20-L24 PolarHBondContact O-N 2.88Å; L24-W27 PolarHBondContact O-N 3.27Å; L24-F28 WeakPolarHBondContact O-CD2 3.35Å; L24-F28 PolarHBondContact O-N 3.24Å
25	T	66.8	Low	57.1	Low	79 Å²	79	117.1 Å²	117.1	49%	0.485	63%	0.629	S	S	.	*	H	α-helix	trans	-66.7	-38.4	176.4	48.4	0	0	0	0	112.3	S21 L22 W27 F28 L29	S21-T25 WeakPolarHBondContact O-CG2 2.93Å; S21-T25 PolarHBondContact O-N 3.16Å; S21-T25 PolarHBondContact O-OG1 2.78Å; L22-T25 WeakPolarHBondContact CA-OG1 3.34Å; L22-T25 PolarHBondContact O-OG1 3.5Å; T25-W27 VanDerWaalsContact C-N 3.35Å; T25-F28 PolarHBondContact O-N 2.99Å; T25-L29 VanDerWaalsContact O-CB 3.25Å; T25-L29 WeakPolarHBondContact O-CB 3.49Å; T25-L29 PolarHBondContact O-N 3.28Å
26	L	64.2	Low	57.1	Low	101 Å²	101	112.4 Å²	112.4	53%	0.529	62%	0.62	S	S	.	*	H	α-helix	trans	-67.4	-32.9	171.9	-71.6	167.9	0	0	0	112.8	L22 C23 S30	L22-L26 WeakPolarHBondContact O-CB 3.32Å; L22-L26 WeakPolarHBondContact O-CD1 3.4Å; L22-L26 VanDerWaalsContact O-CG 3.26Å; L22-L26 WeakPolarHBondContact O-CG 3.39Å; L22-L26 PolarHBondContact O-N 3.03Å; C23-L26 PolarHBondContact O-N 2.76Å; L26-S30 WeakPolarHBondContact O-CB 3.37Å; L26-S30 PolarHBondContact O-N 3.17Å; L26-S30 PolarHBondContact O-OG 3.42Å
27	W	63.5	Low	57.4	Low	180 Å²	180	113.6 Å²	113.6	68%	0.682	63%	0.625	S	S	*	*	H	α-helix	trans	-68.3	-43.6	173	-130.5	81.3	0	0	0	111.8	C23 L24 T25 S30 L31	C23-W27 WeakPolarHBondContact O-CB 3.28Å; C23-W27 PolarHBondContact O-N 2.68Å; L24-W27 PolarHBondContact O-N 3.27Å; T25-W27 VanDerWaalsContact C-N 3.35Å; W27-S30 WeakPolarHBondContact CA-OG 3.4Å; W27-S30 PolarHBondContact O-N 3.04Å; W27-S30 PolarHBondContact O-OG 3.41Å; W27-L31 VanDerWaalsContact O-CB 3.29Å; W27-L31 WeakPolarHBondContact O-CB 3.36Å; W27-L31 PolarHBondContact O-N 3.37Å
28	F	61.7	Low	57.4	Low	143 Å²	143	115.7 Å²	115.7	63%	0.627	63%	0.627	S	S	*	*	H	α-helix	trans	-67.5	-36.5	174.2	-83.6	-71.2	0	0	0	112.4	L24 T25 L31 A32	L24-F28 WeakPolarHBondContact O-CD2 3.35Å; L24-F28 PolarHBondContact O-N 3.24Å; T25-F28 PolarHBondContact O-N 2.99Å; F28-L31 PolarHBondContact O-N 2.83Å; F28-A32 VanDerWaalsContact O-CB 3.29Å; F28-A32 WeakPolarHBondContact O-CB 3.41Å; F28-A32 PolarHBondContact O-N 3.29Å
29	L	60.3	Low	57.9	Low	122 Å²	122	113.5 Å²	113.5	64%	0.639	62%	0.62	S	S	*	*	H	α-helix	trans	-68.9	-38.2	176.7	-159.1	73.5	0	0	0	111.5	T25 L33	T25-L29 VanDerWaalsContact O-CB 3.25Å; T25-L29 WeakPolarHBondContact O-CB 3.49Å; T25-L29 PolarHBondContact O-N 3.28Å; L29-L33 WeakPolarHBondContact O-CB 3.45Å; L29-L33 PolarHBondContact O-N 3.12Å
30	S	60.5	Low	59.1	Low	56 Å²	56	116.8 Å²	116.8	39%	0.392	63%	0.632	S	S	.	*	H	α-helix	trans	-73.6	-29.3	173.4	55	0	0	0	0	113.4	L26 W27 R34	L26-S30 WeakPolarHBondContact O-CB 3.37Å; L26-S30 PolarHBondContact O-N 3.17Å; L26-S30 PolarHBondContact O-OG 3.42Å; W27-S30 WeakPolarHBondContact CA-OG 3.4Å; W27-S30 PolarHBondContact O-N 3.04Å; W27-S30 PolarHBondContact O-OG 3.41Å; S30-R34 WeakPolarHBondContact O-CG 3.31Å; S30-R34 PolarHBondContact O-N 3.06Å
31	L	58.1	Low	60.8	Low	94 Å²	94	109.2 Å²	109.2	49%	0.492	61%	0.614	S	S	.	*	H	α-helix	trans	-72.6	-37.1	171.9	-159.7	71.7	0	0	0	111.6	W27 F28 R34	W27-L31 VanDerWaalsContact O-CB 3.29Å; W27-L31 WeakPolarHBondContact O-CB 3.36Å; W27-L31 PolarHBondContact O-N 3.37Å; F28-L31 PolarHBondContact O-N 2.83Å; L31-R34 PolarHBondContact O-N 3.49Å
32	A	57.8	Low	62.6	Low	68 Å²	68	106.3 Å²	106.3	56%	0.562	59%	0.593	S	S	*	*	H	α-helix	trans	-69.1	-34.5	172.9	0	0	0	0	0	112.2	F28 R34 A35	F28-A32 VanDerWaalsContact O-CB 3.29Å; F28-A32 WeakPolarHBondContact O-CB 3.41Å; F28-A32 PolarHBondContact O-N 3.29Å; A32-R34 PolarHBondContact O-N 3.05Å; A32-A35 WeakPolarHBondContact O-CB 3.31Å; A32-A35 PolarHBondContact O-N 3.25Å
33	L	52.8	Low	64.4	Low	158 Å²	158	104.4 Å²	104.4	83%	0.827	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.9	-10.5	175	-149.2	71.5	0	0	0	113.4	L29	L29-L33 WeakPolarHBondContact O-CB 3.45Å; L29-L33 PolarHBondContact O-N 3.12Å
34	R	50.7	Low	66.1	Low	205 Å²	205	101.2 Å²	101.2	77%	0.774	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.6	8.5	169.5	-76.4	-179.3	-176.5	-153.2	2	113.2	S30 L31 A32 S36	S30-R34 WeakPolarHBondContact O-CG 3.31Å; S30-R34 PolarHBondContact O-N 3.06Å; L31-R34 PolarHBondContact O-N 3.49Å; A32-R34 PolarHBondContact O-N 3.05Å; R34-S36 VanDerWaalsContact C-N 3.27Å; R34-S36 PolarHBondContact O-N 2.8Å
35	A	49	Very low	67.8	Low	74 Å²	74	100.2 Å²	100.2	61%	0.612	56%	0.559	S	S	*	*	S	Bend	trans	-59.4	99.1	164	0	0	0	0	0	107.6	A32 T37	A32-A35 WeakPolarHBondContact O-CB 3.31Å; A32-A35 PolarHBondContact O-N 3.25Å; A35-T37 PolarHBondContact O-N 2.84Å; A35-T37 VanDerWaalsContact O-N 3.1Å
36	S	52.7	Low	69.2	Low	92 Å²	92	96.7 Å²	96.7	64%	0.643	54%	0.537	S	S	*	.			trans	-41.2	115.3	-176.9	-171.9	0	0	0	0	110.3	R34 Q38	R34-S36 VanDerWaalsContact C-N 3.27Å; R34-S36 PolarHBondContact O-N 2.8Å; S36-Q38 PolarHBondContact O-N 3.15Å
37	T	51.9	Low	70.8	Confident	142 Å²	142	97.6 Å²	97.6	87%	0.871	54%	0.539	S	S	*	.			trans	-70.1	65.7	162.3	53.4	0	0	0	0	107.7	A35 A39	A35-T37 PolarHBondContact O-N 2.84Å; A35-T37 VanDerWaalsContact O-N 3.1Å; T37-A39 PolarHBondContact O-N 3.14Å
38	Q	55.8	Low	72.4	Confident	164 Å²	164	90.3 Å²	90.3	77%	0.766	51%	0.512	S	S	*	.			trans	-72.2	115.1	172.7	-163.6	156.2	5.5	0	0	106	S36	S36-Q38 PolarHBondContact O-N 3.15Å
39	A	64.3	Low	74.1	Confident	66 Å²	66	84.1 Å²	84.1	55%	0.545	49%	0.488	S	S	.	.	P	Polyproline II helix	trans	-49.6	136	176.5	0	0	0	0	0	108.9	T37 A41	T37-A39 PolarHBondContact O-N 3.14Å; A39-A41 PolarHBondContact O-N 2.85Å
40	P	78.7	Confident	75.9	Confident	124 Å²	124	83.4 Å²	83.4	81%	0.805	48%	0.48	S	S	*	.	P	Polyproline II helix	trans	-56	131.5	-176.8	19.4	-29.4	0	0	0	109.9
41	A	89.3	Confident	77.7	Confident	48 Å²	48	80.8 Å²	80.8	40%	0.397	46%	0.461	S	S	.	.	P	Polyproline II helix	trans	-58.4	132.5	-178.3	0	0	0	0	0	110.4	A39 T43 R52	A39-A41 PolarHBondContact O-N 2.85Å; A41-T43 PolarHBondContact O-N 2.87Å; A41-T43 PolarHBondContact O-OG1 2.97Å; A41-R52 HydrophobicContact CB-CG 3.72Å
42	P	95.1	Very high	79.6	Confident	14 Å²	14	80.8 Å²	80.8	9%	0.091	46%	0.455	C	S	.	.	P	Polyproline II helix	trans	-62.3	129.1	-174.7	29.4	-37.2	0	0	0	109.3	R52 G53 D67 Y69	P42-R52 CarbonylContact O-C 3.49Å; P42-R52 WeakPolarHBondContact O-CA 3.32Å; P42-G53 PolarHBondContact O-N 3.18Å; P42-D67 HydrophobicContact CB-CB 4.16Å; P42-D67 HydrophobicContact CG-CB 4.02Å; P42-Y69 WeakPolarHBondContact CB-OH 3.34Å
43	T	96.8	Very high	81.5	Confident	71 Å²	71	77.6 Å²	77.6	44%	0.436	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	127.3	-175.9	-58	0	0	0	0	109.3	A41 L51	A41-T43 PolarHBondContact O-N 2.87Å; A41-T43 PolarHBondContact O-OG1 2.97Å; T43-L51 CarbonylContact C-O 3.56Å; T43-L51 WeakPolarHBondContact CA-O 2.98Å; T43-L51 WeakPolarHBondContact CG2-O 3.46Å
44	V	96.8	Very high	83.5	Confident	18 Å²	18	71.6 Å²	71.6	11%	0.109	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	144.8	-178.1	162.4	0	0	0	0	109.7	K50 L51 Y69 F254 F255	V44-K50 WeakPolarHBondContact O-CA 3.46Å; V44-L51 PolarHBondContact N-O 2.8Å; V44-L51 PolarHBondContact O-N 3.2Å; V44-Y69 HydrophobicContact CB-CE1 4.14Å; V44-Y69 HydrophobicContact CG2-CE1 4.19Å; V44-Y69 WeakPolarHBondContact CG2-OH 3.17Å; V44-F254 HydrophobicContact CG1-CB 3.73Å; V44-F254 WeakPolarHBondContact CG1-O 3.46Å; V44-F255 HydrophobicContact CB-CD1 4.4Å; V44-F255 HydrophobicContact CB-CE1 4.2Å; V44-F255 HydrophobicContact CG1-CD1 4.07Å; V44-F255 HydrophobicContact CG1-CD2 4.11Å; V44-F255 HydrophobicContact CG1-CE1 3.91Å; V44-F255 HydrophobicContact CG1-CE2 3.96Å; V44-F255 HydrophobicContact CG1-CG 4.18Å; V44-F255 HydrophobicContact CG1-CZ 3.87Å; V44-F255 HydrophobicContact CG2-CD1 4.21Å; V44-F255 HydrophobicContact CG2-CE1 4.46Å
45	N	96.9	Very high	85.7	Confident	86 Å²	86	67.4 Å²	67.4	46%	0.46	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	135.7	171.7	-166	45.5	0	0	0	109.7	K50 F254	N45-K50 WeakPolarHBondContact OD1-CG 3.22Å; N45-F254 WeakPolarHBondContact O-CB 3.36Å; N45-F254 WeakPolarHBondContact O-CD1 3.44Å; N45-F254 VanDerWaalsContact O-CD2 3.31Å; N45-F254 WeakPolarHBondContact O-CD2 3.47Å; N45-F254 WeakPolarHBondContact O-CG 3.03Å
46	T	97	Very high	87.7	Confident	4 Å²	4	66 Å²	66	3%	0.025	37%	0.37	C	S	.	.			trans	-115.7	173.5	170.8	69.8	0	0	0	0	109.3	F48 G49 L51 W247 N251 F255	T46-F48 PolarHBondContact O-N 3.18Å; T46-F48 PolarHBondContact OG1-N 2.87Å; T46-G49 PolarHBondContact N-O 3.34Å; T46-G49 PolarHBondContact O-N 3.38Å; T46-G49 PolarHBondContact OG1-N 3.42Å; T46-G49 VanDerWaalsContact OG1-N 3.15Å; T46-G49 PolarHBondContact OG1-O 3.03Å; T46-L51 HydrophobicContact CG2-CD1 3.54Å; T46-L51 HydrophobicContact CG2-CG 4.19Å; T46-W247 HydrophobicContact CG2-CZ2 4.24Å; T46-N251 WeakPolarHBondContact CB-OD1 3.37Å; T46-F255 HydrophobicContact CG2-CE2 4.12Å; T46-F255 HydrophobicContact CG2-CZ 4.18Å
47	H	96.6	Very high	89.6	Confident	121 Å²	121	66.5 Å²	66.5	56%	0.56	37%	0.371	S	S	*	.	S	Bend	trans	-59.9	-23.7	171.2	-76.1	-67.2	0	0	0	113.1	E250 N251 F254	H47-E250 PolarHBondContact CD2-O 3.32Å; H47-E250 VanDerWaalsContact CD2-O 3.28Å; H47-E250 PolarHBondContact NE2-O 2.79Å; H47-N251 PolarHBondContact CD2-OD1 2.87Å; H47-N251 PolarHBondContact N-OD1 3.4Å; H47-F254 AromaticContact CD2-CE2 3.63Å; H47-F254 AromaticContact NE2-CE2 3.64Å; H47-F254 AromaticContact NE2-CZ 3.88Å
48	F	97.4	Very high	91.5	Very high	27 Å²	27	60.9 Å²	60.9	12%	0.118	34%	0.336	C	S	.	.	S	Bend	trans	-98.1	-17.4	-175.7	-58.6	-80.9	0	0	0	113.8	T46 P89 P90 S92 W93 W247	T46-F48 PolarHBondContact O-N 3.18Å; T46-F48 PolarHBondContact OG1-N 2.87Å; F48-P89 HydrophobicContact CE1-CB 4.26Å; F48-P89 HydrophobicContact CZ-CB 4.39Å; F48-P90 HydrophobicContact CD1-CG 3.8Å; F48-P90 WeakPolarHBondContact CD1-O 3.39Å; F48-P90 HydrophobicContact CD2-CG 3.94Å; F48-P90 HydrophobicContact CE1-CG 3.77Å; F48-P90 VanDerWaalsContact CE1-O 3.3Å; F48-P90 WeakPolarHBondContact CE1-O 3.42Å; F48-P90 HydrophobicContact CE2-CG 3.91Å; F48-P90 HydrophobicContact CG-CG 3.89Å; F48-P90 HydrophobicContact CZ-CG 3.83Å; F48-S92 CarbonylContact O-C 3.17Å; F48-S92 WeakPolarHBondContact O-CA 3.43Å; F48-S92 WeakPolarHBondContact O-CB 3.3Å; F48-W93 HydrophobicContact CB-CE3 4.18Å; F48-W93 HydrophobicContact CB-CH2 3.8Å; F48-W93 HydrophobicContact CB-CZ3 3.58Å; F48-W93 PolarHBondContact O-N 2.8Å; F48-W247 AromaticContact CD2-NE1 3.65Å; F48-W247 AromaticContact CE2-CD1 3.58Å; F48-W247 AromaticContact CE2-NE1 3.68Å
49	G	96.8	Very high	93	Very high	12 Å²	12	59.7 Å²	59.7	12%	0.124	34%	0.342	C	S	.	.			trans	151.4	-178.9	-179.6	0	0	0	0	0	113.2	T46	T46-G49 PolarHBondContact N-O 3.34Å; T46-G49 PolarHBondContact O-N 3.38Å; T46-G49 PolarHBondContact OG1-N 3.42Å; T46-G49 VanDerWaalsContact OG1-N 3.15Å; T46-G49 PolarHBondContact OG1-O 3.03Å
50	K	98.3	Very high	93.9	Very high	108 Å²	108	58.9 Å²	58.9	47%	0.47	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	139.8	-179.5	-62.7	-179.9	-178.3	-177.4	0	111.5	V44 N45 W93 I96 R97	V44-K50 WeakPolarHBondContact O-CA 3.46Å; N45-K50 WeakPolarHBondContact OD1-CG 3.22Å; K50-W93 PolarHBondContact O-NE1 2.9Å; K50-I96 HydrophobicContact CB-CB 4.49Å; K50-I96 HydrophobicContact CB-CG1 4.06Å; K50-I96 HydrophobicContact CD-CG1 4.24Å; K50-R97 PolarHBondContact O-N 2.83Å
51	L	98.2	Very high	94	Very high	0 Å²	0	62.6 Å²	62.6	0%	0	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	139.9	175.6	-65.8	169.4	0	0	0	109.9	T43 V44 T46 Y69 V72 W93 R97 A99 F255	T43-L51 CarbonylContact C-O 3.56Å; T43-L51 WeakPolarHBondContact CA-O 2.98Å; T43-L51 WeakPolarHBondContact CG2-O 3.46Å; V44-L51 PolarHBondContact N-O 2.8Å; V44-L51 PolarHBondContact O-N 3.2Å; T46-L51 HydrophobicContact CG2-CD1 3.54Å; T46-L51 HydrophobicContact CG2-CG 4.19Å; L51-Y69 HydrophobicContact CB-CD1 4.19Å; L51-V72 HydrophobicContact CD1-CB 4.45Å; L51-V72 HydrophobicContact CD1-CG1 3.62Å; L51-V72 HydrophobicContact CD1-CG2 3.95Å; L51-V72 HydrophobicContact CD2-CG1 4.42Å; L51-W93 HydrophobicContact CD2-CH2 4.14Å; L51-W93 HydrophobicContact CD2-CZ2 3.53Å; L51-W93 HydrophobicContact CG-CZ2 3.94Å; L51-R97 CarbonylContact C-O 3.58Å; L51-R97 WeakPolarHBondContact CA-O 3.41Å; L51-R97 HydrophobicContact CD2-CB 4.16Å; L51-R97 HydrophobicContact CD2-CG 4.38Å; L51-A99 HydrophobicContact CD2-CB 4.27Å; L51-F255 HydrophobicContact CD1-CZ 3.94Å
52	R	98.1	Very high	93.8	Very high	94 Å²	94	66.3 Å²	66.3	36%	0.355	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	116.3	169.1	178.2	-176.5	-65.4	154.8	-4.8	109.3	A41 P42 I96 R97 A99	A41-R52 HydrophobicContact CB-CG 3.72Å; P42-R52 CarbonylContact O-C 3.49Å; P42-R52 WeakPolarHBondContact O-CA 3.32Å; R52-I96 HydrophobicContact CB-CG2 3.64Å; R52-R97 PolarHBondContact N-O 3.4Å; R52-A99 PolarHBondContact O-N 2.88Å
53	G	97.5	Very high	93.4	Very high	1 Å²	1	67.4 Å²	67.4	1%	0.01	36%	0.355	C	S	.	.			trans	-93	-164.4	174	0	0	0	0	0	112.7	P42 Q68	P42-G53 PolarHBondContact O-N 3.18Å; G53-Q68 CarbonylContact C-O 3.51Å; G53-Q68 WeakPolarHBondContact CA-O 3.22Å
54	A	96.6	Very high	93	Very high	33 Å²	33	64.2 Å²	64.2	27%	0.273	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	134.6	173.9	0	0	0	0	0	110.2	V56 Q68 T100	A54-V56 HydrophobicContact CB-CG2 4.48Å; A54-Q68 PolarHBondContact N-O 2.9Å; A54-Q68 PolarHBondContact O-N 3.47Å; A54-T100 HydrophobicContact CB-CG2 4.21Å
55	R	95.1	Very high	92.9	Very high	117 Å²	117	65 Å²	65	44%	0.442	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	119.1	170.8	-176.6	161.5	-67.1	-176.2	-1.5	109.2	P65 D67	R55-P65 HydrophobicContact CG-CB 4.06Å; R55-D67 VanDerWaalsContact CB-OD1 3.27Å; R55-D67 WeakPolarHBondContact CB-OD1 3.5Å; R55-D67 WeakPolarHBondContact CG-OD1 3.27Å; R55-D67 IonicContact CZ-OD1 2.79Å; R55-D67 IonicContact CZ-OD2 2.67Å; R55-D67 IonicContact NE-OD1 2.69Å; R55-D67 PolarHBondContact NE-OD1 3.2Å; R55-D67 IonicContact NE-OD2 3.71Å; R55-D67 IonicContact NH2-OD1 3.36Å; R55-D67 PolarHBondContact NH2-OD1 3.33Å; R55-D67 IonicContact NH2-OD2 3.67Å; R55-D67 PolarHBondContact NH2-OD2 3.18Å
56	V	92.9	Very high	92.8	Very high	45 Å²	45	60.9 Å²	60.9	27%	0.273	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	120.1	-175.1	-178.8	0	0	0	0	109.8	A54 P65 V66 Q68	A54-V56 HydrophobicContact CB-CG2 4.48Å; V56-P65 WeakPolarHBondContact O-CA 3.13Å; V56-P65 WeakPolarHBondContact O-CB 3.48Å; V56-V66 PolarHBondContact N-O 3Å; V56-V66 PolarHBondContact O-N 3.28Å; V56-Q68 HydrophobicContact CB-CG 4.39Å; V56-Q68 HydrophobicContact CG2-CG 4.01Å
57	P	92.7	Very high	92.8	Very high	102 Å²	102	61.5 Å²	61.5	66%	0.662	32%	0.323	S	S	*	.			trans	-71.8	144.9	171.9	30.9	-33.4	0	0	0	110.4
58	L	90.3	Very high	92.9	Very high	24 Å²	24	56.9 Å²	56.9	13%	0.126	30%	0.302	C	S	.	.			trans	-92.5	150.2	175.5	-70.6	178.4	0	0	0	111.1	S60 L63 V66 S206	L58-S60 PolarHBondContact O-N 2.94Å; L58-L63 HydrophobicContact CB-CB 4.12Å; L58-L63 HydrophobicContact CD1-CB 3.76Å; L58-L63 HydrophobicContact CD1-CD1 4.01Å; L58-V66 HydrophobicContact CD1-CG2 4.04Å; L58-V66 HydrophobicContact CG-CG2 4.49Å; L58-S206 VanDerWaalsContact CD1-CB 3.47Å
59	P	87	Confident	93	Very high	139 Å²	139	56 Å²	56	90%	0.903	30%	0.298	S	S	*	.	S	Bend	trans	-65.5	-2.2	-179.5	-21.3	32.9	0	0	0	115.5
60	S	84.5	Confident	93	Very high	49 Å²	49	55.9 Å²	55.9	34%	0.343	30%	0.295	S	S	.	.	S	Bend	trans	-105.1	135.3	-178.9	177.9	0	0	0	0	110.2	L58 I62 L63	L58-S60 PolarHBondContact O-N 2.94Å; S60-I62 PolarHBondContact O-N 2.87Å; S60-I62 PolarHBondContact OG-N 3.28Å; S60-L63 PolarHBondContact O-N 2.83Å
61	E	80.7	Confident	93	Very high	201 Å²	201	51.1 Å²	51.1	94%	0.939	28%	0.276	S	S	*	.	S	Bend	trans	-69.1	-16.1	175.2	-61.4	-177.8	174.6	0	0	113.4
62	I	83.9	Confident	93	Very high	127 Å²	127	51.1 Å²	51.1	65%	0.651	28%	0.276	S	S	*	.	S	Bend	trans	-89.5	-31.5	-178.5	-55.7	173.4	0	0	0	110.9	S60	S60-I62 PolarHBondContact O-N 2.87Å; S60-I62 PolarHBondContact OG-N 3.28Å
63	L	87.9	Confident	93	Very high	36 Å²	36	47.2 Å²	47.2	19%	0.188	26%	0.263	C	S	.	.	S	Bend	trans	-87.4	128.1	-175.7	-62.4	179.6	0	0	0	110.2	L58 S60 I203 Y207	L58-L63 HydrophobicContact CB-CB 4.12Å; L58-L63 HydrophobicContact CD1-CB 3.76Å; L58-L63 HydrophobicContact CD1-CD1 4.01Å; S60-L63 PolarHBondContact O-N 2.83Å; L63-I203 HydrophobicContact CD1-CG2 4.15Å; L63-Y207 HydrophobicContact CD2-CD2 4.21Å
64	G	88.9	Confident	93.1	Very high	5 Å²	5	47.1 Å²	47.1	5%	0.052	26%	0.262	C	S	.	.	P	Polyproline II helix	trans	-66.9	158.1	172.7	0	0	0	0	0	111.9	S206	G64-S206 PolarHBondContact N-OG 3.26Å; G64-S206 PolarHBondContact O-OG 2.9Å
65	P	93.4	Very high	93.2	Very high	33 Å²	33	45.7 Å²	45.7	21%	0.214	25%	0.251	C	S	.	.	P	Polyproline II helix	trans	-62.2	163.8	174.2	26	-29.6	0	0	0	111.6	R55 V56 T150	R55-P65 HydrophobicContact CG-CB 4.06Å; V56-P65 WeakPolarHBondContact O-CA 3.13Å; V56-P65 WeakPolarHBondContact O-CB 3.48Å; P65-T150 WeakPolarHBondContact CD-OG1 3.18Å; P65-T150 HydrophobicContact CG-CG2 4.2Å; P65-T150 WeakPolarHBondContact CG-OG1 3.29Å; P65-T150 WeakPolarHBondContact O-CG2 3.45Å; P65-T150 PolarHBondContact O-N 3.12Å; P65-T150 VanDerWaalsContact O-N 3.1Å; P65-T150 PolarHBondContact O-OG1 3.27Å
66	V	95.8	Very high	93.3	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	132.8	-178.8	176.6	0	0	0	0	109.3	V56 L58 Q68 Y147 V148 S202	V56-V66 PolarHBondContact N-O 3Å; V56-V66 PolarHBondContact O-N 3.28Å; L58-V66 HydrophobicContact CD1-CG2 4.04Å; L58-V66 HydrophobicContact CG-CG2 4.49Å; V66-Q68 HydrophobicContact CG1-CG 4.23Å; V66-Y147 HydrophobicContact CG1-CD1 4.48Å; V66-V148 CarbonylContact C-O 3.58Å; V66-V148 WeakPolarHBondContact CA-O 3.46Å; V66-V148 WeakPolarHBondContact CG1-O 3.36Å; V66-S202 WeakPolarHBondContact CG2-O 3.45Å
67	D	97.3	Very high	93.5	Very high	17 Å²	17	40.1 Å²	40.1	9%	0.091	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	115.1	168.7	-70.4	-21.7	0	0	0	108.8	P42 R55 Y69 V148	P42-D67 HydrophobicContact CB-CB 4.16Å; P42-D67 HydrophobicContact CG-CB 4.02Å; R55-D67 VanDerWaalsContact CB-OD1 3.27Å; R55-D67 WeakPolarHBondContact CB-OD1 3.5Å; R55-D67 WeakPolarHBondContact CG-OD1 3.27Å; R55-D67 IonicContact CZ-OD1 2.79Å; R55-D67 IonicContact CZ-OD2 2.67Å; R55-D67 IonicContact NE-OD1 2.69Å; R55-D67 PolarHBondContact NE-OD1 3.2Å; R55-D67 IonicContact NE-OD2 3.71Å; R55-D67 IonicContact NH2-OD1 3.36Å; R55-D67 PolarHBondContact NH2-OD1 3.33Å; R55-D67 IonicContact NH2-OD2 3.67Å; R55-D67 PolarHBondContact NH2-OD2 3.18Å; D67-Y69 HydrophobicContact CB-CE2 4.06Å; D67-V148 HydrophobicContact CB-CB 4.28Å; D67-V148 PolarHBondContact N-O 3.27Å; D67-V148 PolarHBondContact O-N 2.69Å
68	Q	98	Very high	93.8	Very high	25 Å²	25	35.6 Å²	35.6	12%	0.117	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	132	-179.5	-61.9	-176.1	-2.9	0	0	110.6	G53 A54 V56 V66 L70 V146 Y147 S202	G53-Q68 CarbonylContact C-O 3.51Å; G53-Q68 WeakPolarHBondContact CA-O 3.22Å; A54-Q68 PolarHBondContact N-O 2.9Å; A54-Q68 PolarHBondContact O-N 3.47Å; V56-Q68 HydrophobicContact CB-CG 4.39Å; V56-Q68 HydrophobicContact CG2-CG 4.01Å; V66-Q68 HydrophobicContact CG1-CG 4.23Å; Q68-L70 HydrophobicContact CB-CD2 4.21Å; Q68-L70 HydrophobicContact CB-CG 4.36Å; Q68-V146 WeakPolarHBondContact CA-O 3.43Å; Q68-Y147 HydrophobicContact CG-CD1 3.89Å; Q68-Y147 HydrophobicContact CG-CE1 4.16Å; Q68-S202 PolarHBondContact NE2-OG 3.33Å
69	Y	98.5	Very high	94.1	Very high	7 Å²	7	38.5 Å²	38.5	3%	0.027	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	98.2	170.9	-57	-98.4	0	0	0	108.1	P42 V44 L51 D67 A99 N145 V146 V148 F255	P42-Y69 WeakPolarHBondContact CB-OH 3.34Å; V44-Y69 HydrophobicContact CB-CE1 4.14Å; V44-Y69 HydrophobicContact CG2-CE1 4.19Å; V44-Y69 WeakPolarHBondContact CG2-OH 3.17Å; L51-Y69 HydrophobicContact CB-CD1 4.19Å; D67-Y69 HydrophobicContact CB-CE2 4.06Å; Y69-A99 CarbonylContact C-O 3.52Å; Y69-A99 WeakPolarHBondContact CA-O 3.23Å; Y69-N145 CarbonylContact O-C 3.56Å; Y69-N145 VanDerWaalsContact O-CA 3.29Å; Y69-N145 WeakPolarHBondContact O-CA 3.4Å; Y69-V146 HydrophobicContact CD2-CB 4.41Å; Y69-V146 PolarHBondContact N-O 2.88Å; Y69-V146 PolarHBondContact O-N 3.26Å; Y69-V148 HydrophobicContact CD2-CG2 4.41Å; Y69-V148 HydrophobicContact CE2-CG2 4.17Å; Y69-F255 AromaticContact CD1-CE1 3.99Å; Y69-F255 HydrophobicContact CD1-CE1 3.99Å; Y69-F255 AromaticContact CD2-CD1 3.87Å; Y69-F255 HydrophobicContact CD2-CD1 3.87Å; Y69-F255 AromaticContact CD2-CE1 3.68Å; Y69-F255 HydrophobicContact CD2-CE1 3.68Å; Y69-F255 HydrophobicContact CE1-CE1 4.19Å; Y69-F255 AromaticContact CE2-CD1 3.79Å; Y69-F255 HydrophobicContact CE2-CD1 3.79Å; Y69-F255 AromaticContact CE2-CE1 3.91Å; Y69-F255 HydrophobicContact CE2-CE1 3.91Å; Y69-F255 HydrophobicContact CG-CD1 4.39Å; Y69-F255 AromaticContact CG-CE1 3.73Å; Y69-F255 HydrophobicContact CG-CE1 3.73Å
70	L	98.1	Very high	94.5	Very high	11 Å²	11	34.2 Å²	34.2	6%	0.058	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	138	-174.1	-51	-177.4	0	0	0	110.4	Q68 A99 H101 F102 N145 Y147	Q68-L70 HydrophobicContact CB-CD2 4.21Å; Q68-L70 HydrophobicContact CB-CG 4.36Å; L70-A99 PolarHBondContact N-O 3.05Å; L70-A99 CarbonylContact O-C 3.52Å; L70-A99 WeakPolarHBondContact O-CA 3.29Å; L70-A99 WeakPolarHBondContact O-CB 3.41Å; L70-H101 CarbonylContact C-O 3.56Å; L70-H101 VanDerWaalsContact CB-O 3.31Å; L70-H101 WeakPolarHBondContact CB-O 3.46Å; L70-F102 HydrophobicContact CB-CD1 4.36Å; L70-F102 HydrophobicContact CD1-CD1 4.21Å; L70-F102 HydrophobicContact CD1-CE1 4.06Å; L70-F102 HydrophobicContact CD1-CE2 4.44Å; L70-F102 HydrophobicContact CD1-CG 4.46Å; L70-F102 HydrophobicContact CD1-CZ 4.18Å; L70-F102 HydrophobicContact CD2-CD1 4.32Å; L70-F102 HydrophobicContact CD2-CE1 3.82Å; L70-F102 HydrophobicContact CD2-CZ 4.41Å; L70-F102 HydrophobicContact CG-CE1 4.4Å; L70-N145 WeakPolarHBondContact CA-OD1 3.39Å; L70-N145 HydrophobicContact CD2-CB 3.9Å; L70-Y147 HydrophobicContact CD2-CE1 4.31Å
71	G	97.4	Very high	95.1	Very high	8 Å²	8	40.3 Å²	40.3	8%	0.082	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	71.7	40	176.7	0	0	0	0	0	114.5	Y143 L144 N145	G71-Y143 VanDerWaalsContact O-CD1 3.32Å; G71-Y143 WeakPolarHBondContact O-CD1 3.25Å; G71-L144 PolarHBondContact N-O 3.32Å; G71-N145 PolarHBondContact N-OD1 2.93Å
72	V	98.5	Very high	95.8	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	120.2	175.9	-176.2	0	0	0	0	109.6	L51 Y74 A99 Y143 L144 W247	L51-V72 HydrophobicContact CD1-CB 4.45Å; L51-V72 HydrophobicContact CD1-CG1 3.62Å; L51-V72 HydrophobicContact CD1-CG2 3.95Å; L51-V72 HydrophobicContact CD2-CG1 4.42Å; V72-Y74 PolarHBondContact O-N 3Å; V72-A99 HydrophobicContact CG2-CB 4.1Å; V72-Y143 CarbonylContact O-C 3.57Å; V72-Y143 VanDerWaalsContact O-CA 3.32Å; V72-Y143 WeakPolarHBondContact O-CA 3.43Å; V72-L144 HydrophobicContact CB-CD1 3.89Å; V72-L144 HydrophobicContact CB-CG 4.46Å; V72-L144 HydrophobicContact CG1-CD1 4.33Å; V72-L144 PolarHBondContact N-O 3.42Å; V72-L144 PolarHBondContact O-N 2.87Å; V72-W247 HydrophobicContact CG1-CH2 3.67Å; V72-W247 HydrophobicContact CG1-CZ2 3.43Å; V72-W247 VanDerWaalsContact CG1-CZ2 3.43Å
73	P	98.4	Very high	96.5	Very high	11 Å²	11	33.1 Å²	33.1	7%	0.071	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	124.7	-179.8	28.2	-32.8	0	0	0	110.3	P90 W93 Y143	P73-P90 HydrophobicContact CB-CB 4.29Å; P73-W93 HydrophobicContact CG-CH2 4.17Å; P73-W93 HydrophobicContact CG-CZ3 3.81Å; P73-Y143 HydrophobicContact CB-CD1 3.99Å; P73-Y143 HydrophobicContact CB-CE1 3.8Å; P73-Y143 HydrophobicContact CG-CE1 4.47Å
74	Y	98.6	Very high	96.9	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	18%	0.183	C	C	.	.			trans	-105.7	-8.1	176	71.3	-102.5	0	0	0	113.2	V72 P90 L142 Y143 L144 N216 D240 Q243 A244	V72-Y74 PolarHBondContact O-N 3Å; Y74-P90 WeakPolarHBondContact O-CD 3.19Å; Y74-L142 WeakPolarHBondContact CD1-O 3.42Å; Y74-L142 HydrophobicContact CE1-CB 4.19Å; Y74-L142 HydrophobicContact CE2-CB 4.22Å; Y74-L142 PolarHBondContact N-O 2.98Å; Y74-L142 WeakPolarHBondContact OH-CD2 3.42Å; Y74-Y143 WeakPolarHBondContact CE1-O 3.4Å; Y74-L144 HydrophobicContact CD1-CB 4.09Å; Y74-L144 HydrophobicContact CD1-CD2 3.95Å; Y74-L144 HydrophobicContact CD1-CG 4.09Å; Y74-L144 HydrophobicContact CG-CD2 4.1Å; Y74-N216 VanDerWaalsContact CE1-O 3.31Å; Y74-N216 WeakPolarHBondContact CE1-O 3.32Å; Y74-N216 PolarHBondContact OH-O 2.81Å; Y74-D240 VanDerWaalsContact CE2-O 3.27Å; Y74-D240 WeakPolarHBondContact CE2-O 3.38Å; Y74-Q243 HydrophobicContact CD2-CB 4.44Å; Y74-Q243 HydrophobicContact CD2-CG 4.1Å; Y74-Q243 HydrophobicContact CE2-CB 4.42Å; Y74-Q243 HydrophobicContact CE2-CG 4.43Å; Y74-Q243 PolarHBondContact O-NE2 3.42Å; Y74-A244 HydrophobicContact CD1-CB 4.13Å; Y74-A244 HydrophobicContact CD2-CB 3.69Å; Y74-A244 HydrophobicContact CE1-CB 4.15Å; Y74-A244 HydrophobicContact CE2-CB 3.76Å; Y74-A244 HydrophobicContact CG-CB 3.9Å
75	A	98.5	Very high	97.3	Very high	3 Å²	3	38.1 Å²	38.1	3%	0.025	20%	0.202	C	C	.	.	S	Bend	trans	-148.7	163.7	177.5	0	0	0	0	0	110.9	P87 E88 L142 Q243	A75-P87 HydrophobicContact CB-CB 4.02Å; A75-E88 CarbonylContact C-O 3.52Å; A75-E88 WeakPolarHBondContact CA-O 3.29Å; A75-E88 VanDerWaalsContact CB-O 3.32Å; A75-E88 WeakPolarHBondContact CB-O 3.5Å; A75-L142 HydrophobicContact CB-CB 3.95Å; A75-L142 HydrophobicContact CB-CD1 3.65Å; A75-L142 HydrophobicContact CB-CG 4.46Å; A75-Q243 HydrophobicContact CB-CG 3.94Å
76	A	98.1	Very high	97.5	Very high	8 Å²	8	40.2 Å²	40.2	7%	0.066	22%	0.215	C	C	.	.			trans	-69	148.7	170.1	0	0	0	0	0	111	E88	A76-E88 HydrophobicContact CB-CB 4.27Å; A76-E88 PolarHBondContact N-O 3.34Å
77	P	98.1	Very high	97.6	Very high	37 Å²	37	41.2 Å²	41.2	24%	0.24	22%	0.222	C	C	.	.			trans	-57.1	126.8	178.6	-26.2	34.9	0	0	0	112.2	I79 D140	P77-I79 HydrophobicContact CB-CD1 4.25Å; P77-I79 HydrophobicContact CB-CG1 4.15Å; P77-I79 HydrophobicContact CB-CG2 4.33Å; P77-I79 PolarHBondContact O-N 3.31Å; P77-D140 HydrophobicContact CB-CB 4.03Å; P77-D140 HydrophobicContact CG-CB 4.47Å; P77-D140 WeakPolarHBondContact CG-OD1 3.49Å
78	P	97.4	Very high	97.6	Very high	7 Å²	7	45 Å²	45	5%	0.045	24%	0.239	C	C	.	.			trans	-83.8	48.6	-175.9	35.9	-37.7	0	0	0	112.2	E139 L142 R218	P78-E139 WeakPolarHBondContact CD-O 3.31Å; P78-E139 WeakPolarHBondContact CG-O 3.08Å; P78-L142 HydrophobicContact CB-CD1 4.21Å; P78-L142 HydrophobicContact CG-CD1 3.83Å; P78-L142 HydrophobicContact CG-CG 3.94Å; P78-R218 HydrophobicContact CG-CG 4.22Å
79	I	97.3	Very high	97.6	Very high	84 Å²	84	47.6 Å²	47.6	43%	0.431	26%	0.258	S	S	.	.			trans	-102.8	156.6	-173.5	63.1	177.1	0	0	0	112.3	P77 E81 K82 E139	P77-I79 HydrophobicContact CB-CD1 4.25Å; P77-I79 HydrophobicContact CB-CG1 4.15Å; P77-I79 HydrophobicContact CB-CG2 4.33Å; P77-I79 PolarHBondContact O-N 3.31Å; I79-E81 PolarHBondContact O-N 2.73Å; I79-K82 PolarHBondContact O-N 3.12Å; I79-K82 VanDerWaalsContact O-N 3.09Å; I79-E139 HydrophobicContact CG2-CB 3.68Å
80	G	95.9	Very high	97.5	Very high	50 Å²	50	47.5 Å²	47.5	52%	0.515	26%	0.258	S	S	.	.	G	3₁₀ helix	trans	59.3	-125.5	177.9	0	0	0	0	0	111.7	K82 R83	G80-K82 PolarHBondContact O-N 3.34Å; G80-K82 VanDerWaalsContact O-N 3.13Å; G80-R83 WeakPolarHBondContact O-CB 3.14Å; G80-R83 PolarHBondContact O-N 3.23Å
81	E	96.2	Very high	97.3	Very high	177 Å²	177	51.1 Å²	51.1	83%	0.827	28%	0.282	S	S	*	.	G	3₁₀ helix	trans	-63.4	-15.9	178.9	-57.2	-55.6	129.4	0	0	113.7	I79 R83 L85	I79-E81 PolarHBondContact O-N 2.73Å; E81-R83 VanDerWaalsContact C-N 3.3Å; E81-L85 WeakPolarHBondContact O-CD1 3.42Å
82	K	96.6	Very high	97.3	Very high	77 Å²	77	55 Å²	55	34%	0.335	31%	0.309	S	S	.	.	G	3₁₀ helix	trans	-85.2	-4.6	175.3	-58.5	-169.3	-177	-165.9	0	113.1	I79 G80 L85 E88	I79-K82 PolarHBondContact O-N 3.12Å; I79-K82 VanDerWaalsContact O-N 3.09Å; G80-K82 PolarHBondContact O-N 3.34Å; G80-K82 VanDerWaalsContact O-N 3.13Å; K82-L85 PolarHBondContact O-N 2.77Å; K82-E88 WeakPolarHBondContact CE-OE2 3.37Å; K82-E88 IonicContact NZ-OE2 3.24Å; K82-E88 PolarHBondContact NZ-OE2 2.96Å
83	R	97	Very high	97.2	Very high	100 Å²	100	57.1 Å²	57.1	38%	0.377	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	136.9	174	-166.4	-176.3	-69.1	157.7	-1.6	109.2	G80 E81 L85 E139 L222	G80-R83 WeakPolarHBondContact O-CB 3.14Å; G80-R83 PolarHBondContact O-N 3.23Å; E81-R83 VanDerWaalsContact C-N 3.3Å; R83-L85 PolarHBondContact O-N 2.79Å; R83-E139 IonicContact CZ-OE1 3.72Å; R83-E139 IonicContact CZ-OE2 3.42Å; R83-E139 IonicContact NE-OE1 3.31Å; R83-E139 IonicContact NE-OE2 3.45Å; R83-E139 PolarHBondContact NE-OE2 3.1Å; R83-E139 VanDerWaalsContact NE-OE2 3.12Å; R83-E139 IonicContact NH2-OE1 3.76Å; R83-E139 PolarHBondContact NH2-OE1 2.81Å; R83-E139 IonicContact NH2-OE2 2.81Å; R83-E139 PolarHBondContact NH2-OE2 3.23Å; R83-L222 HydrophobicContact CG-CD2 3.92Å
84	F	96.9	Very high	97.1	Very high	60 Å²	60	62.3 Å²	62.3	26%	0.263	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.4	25.8	-176.6	-42.8	-57.7	0	0	0	114.3	V221 L222 L225 Y236	F84-V221 HydrophobicContact CE1-CG1 4.33Å; F84-V221 WeakPolarHBondContact CE1-O 3.43Å; F84-V221 HydrophobicContact CZ-CG1 4.42Å; F84-L222 HydrophobicContact CE1-CD2 4.15Å; F84-L222 HydrophobicContact CZ-CD2 4.27Å; F84-L225 HydrophobicContact CD1-CB 4.36Å; F84-L225 HydrophobicContact CD1-CD2 4.4Å; F84-L225 HydrophobicContact CE1-CB 4.11Å; F84-L225 HydrophobicContact CE1-CD2 4.45Å; F84-Y236 HydrophobicContact CB-CD2 4.45Å; F84-Y236 HydrophobicContact CB-CE1 4.48Å; F84-Y236 HydrophobicContact CB-CE2 3.69Å; F84-Y236 HydrophobicContact CD1-CD2 4.25Å; F84-Y236 AromaticContact CD1-CE2 3.86Å; F84-Y236 HydrophobicContact CD1-CE2 3.86Å; F84-Y236 HydrophobicContact CG-CE2 4.25Å; F84-Y236 WeakPolarHBondContact O-CE1 3.45Å; F84-Y236 PolarHBondContact O-OH 2.95Å
85	L	97.3	Very high	97	Very high	86 Å²	86	64.9 Å²	64.9	45%	0.45	38%	0.379	S	S	.	.	S	Bend	trans	-114.4	158.6	168.7	-65.9	-176.4	0	0	0	111.2	E81 K82 R83 R218	E81-L85 WeakPolarHBondContact O-CD1 3.42Å; K82-L85 PolarHBondContact O-N 2.77Å; R83-L85 PolarHBondContact O-N 2.79Å; L85-R218 PolarHBondContact O-NH1 2.86Å; L85-R218 PolarHBondContact O-NH2 3.28Å
86	P	97.9	Very high	96.9	Very high	77 Å²	77	68.5 Å²	68.5	50%	0.5	40%	0.397	S	S	.	.			trans	-52.6	146	168.3	-25.2	35.3	0	0	0	111.7	L239	P86-L239 HydrophobicContact CB-CD1 4.05Å; P86-L239 HydrophobicContact CG-CD1 4.05Å
87	P	97.9	Very high	96.9	Very high	21 Å²	21	72.7 Å²	72.7	14%	0.136	41%	0.412	C	S	.	.			trans	-65.7	147.2	175.9	32.2	-37.5	0	0	0	110.7	A75 L142 L239 D240 Q243	A75-P87 HydrophobicContact CB-CB 4.02Å; P87-L142 HydrophobicContact CB-CD1 4.22Å; P87-L239 HydrophobicContact CG-CB 4.26Å; P87-L239 WeakPolarHBondContact CG-O 3.46Å; P87-D240 WeakPolarHBondContact CB-OD1 3.49Å; P87-D240 WeakPolarHBondContact CG-OD1 3.49Å; P87-Q243 HydrophobicContact CB-CB 4.11Å; P87-Q243 HydrophobicContact CB-CG 4.1Å; P87-Q243 HydrophobicContact CG-CB 3.56Å; P87-Q243 HydrophobicContact CG-CG 4.06Å
88	E	97.3	Very high	96.9	Very high	95 Å²	95	75.6 Å²	75.6	44%	0.444	43%	0.425	S	S	.	.			trans	-107.8	157	173.5	-66.7	177	173.1	0	0	109.9	A75 A76 K82	A75-E88 CarbonylContact C-O 3.52Å; A75-E88 WeakPolarHBondContact CA-O 3.29Å; A75-E88 VanDerWaalsContact CB-O 3.32Å; A75-E88 WeakPolarHBondContact CB-O 3.5Å; A76-E88 HydrophobicContact CB-CB 4.27Å; A76-E88 PolarHBondContact N-O 3.34Å; K82-E88 WeakPolarHBondContact CE-OE2 3.37Å; K82-E88 IonicContact NZ-OE2 3.24Å; K82-E88 PolarHBondContact NZ-OE2 2.96Å
89	P	96.9	Very high	96.9	Very high	80 Å²	80	75.3 Å²	75.3	52%	0.519	42%	0.424	S	S	.	.	P	Polyproline II helix	trans	-53.3	149.3	172.9	-26.2	35.1	0	0	0	112.7	F48	F48-P89 HydrophobicContact CE1-CB 4.26Å; F48-P89 HydrophobicContact CZ-CB 4.39Å
90	P	96.8	Very high	96.9	Very high	5 Å²	5	73.4 Å²	73.4	3%	0.032	42%	0.416	C	S	.	.	P	Polyproline II helix	trans	-68.2	147.3	-179.5	29.2	-31.2	0	0	0	110.2	F48 P73 Y74	F48-P90 HydrophobicContact CD1-CG 3.8Å; F48-P90 WeakPolarHBondContact CD1-O 3.39Å; F48-P90 HydrophobicContact CD2-CG 3.94Å; F48-P90 HydrophobicContact CE1-CG 3.77Å; F48-P90 VanDerWaalsContact CE1-O 3.3Å; F48-P90 WeakPolarHBondContact CE1-O 3.42Å; F48-P90 HydrophobicContact CE2-CG 3.91Å; F48-P90 HydrophobicContact CG-CG 3.89Å; F48-P90 HydrophobicContact CZ-CG 3.83Å; P73-P90 HydrophobicContact CB-CB 4.29Å; Y74-P90 WeakPolarHBondContact O-CD 3.19Å
91	P	94.2	Very high	96.8	Very high	87 Å²	87	78 Å²	78	57%	0.565	42%	0.423	S	S	*	.	P	Polyproline II helix	trans	-65.2	139	172.8	28	-33.5	0	0	0	110.1
92	S	96.9	Very high	96.8	Very high	91 Å²	91	73.7 Å²	73.7	64%	0.636	40%	0.402	S	S	*	.	P	Polyproline II helix	trans	-64.9	150.4	170.8	-54.3	0	0	0	0	111.1	F48	F48-S92 CarbonylContact O-C 3.17Å; F48-S92 WeakPolarHBondContact O-CA 3.43Å; F48-S92 WeakPolarHBondContact O-CB 3.3Å
93	W	96.7	Very high	96.4	Very high	44 Å²	44	70.7 Å²	70.7	17%	0.167	39%	0.39	C	S	.	.			trans	-125.7	147.5	177.2	59.4	86.9	0	0	0	112	F48 K50 L51 P73 R97	F48-W93 HydrophobicContact CB-CE3 4.18Å; F48-W93 HydrophobicContact CB-CH2 3.8Å; F48-W93 HydrophobicContact CB-CZ3 3.58Å; F48-W93 PolarHBondContact O-N 2.8Å; K50-W93 PolarHBondContact O-NE1 2.9Å; L51-W93 HydrophobicContact CD2-CH2 4.14Å; L51-W93 HydrophobicContact CD2-CZ2 3.53Å; L51-W93 HydrophobicContact CG-CZ2 3.94Å; P73-W93 HydrophobicContact CG-CH2 4.17Å; P73-W93 HydrophobicContact CG-CZ3 3.81Å; W93-R97 HydrophobicContact CD2-CB 4.47Å; W93-R97 HydrophobicContact CG-CB 4.46Å; W93-R97 HydrophobicContact CZ2-CB 4.45Å
94	S	96.3	Very high	96.3	Very high	119 Å²	119	68 Å²	68	83%	0.832	39%	0.386	S	S	*	.	S	Bend	trans	-85.1	149.2	170.9	59.2	0	0	0	0	111.4
95	G	96.4	Very high	96.2	Very high	54 Å²	54	65.3 Å²	65.3	56%	0.557	37%	0.374	S	S	*	.	S	Bend	trans	80.4	-152.3	178	0	0	0	0	0	113.1
96	I	97.6	Very high	96.2	Very high	79 Å²	79	61.3 Å²	61.3	41%	0.405	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	120.7	-177.8	-56.6	174	0	0	0	108.5	K50 R52	K50-I96 HydrophobicContact CB-CB 4.49Å; K50-I96 HydrophobicContact CB-CG1 4.06Å; K50-I96 HydrophobicContact CD-CG1 4.24Å; R52-I96 HydrophobicContact CB-CG2 3.64Å
97	R	97.5	Very high	96.1	Very high	97 Å²	97	59.8 Å²	59.8	37%	0.366	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	129.7	173.8	179.8	179.2	-177	100.9	0	109.5	K50 L51 R52 W93	K50-R97 PolarHBondContact O-N 2.83Å; L51-R97 CarbonylContact C-O 3.58Å; L51-R97 WeakPolarHBondContact CA-O 3.41Å; L51-R97 HydrophobicContact CD2-CB 4.16Å; L51-R97 HydrophobicContact CD2-CG 4.38Å; R52-R97 PolarHBondContact N-O 3.4Å; W93-R97 HydrophobicContact CD2-CB 4.47Å; W93-R97 HydrophobicContact CG-CB 4.46Å; W93-R97 HydrophobicContact CZ2-CB 4.45Å
98	N	97.8	Very high	95.7	Very high	97 Å²	97	60.1 Å²	60.1	52%	0.519	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	128.3	173.3	-70.4	-25.3	0	0	0	109.6
99	A	97.8	Very high	94.9	Very high	2 Å²	2	59.7 Å²	59.7	2%	0.017	34%	0.344	C	S	.	.			trans	-122.4	57.8	176.8	0	0	0	0	0	108.8	L51 R52 Y69 L70 V72	L51-A99 HydrophobicContact CD2-CB 4.27Å; R52-A99 PolarHBondContact O-N 2.88Å; Y69-A99 CarbonylContact C-O 3.52Å; Y69-A99 WeakPolarHBondContact CA-O 3.23Å; L70-A99 PolarHBondContact N-O 3.05Å; L70-A99 CarbonylContact O-C 3.52Å; L70-A99 WeakPolarHBondContact O-CA 3.29Å; L70-A99 WeakPolarHBondContact O-CB 3.41Å; V72-A99 HydrophobicContact CG2-CB 4.1Å
100	T	96.4	Very high	93.7	Very high	43 Å²	43	57.5 Å²	57.5	26%	0.264	33%	0.328	S	S	.	.	B	Isolated β-bridge	trans	-116.4	-4.1	-171.7	54.8	0	0	0	0	113.4	A54	A54-T100 HydrophobicContact CB-CG2 4.21Å
101	H	94.9	Very high	92	Very high	147 Å²	147	66.2 Å²	66.2	68%	0.681	37%	0.368	S	S	*	.	S	Bend	trans	-134.3	149.4	-176.9	-58.7	-45.9	0	0	0	109.9	L70	L70-H101 CarbonylContact C-O 3.56Å; L70-H101 VanDerWaalsContact CB-O 3.31Å; L70-H101 WeakPolarHBondContact CB-O 3.46Å
102	F	94.8	Very high	90.2	Very high	87 Å²	87	67.3 Å²	67.3	38%	0.382	37%	0.373	S	S	.	.	P	Polyproline II helix	trans	-62.4	142.7	176.5	-73.7	-58.6	0	0	0	111.1	L70 Y133 N197	L70-F102 HydrophobicContact CB-CD1 4.36Å; L70-F102 HydrophobicContact CD1-CD1 4.21Å; L70-F102 HydrophobicContact CD1-CE1 4.06Å; L70-F102 HydrophobicContact CD1-CE2 4.44Å; L70-F102 HydrophobicContact CD1-CG 4.46Å; L70-F102 HydrophobicContact CD1-CZ 4.18Å; L70-F102 HydrophobicContact CD2-CD1 4.32Å; L70-F102 HydrophobicContact CD2-CE1 3.82Å; L70-F102 HydrophobicContact CD2-CZ 4.41Å; L70-F102 HydrophobicContact CG-CE1 4.4Å; F102-Y133 HydrophobicContact CE2-CE1 4.39Å; F102-N197 HydrophobicContact CD1-CB 3.83Å; F102-N197 HydrophobicContact CE1-CB 4.13Å; F102-N197 HydrophobicContact CG-CB 4.1Å
103	P	89.9	Confident	88.2	Confident	13 Å²	13	64.3 Å²	64.3	8%	0.084	35%	0.353	C	S	.	.	P	Polyproline II helix	trans	-74.6	163.1	174.9	33.9	-35.1	0	0	0	110.5	Y143 N197	P103-Y143 HydrophobicContact CB-CD1 4.07Å; P103-Y143 HydrophobicContact CB-CD2 3.46Å; P103-Y143 VanDerWaalsContact CB-CD2 3.46Å; P103-Y143 HydrophobicContact CB-CE2 4.21Å; P103-Y143 HydrophobicContact CB-CG 3.41Å; P103-Y143 VanDerWaalsContact CB-CG 3.41Å; P103-Y143 VanDerWaalsContact CG-CB 3.45Å; P103-Y143 HydrophobicContact CG-CD2 4.25Å; P103-Y143 HydrophobicContact CG-CG 3.97Å; P103-N197 PolarHBondContact O-ND2 3.48Å
104	P	94.6	Very high	86.1	Confident	44 Å²	44	64.7 Å²	64.7	29%	0.286	36%	0.361	S	S	.	.	P	Polyproline II helix	trans	-51.6	146.2	163.8	-24.4	34.7	0	0	0	111.3	E136 N138	P104-E136 WeakPolarHBondContact CA-O 3.17Å; P104-E136 WeakPolarHBondContact CB-O 3.44Å; P104-N138 HydrophobicContact CB-CB 3.58Å; P104-N138 HydrophobicContact CG-CB 4.21Å
105	V	94.9	Very high	84.2	Confident	3 Å²	3	63.5 Å²	63.5	2%	0.018	35%	0.35	C	S	.	.	B	Isolated β-bridge	trans	-87	160.6	174.6	-59.8	0	0	0	0	110.6	Y133 I134 E136 P137 N138 T195	V105-Y133 WeakPolarHBondContact CG1-O 3.36Å; V105-I134 HydrophobicContact CG2-CB 4.39Å; V105-I134 HydrophobicContact CG2-CG2 4.13Å; V105-E136 PolarHBondContact N-O 3.44Å; V105-P137 HydrophobicContact CG2-CB 4.36Å; V105-P137 CarbonylContact O-C 3.59Å; V105-P137 VanDerWaalsContact O-CA 3.31Å; V105-P137 WeakPolarHBondContact O-CA 3.45Å; V105-N138 PolarHBondContact O-N 2.82Å; V105-T195 HydrophobicContact CG1-CG2 3.95Å; V105-T195 WeakPolarHBondContact CG1-OG1 3.32Å
106	C	96.6	Very high	82.3	Confident	3 Å²	3	67.5 Å²	67.5	2%	0.02	35%	0.354	C	S	.	.	P	Polyproline II helix	trans	-67	148.7	174.7	-61.4	0	0	0	0	111.1	Q108 C141 Y217 V219	C106-Q108 WeakPolarHBondContact O-CG 3.34Å; C106-Q108 PolarHBondContact O-N 3.29Å; C106-Q108 PolarHBondContact O-NE2 3.31Å; C106-C141 VanDerWaalsContact CA-CB 3.48Å; C106-C141 WeakPolarHBondContact CA-SG 3.46Å; C106-C141 HydrophobicContact CB-CB 3.83Å; C106-C141 WeakPolarHBondContact CB-SG 3.35Å; C106-C141 WeakPolarHBondContact SG-CB 3.24Å; C106-C141 CovalentContact SG-SG 2.04Å; C106-C141 PolarHBondContact SG-SG 3.23Å; C106-Y217 VanDerWaalsContact SG-C 3.57Å; C106-Y217 PolarHBondContact SG-O 2.77Å; C106-V219 HydrophobicContact CB-CG2 4Å
107	P	95.1	Very high	80.3	Confident	44 Å²	44	70.3 Å²	70.3	29%	0.286	38%	0.375	S	S	.	.	P	Polyproline II helix	trans	-60.8	123.1	-177.1	-23.8	36.7	0	0	0	111.7	P137 N138 E139 L222	P107-P137 HydrophobicContact CB-CB 4.45Å; P107-N138 VanDerWaalsContact CD-O 3.31Å; P107-N138 WeakPolarHBondContact CD-O 3.17Å; P107-E139 HydrophobicContact CG-CG 3.89Å; P107-L222 HydrophobicContact CB-CD1 4.14Å; P107-L222 HydrophobicContact CG-CD1 3.78Å
108	Q	90.3	Very high	78.5	Confident	29 Å²	29	72.3 Å²	72.3	14%	0.136	39%	0.39	C	S	.	.			trans	-151.8	154.9	-175.4	62.8	-166.4	-84.2	0	0	109.9	C106 I134 M192 E193 G194 V219	C106-Q108 WeakPolarHBondContact O-CG 3.34Å; C106-Q108 PolarHBondContact O-N 3.29Å; C106-Q108 PolarHBondContact O-NE2 3.31Å; Q108-I134 HydrophobicContact CG-CG2 3.54Å; Q108-M192 WeakPolarHBondContact CB-O 3.43Å; Q108-E193 HydrophobicContact CB-CB 4.34Å; Q108-E193 VanDerWaalsContact OE1-CA 3.32Å; Q108-G194 PolarHBondContact NE2-O 3.28Å; Q108-V219 HydrophobicContact CB-CG2 4.11Å
109	N	81.5	Confident	76.8	Confident	85 Å²	85	68.7 Å²	68.7	46%	0.455	37%	0.371	S	S	.	.			trans	-129.2	104.3	176.8	-174.6	-13.9	0	0	0	110	H111 T112 A113	N109-H111 WeakPolarHBondContact OD1-CB 3.18Å; N109-H111 PolarHBondContact OD1-N 3.22Å; N109-T112 WeakPolarHBondContact CB-OG1 3.3Å; N109-T112 PolarHBondContact ND2-OG1 2.9Å; N109-T112 PolarHBondContact O-OG1 2.94Å; N109-T112 PolarHBondContact OD1-N 2.94Å; N109-T112 PolarHBondContact OD1-OG1 3.15Å; N109-A113 PolarHBondContact O-N 2.92Å
110	I	70	Confident	75.1	Confident	34 Å²	34	70.6 Å²	70.6	17%	0.174	38%	0.383	C	S	.	.	G	3₁₀ helix	trans	-73.4	-29.2	-178.6	-54.4	171.4	0	0	0	111.4	T112 A113 L127 V130 I134	I110-T112 PolarHBondContact O-N 2.72Å; I110-A113 WeakPolarHBondContact O-CB 3.18Å; I110-A113 PolarHBondContact O-N 2.9Å; I110-L127 HydrophobicContact CG2-CD2 3.64Å; I110-V130 HydrophobicContact CD1-CG1 4.16Å; I110-I134 HydrophobicContact CD1-CB 3.97Å; I110-I134 HydrophobicContact CD1-CD1 3.31Å; I110-I134 HydrophobicContact CD1-CG1 4.19Å; I110-I134 HydrophobicContact CD1-CG2 3.82Å; I110-I134 HydrophobicContact CG1-CD1 4.17Å; I110-I134 HydrophobicContact CG1-CG2 4.31Å
111	H	62.2	Low	73.9	Confident	189 Å²	189	74 Å²	74	88%	0.875	40%	0.403	S	S	*	.	G	3₁₀ helix	trans	-69.9	-21.3	-179.2	-69.8	-67.2	0	0	0	113.1	N109	N109-H111 WeakPolarHBondContact OD1-CB 3.18Å; N109-H111 PolarHBondContact OD1-N 3.22Å
112	T	56.4	Low	72.6	Confident	109 Å²	109	73.1 Å²	73.1	67%	0.669	39%	0.394	S	S	*	.	G	3₁₀ helix	trans	-108.9	8.4	175.1	52.5	0	0	0	0	112.8	N109 I110	N109-T112 WeakPolarHBondContact CB-OG1 3.3Å; N109-T112 PolarHBondContact ND2-OG1 2.9Å; N109-T112 PolarHBondContact O-OG1 2.94Å; N109-T112 PolarHBondContact OD1-N 2.94Å; N109-T112 PolarHBondContact OD1-OG1 3.15Å; I110-T112 PolarHBondContact O-N 2.72Å
113	A	54.2	Low	71	Confident	28 Å²	28	69.3 Å²	69.3	23%	0.231	38%	0.377	C	S	.	.			trans	-71.7	149.3	-176.5	0	0	0	0	0	111.8	N109 I110	N109-A113 PolarHBondContact O-N 2.92Å; I110-A113 WeakPolarHBondContact O-CB 3.18Å; I110-A113 PolarHBondContact O-N 2.9Å
114	V	53.2	Low	69.6	Low	53 Å²	53	69.5 Å²	69.5	32%	0.321	38%	0.378	S	S	.	.	S	Bend	trans	-42	151.7	-176.3	-159.3	0	0	0	0	112.3	E116 M118 M192	V114-E116 PolarHBondContact O-N 3.4Å; V114-M118 HydrophobicContact CG1-SD 4.22Å; V114-M192 HydrophobicContact CG2-CG 4.47Å
115	P	55.3	Low	67.8	Low	94 Å²	94	70.6 Å²	70.6	61%	0.61	39%	0.391	S	S	*	.			trans	-48.8	138.6	-170.9	-28.8	34.7	0	0	0	112.9	V117 M118	P115-V117 HydrophobicContact CB-CG2 4.44Å; P115-V117 PolarHBondContact O-N 3.23Å; P115-M118 PolarHBondContact O-N 2.94Å
116	E	56.4	Low	66.4	Low	138 Å²	138	74.2 Å²	74.2	65%	0.645	41%	0.41	S	S	*	.	G	3₁₀ helix	trans	-41.6	-25.9	-178.9	-157.3	178.3	174.1	0	0	114.4	V114 M118 L119 T124	V114-E116 PolarHBondContact O-N 3.4Å; E116-M118 VanDerWaalsContact C-N 3.28Å; E116-M118 PolarHBondContact O-N 3.33Å; E116-L119 PolarHBondContact O-N 2.86Å; E116-T124 HydrophobicContact CG-CG2 3.71Å
117	V	57.1	Low	64.9	Low	138 Å²	138	78 Å²	78	84%	0.836	43%	0.43	S	S	*	.	G	3₁₀ helix	trans	-58.5	-26.6	177.3	-167.9	0	0	0	0	114.6	P115	P115-V117 HydrophobicContact CB-CG2 4.44Å; P115-V117 PolarHBondContact O-N 3.23Å
118	M	58.2	Low	63.3	Low	138 Å²	138	82.9 Å²	82.9	68%	0.68	45%	0.454	S	S	*	.	G	3₁₀ helix	trans	-94	-8.9	-178.9	-83.4	-171.5	170.7	0	0	114.7	V114 P115 E116	V114-M118 HydrophobicContact CG1-SD 4.22Å; P115-M118 PolarHBondContact O-N 2.94Å; E116-M118 VanDerWaalsContact C-N 3.28Å; E116-M118 PolarHBondContact O-N 3.33Å
119	L	63.7	Low	62.4	Low	22 Å²	22	85.9 Å²	85.9	12%	0.115	47%	0.47	C	S	.	.	S	Bend	trans	-101.7	149.2	-176.3	-69.3	170	0	0	0	111.2	E116 F123 T124 E193	E116-L119 PolarHBondContact O-N 2.86Å; L119-F123 HydrophobicContact CB-CD1 4.17Å; L119-F123 HydrophobicContact CD1-CD1 3.87Å; L119-F123 HydrophobicContact CD1-CE1 3.85Å; L119-F123 HydrophobicContact CD2-CD1 3.99Å; L119-F123 HydrophobicContact CD2-CE1 4.01Å; L119-F123 HydrophobicContact CG-CD1 4.24Å; L119-F123 HydrophobicContact CG-CE1 4.45Å; L119-T124 HydrophobicContact CB-CG2 3.42Å; L119-T124 VanDerWaalsContact CB-CG2 3.42Å; L119-T124 HydrophobicContact CD1-CG2 3.94Å; L119-T124 HydrophobicContact CG-CG2 4.33Å; L119-E193 HydrophobicContact CD2-CG 4.45Å; L119-E193 WeakPolarHBondContact CD2-OE1 3.32Å
120	P	61.3	Low	61.9	Low	41 Å²	41	82.2 Å²	82.2	27%	0.266	45%	0.45	S	S	.	.			trans	-60.8	142.9	174.1	-19.7	30.9	0	0	0	111.5	W122 F123 T124	P120-W122 HydrophobicContact CB-CD2 4.33Å; P120-W122 HydrophobicContact CB-CG 4.28Å; P120-W122 HydrophobicContact CB-CZ2 4.32Å; P120-W122 VanDerWaalsContact CB-NE1 3.3Å; P120-W122 HydrophobicContact CG-CZ2 4.25Å; P120-W122 PolarHBondContact O-N 3.16Å; P120-F123 HydrophobicContact CB-CB 4.29Å; P120-F123 HydrophobicContact CG-CB 4.42Å; P120-F123 WeakPolarHBondContact O-CA 3.42Å; P120-F123 VanDerWaalsContact O-CB 3.24Å; P120-F123 WeakPolarHBondContact O-CB 3.29Å; P120-F123 PolarHBondContact O-N 3.27Å; P120-T124 PolarHBondContact O-N 2.82Å; P120-T124 VanDerWaalsContact O-N 3.16Å
121	V	70.5	Confident	61.9	Low	115 Å²	115	82.4 Å²	82.4	70%	0.697	46%	0.457	S	S	*	.	H	α-helix	trans	-55.4	-38.4	-179.7	177.8	0	0	0	0	112.4	F123 T124 A125	V121-F123 PolarHBondContact O-N 2.79Å; V121-T124 PolarHBondContact O-N 3.1Å; V121-T124 PolarHBondContact O-OG1 3.21Å; V121-A125 HydrophobicContact CG1-CB 4.33Å; V121-A125 WeakPolarHBondContact O-CB 3.33Å; V121-A125 PolarHBondContact O-N 3.04Å
122	W	68.8	Low	62.7	Low	129 Å²	129	77.1 Å²	77.1	49%	0.489	44%	0.438	S	S	.	.	H	α-helix	trans	-67	-23.6	177	62.9	-98.6	0	0	0	113.4	P120 I199	P120-W122 HydrophobicContact CB-CD2 4.33Å; P120-W122 HydrophobicContact CB-CG 4.28Å; P120-W122 HydrophobicContact CB-CZ2 4.32Å; P120-W122 VanDerWaalsContact CB-NE1 3.3Å; P120-W122 HydrophobicContact CG-CZ2 4.25Å; P120-W122 PolarHBondContact O-N 3.16Å; W122-I199 HydrophobicContact CH2-CD1 4.23Å
123	F	60.5	Low	63.8	Low	6 Å²	6	76.3 Å²	76.3	3%	0.026	42%	0.423	C	S	.	.	H	α-helix	trans	-79.7	-39.8	177	-173.5	-83.5	0	0	0	110.7	L119 P120 V121 V130 E193 M198	L119-F123 HydrophobicContact CB-CD1 4.17Å; L119-F123 HydrophobicContact CD1-CD1 3.87Å; L119-F123 HydrophobicContact CD1-CE1 3.85Å; L119-F123 HydrophobicContact CD2-CD1 3.99Å; L119-F123 HydrophobicContact CD2-CE1 4.01Å; L119-F123 HydrophobicContact CG-CD1 4.24Å; L119-F123 HydrophobicContact CG-CE1 4.45Å; P120-F123 HydrophobicContact CB-CB 4.29Å; P120-F123 HydrophobicContact CG-CB 4.42Å; P120-F123 WeakPolarHBondContact O-CA 3.42Å; P120-F123 VanDerWaalsContact O-CB 3.24Å; P120-F123 WeakPolarHBondContact O-CB 3.29Å; P120-F123 PolarHBondContact O-N 3.27Å; V121-F123 PolarHBondContact O-N 2.79Å; F123-V130 HydrophobicContact CD2-CG1 4.22Å; F123-V130 HydrophobicContact CD2-CG2 4.29Å; F123-V130 HydrophobicContact CE1-CG1 4.28Å; F123-V130 HydrophobicContact CE2-CG1 3.74Å; F123-V130 HydrophobicContact CG-CG2 4.49Å; F123-V130 HydrophobicContact CZ-CG1 3.78Å; F123-E193 HydrophobicContact CE1-CG 4.44Å; F123-E193 HydrophobicContact CZ-CG 4.15Å; F123-M198 HydrophobicContact CD2-CE 4.21Å; F123-M198 HydrophobicContact CD2-SD 3.94Å; F123-M198 HydrophobicContact CE2-CE 3.71Å; F123-M198 HydrophobicContact CE2-SD 3.57Å; F123-M198 VanDerWaalsContact CE2-SD 3.57Å
124	T	60.4	Low	65.1	Low	18 Å²	18	75.6 Å²	75.6	11%	0.11	42%	0.416	C	S	.	.	H	α-helix	trans	-86.5	-31.5	-178.8	58.9	0	0	0	0	113.5	E116 L119 P120 V121 N126 L127	E116-T124 HydrophobicContact CG-CG2 3.71Å; L119-T124 HydrophobicContact CB-CG2 3.42Å; L119-T124 VanDerWaalsContact CB-CG2 3.42Å; L119-T124 HydrophobicContact CD1-CG2 3.94Å; L119-T124 HydrophobicContact CG-CG2 4.33Å; P120-T124 PolarHBondContact O-N 2.82Å; P120-T124 VanDerWaalsContact O-N 3.16Å; V121-T124 PolarHBondContact O-N 3.1Å; V121-T124 PolarHBondContact O-OG1 3.21Å; T124-N126 VanDerWaalsContact C-N 3.3Å; T124-N126 PolarHBondContact O-N 2.88Å; T124-L127 WeakPolarHBondContact O-CG 3.34Å
125	A	58.1	Low	65.9	Low	66 Å²	66	79.6 Å²	79.6	55%	0.545	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-18.7	-178.9	0	0	0	0	0	113.7	V121	V121-A125 HydrophobicContact CG1-CB 4.33Å; V121-A125 WeakPolarHBondContact O-CB 3.33Å; V121-A125 PolarHBondContact O-N 3.04Å
126	N	65.8	Low	67.2	Low	80 Å²	80	82.2 Å²	82.2	43%	0.428	44%	0.435	S	S	.	.	T	Hydrogen-bonded Turn	trans	-126.6	43.4	-176.9	-70	77.9	0	0	0	111.5	T124 D128 I129 V130	T124-N126 VanDerWaalsContact C-N 3.3Å; T124-N126 PolarHBondContact O-N 2.88Å; N126-D128 PolarHBondContact O-N 3.39Å; N126-D128 VanDerWaalsContact O-N 3.12Å; N126-I129 HydrophobicContact CB-CB 4.33Å; N126-I129 HydrophobicContact CB-CD1 4.27Å; N126-I129 HydrophobicContact CB-CG1 4.47Å; N126-I129 PolarHBondContact O-N 3.24Å; N126-V130 PolarHBondContact O-N 3.44Å
127	L	63.5	Low	68.9	Low	82 Å²	82	78.9 Å²	78.9	43%	0.429	43%	0.425	S	S	.	.	H	α-helix	trans	-52.2	-35	-178.6	-82.3	164.1	0	0	0	113.4	I110 T124 I129 V130 A131	I110-L127 HydrophobicContact CG2-CD2 3.64Å; T124-L127 WeakPolarHBondContact O-CG 3.34Å; L127-I129 VanDerWaalsContact C-N 3.34Å; L127-I129 PolarHBondContact O-N 2.93Å; L127-V130 PolarHBondContact O-N 3.36Å; L127-A131 WeakPolarHBondContact O-CB 3.25Å; L127-A131 PolarHBondContact O-N 2.82Å
128	D	62.9	Low	70.7	Confident	147 Å²	147	76.2 Å²	76.2	79%	0.786	41%	0.406	S	S	*	.	H	α-helix	trans	-64.1	-37.5	176.8	-65.2	-30	0	0	0	112.6	N126 T132	N126-D128 PolarHBondContact O-N 3.39Å; N126-D128 VanDerWaalsContact O-N 3.12Å; D128-T132 WeakPolarHBondContact O-CG2 3.26Å; D128-T132 PolarHBondContact O-N 3.08Å
129	I	70.2	Confident	72.6	Confident	92 Å²	92	72 Å²	72	47%	0.472	39%	0.385	S	S	.	.	H	α-helix	trans	-74.6	-44.6	176.4	-60	179.5	0	0	0	109.7	N126 L127 A131 T132 Y133	N126-I129 HydrophobicContact CB-CB 4.33Å; N126-I129 HydrophobicContact CB-CD1 4.27Å; N126-I129 HydrophobicContact CB-CG1 4.47Å; N126-I129 PolarHBondContact O-N 3.24Å; L127-I129 VanDerWaalsContact C-N 3.34Å; L127-I129 PolarHBondContact O-N 2.93Å; I129-A131 PolarHBondContact O-N 3.23Å; I129-T132 WeakPolarHBondContact O-CB 3.5Å; I129-T132 PolarHBondContact O-N 3.31Å; I129-T132 PolarHBondContact O-OG1 3.19Å; I129-Y133 HydrophobicContact CG2-CE2 4.2Å; I129-Y133 WeakPolarHBondContact O-CD2 3.46Å
130	V	71.7	Confident	74.2	Confident	7 Å²	7	73 Å²	73	4%	0.042	39%	0.39	C	S	.	.	H	α-helix	trans	-59.4	-40.1	176.6	171.1	0	0	0	0	111	I110 F123 N126 L127 T132 Y133 I134 M198	I110-V130 HydrophobicContact CD1-CG1 4.16Å; F123-V130 HydrophobicContact CD2-CG1 4.22Å; F123-V130 HydrophobicContact CD2-CG2 4.29Å; F123-V130 HydrophobicContact CE1-CG1 4.28Å; F123-V130 HydrophobicContact CE2-CG1 3.74Å; F123-V130 HydrophobicContact CG-CG2 4.49Å; F123-V130 HydrophobicContact CZ-CG1 3.78Å; N126-V130 PolarHBondContact O-N 3.44Å; L127-V130 PolarHBondContact O-N 3.36Å; V130-T132 PolarHBondContact O-N 2.92Å; V130-Y133 PolarHBondContact O-N 2.85Å; V130-I134 HydrophobicContact CG1-CD1 3.72Å; V130-I134 PolarHBondContact O-N 2.96Å; V130-M198 HydrophobicContact CG1-SD 4.02Å; V130-M198 HydrophobicContact CG2-SD 4.5Å
131	A	70.1	Confident	75.9	Confident	38 Å²	38	71.1 Å²	71.1	31%	0.314	38%	0.378	S	S	.	.	H	α-helix	trans	-56.7	-37.9	175.6	0	0	0	0	0	111.2	L127 I129 Y133 I134 Q135	L127-A131 WeakPolarHBondContact O-CB 3.25Å; L127-A131 PolarHBondContact O-N 2.82Å; I129-A131 PolarHBondContact O-N 3.23Å; A131-Y133 PolarHBondContact O-N 3.24Å; A131-I134 CarbonylContact O-C 3.58Å; A131-I134 PolarHBondContact O-N 2.87Å; A131-Q135 WeakPolarHBondContact O-CG 3.38Å; A131-Q135 PolarHBondContact O-N 3.04Å; A131-Q135 VanDerWaalsContact O-N 3.17Å
132	T	78.3	Confident	77.3	Confident	79 Å²	79	65.7 Å²	65.7	49%	0.485	35%	0.345	S	S	.	.	H	α-helix	trans	-59	-31.1	176.6	71.2	0	0	0	0	114	D128 I129 V130 I134	D128-T132 WeakPolarHBondContact O-CG2 3.26Å; D128-T132 PolarHBondContact O-N 3.08Å; I129-T132 WeakPolarHBondContact O-CB 3.5Å; I129-T132 PolarHBondContact O-N 3.31Å; I129-T132 PolarHBondContact O-OG1 3.19Å; V130-T132 PolarHBondContact O-N 2.92Å; T132-I134 VanDerWaalsContact C-N 3.33Å
133	Y	80.1	Confident	78.7	Confident	91 Å²	91	60.6 Å²	60.6	36%	0.357	33%	0.326	S	S	.	.	H	α-helix	trans	-82.1	-12.3	177.6	-71.1	-83.5	0	0	0	113.3	F102 V105 I129 V130 A131 N197 M198	F102-Y133 HydrophobicContact CE2-CE1 4.39Å; V105-Y133 WeakPolarHBondContact CG1-O 3.36Å; I129-Y133 HydrophobicContact CG2-CE2 4.2Å; I129-Y133 WeakPolarHBondContact O-CD2 3.46Å; V130-Y133 PolarHBondContact O-N 2.85Å; A131-Y133 PolarHBondContact O-N 3.24Å; Y133-N197 HydrophobicContact CD1-CB 4.17Å; Y133-N197 WeakPolarHBondContact CE1-O 3.35Å; Y133-M198 HydrophobicContact CD1-CG 4.48Å; Y133-M198 HydrophobicContact CD2-CG 4.12Å; Y133-M198 HydrophobicContact CG-CG 3.9Å
134	I	81.3	Confident	80.5	Confident	14 Å²	14	60.3 Å²	60.3	7%	0.072	33%	0.325	C	S	.	.	H	α-helix	trans	-119	7.6	-170.5	-61.6	164.7	0	0	0	111.8	V105 Q108 I110 V130 A131 T132 E136 T195 M198	V105-I134 HydrophobicContact CG2-CB 4.39Å; V105-I134 HydrophobicContact CG2-CG2 4.13Å; Q108-I134 HydrophobicContact CG-CG2 3.54Å; I110-I134 HydrophobicContact CD1-CB 3.97Å; I110-I134 HydrophobicContact CD1-CD1 3.31Å; I110-I134 HydrophobicContact CD1-CG1 4.19Å; I110-I134 HydrophobicContact CD1-CG2 3.82Å; I110-I134 HydrophobicContact CG1-CD1 4.17Å; I110-I134 HydrophobicContact CG1-CG2 4.31Å; V130-I134 HydrophobicContact CG1-CD1 3.72Å; V130-I134 PolarHBondContact O-N 2.96Å; A131-I134 CarbonylContact O-C 3.58Å; A131-I134 PolarHBondContact O-N 2.87Å; T132-I134 VanDerWaalsContact C-N 3.33Å; I134-E136 VanDerWaalsContact C-N 3.26Å; I134-E136 PolarHBondContact O-N 2.83Å; I134-T195 HydrophobicContact CG1-CG2 4.16Å; I134-M198 HydrophobicContact CD1-SD 4.48Å
135	Q	69.4	Low	82.3	Confident	136 Å²	136	59.5 Å²	59.5	64%	0.636	32%	0.32	S	S	*	.	S	Bend	trans	-66.8	-20.6	-173.9	-55.8	-166.8	-16.4	0	0	114.7	A131 P137	A131-Q135 WeakPolarHBondContact O-CG 3.38Å; A131-Q135 PolarHBondContact O-N 3.04Å; A131-Q135 VanDerWaalsContact O-N 3.17Å; Q135-P137 VanDerWaalsContact C-CD 3.44Å; Q135-P137 WeakPolarHBondContact O-CD 3.29Å
136	E	83.1	Confident	84.2	Confident	150 Å²	150	56.3 Å²	56.3	70%	0.701	29%	0.294	S	S	*	.	S	Bend	trans	-124.6	70.9	-174.2	-63.2	-177.8	-175.1	0	0	111.7	P104 V105 I134	P104-E136 WeakPolarHBondContact CA-O 3.17Å; P104-E136 WeakPolarHBondContact CB-O 3.44Å; V105-E136 PolarHBondContact N-O 3.44Å; I134-E136 VanDerWaalsContact C-N 3.26Å; I134-E136 PolarHBondContact O-N 2.83Å
137	P	91.4	Very high	85.8	Confident	68 Å²	68	52.6 Å²	52.6	44%	0.442	27%	0.273	S	S	.	.	B	Isolated β-bridge	trans	-71.7	135.2	175.2	27.1	-30.7	0	0	0	111.5	V105 P107 Q135	V105-P137 HydrophobicContact CG2-CB 4.36Å; V105-P137 CarbonylContact O-C 3.59Å; V105-P137 VanDerWaalsContact O-CA 3.31Å; V105-P137 WeakPolarHBondContact O-CA 3.45Å; P107-P137 HydrophobicContact CB-CB 4.45Å; Q135-P137 VanDerWaalsContact C-CD 3.44Å; Q135-P137 WeakPolarHBondContact O-CD 3.29Å
138	N	96.1	Very high	87.4	Confident	81 Å²	81	49.4 Å²	49.4	43%	0.433	26%	0.257	S	S	.	.			trans	-143	145.7	173.3	-160.9	-49.8	0	0	0	109.9	P104 V105 P107 D140 C141	P104-N138 HydrophobicContact CB-CB 3.58Å; P104-N138 HydrophobicContact CG-CB 4.21Å; V105-N138 PolarHBondContact O-N 2.82Å; P107-N138 VanDerWaalsContact CD-O 3.31Å; P107-N138 WeakPolarHBondContact CD-O 3.17Å; N138-D140 PolarHBondContact O-N 2.79Å; N138-D140 PolarHBondContact OD1-N 3.31Å; N138-C141 WeakPolarHBondContact O-CB 3.45Å
139	E	97.3	Very high	89	Confident	50 Å²	50	42.6 Å²	42.6	23%	0.234	22%	0.221	C	C	.	.	S	Bend	trans	-65.6	-27.8	173.4	-71.7	-172.4	-162.3	0	0	112.3	P78 I79 R83 P107 C141 L222	P78-E139 WeakPolarHBondContact CD-O 3.31Å; P78-E139 WeakPolarHBondContact CG-O 3.08Å; I79-E139 HydrophobicContact CG2-CB 3.68Å; R83-E139 IonicContact CZ-OE1 3.72Å; R83-E139 IonicContact CZ-OE2 3.42Å; R83-E139 IonicContact NE-OE1 3.31Å; R83-E139 IonicContact NE-OE2 3.45Å; R83-E139 PolarHBondContact NE-OE2 3.1Å; R83-E139 VanDerWaalsContact NE-OE2 3.12Å; R83-E139 IonicContact NH2-OE1 3.76Å; R83-E139 PolarHBondContact NH2-OE1 2.81Å; R83-E139 IonicContact NH2-OE2 2.81Å; R83-E139 PolarHBondContact NH2-OE2 3.23Å; P107-E139 HydrophobicContact CG-CG 3.89Å; E139-C141 VanDerWaalsContact C-N 3.31Å; E139-C141 PolarHBondContact O-N 2.93Å; E139-L222 HydrophobicContact CG-CD1 3.83Å
140	D	97.6	Very high	89.9	Confident	44 Å²	44	39 Å²	39	24%	0.235	20%	0.204	C	C	.	.			trans	-74.6	85.4	164.1	-174.8	6	0	0	0	109.6	P77 N138 Y143	P77-D140 HydrophobicContact CB-CB 4.03Å; P77-D140 HydrophobicContact CG-CB 4.47Å; P77-D140 WeakPolarHBondContact CG-OD1 3.49Å; N138-D140 PolarHBondContact O-N 2.79Å; N138-D140 PolarHBondContact OD1-N 3.31Å; D140-Y143 VanDerWaalsContact CG-OH 3.26Å; D140-Y143 WeakPolarHBondContact O-CE2 3.34Å; D140-Y143 VanDerWaalsContact OD1-CE2 3.27Å; D140-Y143 WeakPolarHBondContact OD1-CE2 3.24Å; D140-Y143 PolarHBondContact OD1-OH 2.91Å; D140-Y143 PolarHBondContact OD2-OH 2.81Å; D140-Y143 VanDerWaalsContact OD2-OH 3.07Å
141	C	97.6	Very high	89.9	Confident	1 Å²	1	45.8 Å²	45.8	1%	0.007	24%	0.235	C	C	.	.			trans	-133.5	5.9	-175.3	67.2	0	0	0	0	115.1	C106 N138 E139 Y143 N216	C106-C141 VanDerWaalsContact CA-CB 3.48Å; C106-C141 WeakPolarHBondContact CA-SG 3.46Å; C106-C141 HydrophobicContact CB-CB 3.83Å; C106-C141 WeakPolarHBondContact CB-SG 3.35Å; C106-C141 WeakPolarHBondContact SG-CB 3.24Å; C106-C141 CovalentContact SG-SG 2.04Å; C106-C141 PolarHBondContact SG-SG 3.23Å; N138-C141 WeakPolarHBondContact O-CB 3.45Å; E139-C141 VanDerWaalsContact C-N 3.31Å; E139-C141 PolarHBondContact O-N 2.93Å; C141-Y143 VanDerWaalsContact C-N 3.26Å; C141-Y143 PolarHBondContact O-N 3.36Å; C141-N216 VanDerWaalsContact O-CB 3.24Å; C141-N216 WeakPolarHBondContact O-CB 3.46Å
142	L	98.4	Very high	89.3	Confident	1 Å²	1	49.4 Å²	49.4	1%	0.005	25%	0.249	C	C	.	.			trans	-81.7	71.7	-175.6	-58.6	-173	0	0	0	112.2	Y74 A75 P78 P87 R218 D240	Y74-L142 WeakPolarHBondContact CD1-O 3.42Å; Y74-L142 HydrophobicContact CE1-CB 4.19Å; Y74-L142 HydrophobicContact CE2-CB 4.22Å; Y74-L142 PolarHBondContact N-O 2.98Å; Y74-L142 WeakPolarHBondContact OH-CD2 3.42Å; A75-L142 HydrophobicContact CB-CB 3.95Å; A75-L142 HydrophobicContact CB-CD1 3.65Å; A75-L142 HydrophobicContact CB-CG 4.46Å; P78-L142 HydrophobicContact CB-CD1 4.21Å; P78-L142 HydrophobicContact CG-CD1 3.83Å; P78-L142 HydrophobicContact CG-CG 3.94Å; P87-L142 HydrophobicContact CB-CD1 4.22Å; L142-R218 HydrophobicContact CD2-CG 4.15Å; L142-D240 HydrophobicContact CD2-CB 4.18Å; L142-D240 WeakPolarHBondContact CD2-OD2 3.47Å
143	Y	98.5	Very high	87.9	Confident	21 Å²	21	46.4 Å²	46.4	8%	0.082	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	154.7	-176.4	-62.1	-86.3	0	0	0	111.9	G71 V72 P73 Y74 P103 D140 C141 N216	G71-Y143 VanDerWaalsContact O-CD1 3.32Å; G71-Y143 WeakPolarHBondContact O-CD1 3.25Å; V72-Y143 CarbonylContact O-C 3.57Å; V72-Y143 VanDerWaalsContact O-CA 3.32Å; V72-Y143 WeakPolarHBondContact O-CA 3.43Å; P73-Y143 HydrophobicContact CB-CD1 3.99Å; P73-Y143 HydrophobicContact CB-CE1 3.8Å; P73-Y143 HydrophobicContact CG-CE1 4.47Å; Y74-Y143 WeakPolarHBondContact CE1-O 3.4Å; P103-Y143 HydrophobicContact CB-CD1 4.07Å; P103-Y143 HydrophobicContact CB-CD2 3.46Å; P103-Y143 VanDerWaalsContact CB-CD2 3.46Å; P103-Y143 HydrophobicContact CB-CE2 4.21Å; P103-Y143 HydrophobicContact CB-CG 3.41Å; P103-Y143 VanDerWaalsContact CB-CG 3.41Å; P103-Y143 VanDerWaalsContact CG-CB 3.45Å; P103-Y143 HydrophobicContact CG-CD2 4.25Å; P103-Y143 HydrophobicContact CG-CG 3.97Å; D140-Y143 VanDerWaalsContact CG-OH 3.26Å; D140-Y143 WeakPolarHBondContact O-CE2 3.34Å; D140-Y143 VanDerWaalsContact OD1-CE2 3.27Å; D140-Y143 WeakPolarHBondContact OD1-CE2 3.24Å; D140-Y143 PolarHBondContact OD1-OH 2.91Å; D140-Y143 PolarHBondContact OD2-OH 2.81Å; D140-Y143 VanDerWaalsContact OD2-OH 3.07Å; C141-Y143 VanDerWaalsContact C-N 3.26Å; C141-Y143 PolarHBondContact O-N 3.36Å; Y143-N216 PolarHBondContact O-N 2.82Å
144	L	98.6	Very high	86.2	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	160.3	171.1	60.2	80.4	0	0	0	111.2	G71 V72 Y74 V146 I213 T214 L215 W247 V248	G71-L144 PolarHBondContact N-O 3.32Å; V72-L144 HydrophobicContact CB-CD1 3.89Å; V72-L144 HydrophobicContact CB-CG 4.46Å; V72-L144 HydrophobicContact CG1-CD1 4.33Å; V72-L144 PolarHBondContact N-O 3.42Å; V72-L144 PolarHBondContact O-N 2.87Å; Y74-L144 HydrophobicContact CD1-CB 4.09Å; Y74-L144 HydrophobicContact CD1-CD2 3.95Å; Y74-L144 HydrophobicContact CD1-CG 4.09Å; Y74-L144 HydrophobicContact CG-CD2 4.1Å; L144-V146 HydrophobicContact CD1-CG2 3.5Å; L144-I213 HydrophobicContact CB-CG2 4.15Å; L144-I213 HydrophobicContact CD1-CG2 4.19Å; L144-I213 HydrophobicContact CD2-CG2 4.38Å; L144-I213 HydrophobicContact CG-CG2 4.49Å; L144-T214 CarbonylContact C-O 3.36Å; L144-T214 VanDerWaalsContact CA-O 3.23Å; L144-T214 WeakPolarHBondContact CA-O 3.39Å; L144-T214 WeakPolarHBondContact CB-O 3.33Å; L144-L215 HydrophobicContact CB-CB 3.89Å; L144-W247 HydrophobicContact CD1-CE3 4.24Å; L144-W247 HydrophobicContact CD1-CH2 4.2Å; L144-W247 HydrophobicContact CD1-CZ3 3.77Å; L144-W247 HydrophobicContact CD2-CD2 4.23Å; L144-W247 HydrophobicContact CD2-CE3 3.63Å; L144-W247 HydrophobicContact CD2-CZ3 4.03Å; L144-W247 HydrophobicContact CG-CE3 4.48Å; L144-W247 HydrophobicContact CG-CZ3 4.48Å; L144-V248 HydrophobicContact CD2-CG2 4.21Å
145	N	98.6	Very high	84.4	Confident	1 Å²	1	49 Å²	49	1%	0.005	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	134.6	176.2	-51.3	-54.9	0	0	0	108.6	Y69 L70 G71 Y147 N197 I213 T214	Y69-N145 CarbonylContact O-C 3.56Å; Y69-N145 VanDerWaalsContact O-CA 3.29Å; Y69-N145 WeakPolarHBondContact O-CA 3.4Å; L70-N145 WeakPolarHBondContact CA-OD1 3.39Å; L70-N145 HydrophobicContact CD2-CB 3.9Å; G71-N145 PolarHBondContact N-OD1 2.93Å; N145-Y147 HydrophobicContact CB-CE2 3.81Å; N145-N197 PolarHBondContact ND2-OD1 2.89Å; N145-I213 VanDerWaalsContact O-CA 3.24Å; N145-I213 WeakPolarHBondContact O-CA 3.32Å; N145-T214 PolarHBondContact N-O 3.46Å; N145-T214 PolarHBondContact ND2-OG1 3.4Å; N145-T214 VanDerWaalsContact ND2-OG1 3.13Å; N145-T214 PolarHBondContact O-N 2.93Å
146	V	98.6	Very high	83.3	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	128.5	179.9	-170.3	0	0	0	0	109.6	Q68 Y69 L144 V148 I211 I213 I252 F255	Q68-V146 WeakPolarHBondContact CA-O 3.43Å; Y69-V146 HydrophobicContact CD2-CB 4.41Å; Y69-V146 PolarHBondContact N-O 2.88Å; Y69-V146 PolarHBondContact O-N 3.26Å; L144-V146 HydrophobicContact CD1-CG2 3.5Å; V146-V148 HydrophobicContact CG1-CG2 3.82Å; V146-I211 HydrophobicContact CG1-CG2 3.71Å; V146-I213 HydrophobicContact CG1-CG1 4.34Å; V146-I213 HydrophobicContact CG2-CG1 4.48Å; V146-I252 HydrophobicContact CG1-CD1 4.22Å; V146-F255 HydrophobicContact CB-CE1 4.43Å; V146-F255 HydrophobicContact CG1-CD1 4Å; V146-F255 HydrophobicContact CG1-CE1 4.36Å; V146-F255 HydrophobicContact CG1-CG 4.33Å; V146-F255 HydrophobicContact CG2-CE1 4.46Å
147	Y	98.4	Very high	81.4	Confident	1 Å²	1	47.7 Å²	47.7	0%	0.004	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	108.5	178.7	-58.5	-94.7	0	0	0	108.8	V66 Q68 L70 N145 D200 S202 I211 V212 T214	V66-Y147 HydrophobicContact CG1-CD1 4.48Å; Q68-Y147 HydrophobicContact CG-CD1 3.89Å; Q68-Y147 HydrophobicContact CG-CE1 4.16Å; L70-Y147 HydrophobicContact CD2-CE1 4.31Å; N145-Y147 HydrophobicContact CB-CE2 3.81Å; Y147-D200 VanDerWaalsContact CE1-OD1 3.31Å; Y147-D200 WeakPolarHBondContact CE1-OD1 3.49Å; Y147-S202 VanDerWaalsContact CD1-OG 3.32Å; Y147-S202 WeakPolarHBondContact CD1-OG 3.31Å; Y147-I211 WeakPolarHBondContact O-CA 3.45Å; Y147-V212 WeakPolarHBondContact CD2-O 3.35Å; Y147-V212 PolarHBondContact N-O 2.98Å; Y147-V212 PolarHBondContact O-N 3.44Å; Y147-T214 HydrophobicContact CE2-CG2 4.25Å
148	V	97.7	Very high	79.2	Confident	15 Å²	15	53 Å²	53	9%	0.091	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	119.6	-175.7	-173.9	0	0	0	0	109.4	V66 D67 Y69 V146 I211 F255	V66-V148 CarbonylContact C-O 3.58Å; V66-V148 WeakPolarHBondContact CA-O 3.46Å; V66-V148 WeakPolarHBondContact CG1-O 3.36Å; D67-V148 HydrophobicContact CB-CB 4.28Å; D67-V148 PolarHBondContact N-O 3.27Å; D67-V148 PolarHBondContact O-N 2.69Å; Y69-V148 HydrophobicContact CD2-CG2 4.41Å; Y69-V148 HydrophobicContact CE2-CG2 4.17Å; V146-V148 HydrophobicContact CG1-CG2 3.82Å; V148-I211 HydrophobicContact CG1-CD1 4.33Å; V148-I211 HydrophobicContact CG1-CG1 4.28Å; V148-I211 HydrophobicContact CG2-CD1 4.33Å; V148-I211 HydrophobicContact CG2-CG1 4.41Å; V148-I211 HydrophobicContact CG2-CG2 4.39Å; V148-F255 WeakPolarHBondContact CG1-O 3.38Å; V148-F255 HydrophobicContact CG2-CB 4.05Å; V148-F255 HydrophobicContact CG2-CD1 4.13Å
149	P	95.4	Very high	76.5	Confident	5 Å²	5	58.9 Å²	58.9	3%	0.032	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	137.2	178	30.3	-32.1	0	0	0	110.5	K180 A205 V210	P149-K180 HydrophobicContact CG-CD 3.63Å; P149-A205 HydrophobicContact CB-CB 4.45Å; P149-A205 VanDerWaalsContact CB-O 3.29Å; P149-A205 WeakPolarHBondContact CB-O 3.31Å; P149-A205 WeakPolarHBondContact CG-O 3.49Å; P149-V210 VanDerWaalsContact CD-O 3.29Å; P149-V210 WeakPolarHBondContact CD-O 3.29Å; P149-V210 WeakPolarHBondContact CG-O 3.41Å
150	T	89.9	Confident	73.9	Confident	16 Å²	16	60.2 Å²	60.2	10%	0.098	35%	0.347	C	S	.	.			trans	-80.3	153.9	170.2	78.8	0	0	0	0	110.4	P65 D152	P65-T150 WeakPolarHBondContact CD-OG1 3.18Å; P65-T150 HydrophobicContact CG-CG2 4.2Å; P65-T150 WeakPolarHBondContact CG-OG1 3.29Å; P65-T150 WeakPolarHBondContact O-CG2 3.45Å; P65-T150 PolarHBondContact O-N 3.12Å; P65-T150 VanDerWaalsContact O-N 3.1Å; P65-T150 PolarHBondContact O-OG1 3.27Å; T150-D152 PolarHBondContact O-N 3.48Å; T150-D152 PolarHBondContact OG1-OD2 2.87Å
151	E	71.4	Confident	71.5	Confident	150 Å²	150	66.7 Å²	66.7	70%	0.701	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.9	-3.3	-179.9	-59.4	-172.9	158.1	0	0	113.5	G153	E151-G153 PolarHBondContact O-N 2.95Å
152	D	56.8	Low	69.2	Low	113 Å²	113	73.9 Å²	73.9	60%	0.604	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.8	1.1	-175.2	-51.6	-50.5	0	0	0	113.4	T150 S154	T150-D152 PolarHBondContact O-N 3.48Å; T150-D152 PolarHBondContact OG1-OD2 2.87Å; D152-S154 PolarHBondContact O-N 3.15Å
153	G	49.7	Very low	66.6	Low	16 Å²	16	81.6 Å²	81.6	17%	0.165	45%	0.454	C	S	.	.			trans	-73.3	115	170.2	0	0	0	0	0	110.8	E151 G155 A156	E151-G153 PolarHBondContact O-N 2.95Å; G153-G155 PolarHBondContact O-N 3.05Å; G153-A156 PolarHBondContact O-N 3.45Å
154	S	43.5	Very low	64.2	Low	93 Å²	93	85.4 Å²	85.4	65%	0.65	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.9	-6.8	177.5	55.2	0	0	0	0	115.4	D152	D152-S154 PolarHBondContact O-N 3.15Å
155	G	44.3	Very low	61.7	Low	66 Å²	66	92.1 Å²	92.1	68%	0.68	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.6	-13.6	174.2	0	0	0	0	0	116	G153	G153-G155 PolarHBondContact O-N 3.05Å
156	A	47.3	Very low	59.4	Low	61 Å²	61	100 Å²	100	50%	0.504	57%	0.568	S	S	.	*	S	Bend	trans	-85.1	-14.6	-178.5	0	0	0	0	0	113.7	G153	G153-A156 PolarHBondContact O-N 3.45Å
157	K	42.9	Very low	56.9	Low	198 Å²	198	107 Å²	107	86%	0.861	61%	0.605	S	S	*	*	S	Bend	trans	-108.1	63.9	174.4	-70.4	-171.3	178.5	-176.9	0	111.6
158	K	45.2	Very low	54.6	Low	180 Å²	180	111 Å²	111	78%	0.783	65%	0.647	S	S	*	*	S	Bend	trans	-145.5	83.7	160.2	-80.2	-162.9	177.7	178.1	0	111.2
159	Q	38.9	Very low	52.1	Low	204 Å²	204	117.1 Å²	117.1	95%	0.953	68%	0.679	S	S	*	*	S	Bend	trans	161.4	89.2	133.4	-91.2	167	18.8	0	0	108.4
160	G	41.6	Very low	49.8	Very low	79 Å²	79	126.1 Å²	126.1	81%	0.814	72%	0.721	S	S	*	*			trans	-169.1	21.6	173	0	0	0	0	0	111.4
161	E	48	Very low	47.7	Very low	180 Å²	180	132.5 Å²	132.5	84%	0.841	75%	0.754	S	S	*	*			trans	-108	125.6	165	-66.5	-175.6	156.7	0	0	105.2
162	D	48.6	Very low	46.7	Very low	151 Å²	151	133.9 Å²	133.9	81%	0.807	76%	0.761	S	S	*	*	S	Bend	trans	86.2	86.6	168.3	-45.8	-26.4	0	0	0	117
163	L	44.6	Very low	46.4	Very low	163 Å²	163	133.7 Å²	133.7	85%	0.853	76%	0.759	S	S	*	*				170.3	97.3	110.4	-82.1	169.5	0	0	0	108.4	D165	L163-D165 PolarHBondContact O-N 3.41Å; L163-D165 VanDerWaalsContact O-N 3.14Å
164	A	49	Very low	46.7	Very low	101 Å²	101	138.5 Å²	138.5	84%	0.835	78%	0.78	S	S	*	*			trans	-75.3	94.8	168.8	0	0	0	0	0	109
165	D	44.3	Very low	47.2	Very low	142 Å²	142	144.4 Å²	144.4	76%	0.759	79%	0.788	S	S	*	*			trans	-104.8	111.4	154.7	-83.6	-30.2	0	0	0	107.6	L163 D167	L163-D165 PolarHBondContact O-N 3.41Å; L163-D165 VanDerWaalsContact O-N 3.14Å; D165-D167 VanDerWaalsContact C-N 3.35Å; D165-D167 PolarHBondContact O-N 3.44Å
166	N	50.7	Low	47.6	Very low	167 Å²	167	148 Å²	148	89%	0.893	79%	0.792	S	S	*	*			trans	-71.3	88.8	171.3	-88	-38.7	0	0	0	108.7
167	D	45.9	Very low	48.1	Very low	146 Å²	146	147.8 Å²	147.8	78%	0.781	79%	0.787	S	S	*	*			trans	-113.5	117.3	158	-82.9	-32.9	0	0	0	108.3	D165 D169	D165-D167 VanDerWaalsContact C-N 3.35Å; D165-D167 PolarHBondContact O-N 3.44Å; D167-D169 VanDerWaalsContact C-N 3.32Å; D167-D169 PolarHBondContact O-N 3.34Å
168	G	50.4	Low	49.7	Very low	85 Å²	85	141.5 Å²	141.5	88%	0.876	78%	0.778	S	S	*	*			trans	-76.3	72.1	-170	0	0	0	0	0	114.2
169	D	44.8	Very low	51.9	Low	143 Å²	143	134.4 Å²	134.4	77%	0.765	75%	0.753	S	S	*	*			trans	-113.9	109.1	159.3	-82.8	-38	0	0	0	108.2	D167 D171	D167-D169 VanDerWaalsContact C-N 3.32Å; D167-D169 PolarHBondContact O-N 3.34Å; D169-D171 PolarHBondContact O-N 3.31Å
170	E	48	Very low	54.5	Low	195 Å²	195	125.8 Å²	125.8	91%	0.911	71%	0.712	S	S	*	*			trans	-72.8	61	174.4	-65.7	179.9	175.2	0	0	110.7	E172	E170-E172 PolarHBondContact O-N 2.85Å
171	D	46.2	Very low	57.1	Low	150 Å²	150	123.9 Å²	123.9	80%	0.802	69%	0.686	S	S	*	*			trans	-82.5	91	159.5	-82.5	-20.9	0	0	0	106.5	D169 D173	D169-D171 PolarHBondContact O-N 3.31Å; D171-D173 VanDerWaalsContact C-N 3.34Å; D171-D173 PolarHBondContact O-N 3.39Å
172	E	50.9	Low	59.5	Low	179 Å²	179	115.3 Å²	115.3	84%	0.836	65%	0.646	S	S	*	*			trans	-52.7	101.9	166.4	-81.1	-166.9	171.3	0	0	108.1	E170 I174	E170-E172 PolarHBondContact O-N 2.85Å; E172-I174 PolarHBondContact O-N 3.46Å; E172-I174 VanDerWaalsContact O-N 3.16Å
173	D	50.4	Low	61.8	Low	108 Å²	108	110.2 Å²	110.2	58%	0.578	62%	0.618	S	S	*	*			trans	-60	124.6	179.3	-153.4	1.6	0	0	0	107	D171 R175 D176	D171-D173 VanDerWaalsContact C-N 3.34Å; D171-D173 PolarHBondContact O-N 3.39Å; D173-R175 PolarHBondContact O-N 2.94Å; D173-D176 PolarHBondContact O-N 2.84Å
174	I	55	Low	64.4	Low	117 Å²	117	102.5 Å²	102.5	60%	0.6	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54	-12.2	-173.3	-67.9	168.1	0	0	0	112.8	E172 R261	E172-I174 PolarHBondContact O-N 3.46Å; E172-I174 VanDerWaalsContact O-N 3.16Å; I174-R261 PolarHBondContact O-NH1 3.37Å
175	R	53.8	Low	66.7	Low	217 Å²	217	98.7 Å²	98.7	82%	0.819	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.2	-14	-180	-61.8	179.2	175.9	-172.2	0.2	113.9	D173	D173-R175 PolarHBondContact O-N 2.94Å
176	D	52.8	Low	69.2	Low	142 Å²	142	92 Å²	92	76%	0.759	51%	0.505	S	S	*	.			trans	-99.8	5	-165.9	-149.5	21.8	0	0	0	115	D173 G178	D173-D176 PolarHBondContact O-N 2.84Å; D176-G178 PolarHBondContact O-N 3.41Å
177	S	57.4	Low	71.2	Confident	56 Å²	56	84.3 Å²	84.3	39%	0.392	46%	0.464	S	S	.	.	S	Bend	trans	-67.5	-7	-178.8	71.5	0	0	0	0	115.1	A179 R261	S177-A179 PolarHBondContact O-N 2.87Å; S177-A179 PolarHBondContact OG-N 2.98Å; S177-A179 PolarHBondContact OG-O 2.89Å; S177-R261 PolarHBondContact OG-NH2 3.29Å
178	G	78.1	Confident	73.1	Confident	66 Å²	66	78 Å²	78	68%	0.68	43%	0.433	S	S	*	.	S	Bend	trans	66.1	-30.1	-169.6	0	0	0	0	0	114.7	D176	D176-G178 PolarHBondContact O-N 3.41Å
179	A	89.9	Confident	74.4	Confident	31 Å²	31	74.4 Å²	74.4	26%	0.256	40%	0.396	S	S	.	.	S	Bend	trans	-71.8	144.3	174.9	0	0	0	0	0	111.4	S177 G256 D258 R261	S177-A179 PolarHBondContact O-N 2.87Å; S177-A179 PolarHBondContact OG-N 2.98Å; S177-A179 PolarHBondContact OG-O 2.89Å; A179-G256 CarbonylContact C-O 3.59Å; A179-G256 WeakPolarHBondContact CA-O 3.37Å; A179-D258 HydrophobicContact CB-CB 3.8Å; A179-R261 PolarHBondContact O-NH2 3.18Å
180	K	93.6	Very high	76.2	Confident	23 Å²	23	68.3 Å²	68.3	10%	0.1	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	143.2	-175.1	-58.5	-174.9	-166.9	-64.9	0	111.4	P149 N209 I211 G256 G257 D258	P149-K180 HydrophobicContact CG-CD 3.63Å; K180-N209 PolarHBondContact NZ-OD1 3.18Å; K180-I211 HydrophobicContact CB-CG1 4.16Å; K180-I211 HydrophobicContact CD-CG1 4.46Å; K180-G256 PolarHBondContact N-O 3.4Å; K180-G257 CarbonylContact O-C 3.46Å; K180-G257 WeakPolarHBondContact O-CA 3.45Å; K180-D258 PolarHBondContact O-N 3.01Å
181	P	96.4	Very high	78.1	Confident	39 Å²	39	62 Å²	62	25%	0.253	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.5	151.5	167.7	-17.8	27.4	0	0	0	111.5	V210 I211	P181-V210 HydrophobicContact CB-CG1 3.88Å; P181-V210 HydrophobicContact CG-CG1 4.01Å; P181-V210 WeakPolarHBondContact O-CA 3.31Å; P181-I211 PolarHBondContact O-N 3.02Å
182	V	97.8	Very high	80.2	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	127.6	-176.8	-175.3	0	0	0	0	109.5	V184 I211 I213 V248 I252 R261 I262 T263	V182-V184 HydrophobicContact CG1-CG2 4.21Å; V182-I211 CarbonylContact C-O 3.45Å; V182-I211 WeakPolarHBondContact CA-O 3.35Å; V182-I211 HydrophobicContact CG2-CB 4.47Å; V182-I213 HydrophobicContact CG1-CD1 3.73Å; V182-I213 HydrophobicContact CG1-CG1 4.25Å; V182-V248 HydrophobicContact CG1-CG1 4.01Å; V182-I252 HydrophobicContact CB-CG1 4.45Å; V182-I252 HydrophobicContact CG1-CD1 4.5Å; V182-I252 HydrophobicContact CG1-CG1 3.98Å; V182-I252 HydrophobicContact CG2-CB 4.42Å; V182-I252 HydrophobicContact CG2-CG1 3.59Å; V182-I252 HydrophobicContact CG2-CG2 4.02Å; V182-R261 PolarHBondContact N-O 3.14Å; V182-I262 HydrophobicContact CB-CG1 4.2Å; V182-I262 CarbonylContact O-C 3.53Å; V182-I262 WeakPolarHBondContact O-CA 3.16Å; V182-T263 PolarHBondContact O-N 3.38Å
183	M	98.1	Very high	81.9	Confident	45 Å²	45	50.7 Å²	50.7	22%	0.222	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	116.8	176.9	-65.9	-173	67	0	0	110.1	L204 V210 I211 V212 I213 T263 F265	M183-L204 HydrophobicContact CE-CD2 4.27Å; M183-L204 HydrophobicContact SD-CD2 4.28Å; M183-V210 HydrophobicContact CG-CG2 4.38Å; M183-V210 HydrophobicContact SD-CG2 3.94Å; M183-I211 PolarHBondContact N-O 3.25Å; M183-V212 CarbonylContact O-C 3.46Å; M183-V212 WeakPolarHBondContact O-CA 3.29Å; M183-I213 PolarHBondContact O-N 2.91Å; M183-T263 CarbonylContact C-O 3.53Å; M183-T263 WeakPolarHBondContact CA-O 3.4Å; M183-F265 HydrophobicContact CB-CD1 4.28Å; M183-F265 HydrophobicContact CB-CE1 3.75Å; M183-F265 HydrophobicContact CE-CD1 4.09Å; M183-F265 HydrophobicContact CE-CE1 3.97Å; M183-F265 HydrophobicContact CE-CE2 4.45Å; M183-F265 HydrophobicContact CE-CG 4.43Å; M183-F265 HydrophobicContact CE-CZ 4.14Å
184	V	98.4	Very high	83.7	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	114.6	-178.9	-175.1	0	0	0	0	109.6	V182 I213 L215 L245 V248 I262 T263 V264 F265	V182-V184 HydrophobicContact CG1-CG2 4.21Å; V184-I213 HydrophobicContact CG2-CB 4.3Å; V184-I213 HydrophobicContact CG2-CD1 4.32Å; V184-L215 HydrophobicContact CG1-CD2 3.64Å; V184-L245 HydrophobicContact CB-CD2 4.18Å; V184-L245 HydrophobicContact CG1-CD2 3.98Å; V184-L245 HydrophobicContact CG2-CD2 4.14Å; V184-V248 HydrophobicContact CG2-CG1 4.25Å; V184-I262 HydrophobicContact CG2-CG2 3.85Å; V184-T263 PolarHBondContact N-O 3.1Å; V184-V264 WeakPolarHBondContact O-CA 3.42Å; V184-F265 VanDerWaalsContact O-CD1 3.24Å; V184-F265 WeakPolarHBondContact O-CD1 3.37Å; V184-F265 PolarHBondContact O-N 2.82Å
185	Y	97.8	Very high	85.6	Confident	22 Å²	22	40 Å²	40	9%	0.086	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	127.1	179.9	-177.9	-104.9	0	0	0	111.8	H187 I199 I213 T214 F265	Y185-H187 HydrophobicContact CE1-CB 3.8Å; Y185-I199 HydrophobicContact CD1-CB 4.3Å; Y185-I199 HydrophobicContact CD1-CG1 3.99Å; Y185-I199 HydrophobicContact CD1-CG2 4.44Å; Y185-I199 HydrophobicContact CE1-CB 4.25Å; Y185-I199 HydrophobicContact CE1-CD1 4.45Å; Y185-I199 HydrophobicContact CE1-CG1 3.45Å; Y185-I199 VanDerWaalsContact CE1-CG1 3.45Å; Y185-I213 PolarHBondContact N-O 2.85Å; Y185-T214 HydrophobicContact CD1-CG2 4.32Å; Y185-F265 CarbonylContact C-O 3.55Å; Y185-F265 WeakPolarHBondContact CA-O 3.41Å; Y185-F265 AromaticContact CD2-CD2 3.78Å; Y185-F265 HydrophobicContact CD2-CD2 3.78Å; Y185-F265 HydrophobicContact CD2-CE1 4.28Å; Y185-F265 AromaticContact CD2-CE2 3.45Å; Y185-F265 HydrophobicContact CD2-CE2 3.45Å; Y185-F265 VanDerWaalsContact CD2-CE2 3.45Å; Y185-F265 HydrophobicContact CD2-CG 4.35Å; Y185-F265 AromaticContact CD2-CZ 3.72Å; Y185-F265 HydrophobicContact CD2-CZ 3.72Å; Y185-F265 HydrophobicContact CE2-CD2 4.44Å; Y185-F265 HydrophobicContact CE2-CE2 4.23Å; Y185-F265 HydrophobicContact CG-CE2 4.28Å; Y185-F265 HydrophobicContact CG-CZ 4.11Å
186	I	96.6	Very high	87.5	Confident	1 Å²	1	29.7 Å²	29.7	1%	0.005	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	116.8	170.6	-58.2	179.1	0	0	0	108.3	L215 Y217 Q241 V264 F265 G266 G270 C273 V274 L277	I186-L215 HydrophobicContact CG1-CD2 4.28Å; I186-Y217 HydrophobicContact CG2-CD1 4.37Å; I186-Y217 HydrophobicContact CG2-CE1 3.73Å; I186-Q241 HydrophobicContact CD1-CB 4.41Å; I186-Q241 HydrophobicContact CD1-CG 4.25Å; I186-V264 HydrophobicContact CD1-CG1 3.6Å; I186-V264 HydrophobicContact CG1-CG1 4.02Å; I186-F265 PolarHBondContact N-O 3.44Å; I186-G266 VanDerWaalsContact O-CA 3.24Å; I186-G266 WeakPolarHBondContact O-CA 3.18Å; I186-G270 WeakPolarHBondContact O-CA 3.19Å; I186-C273 HydrophobicContact CG2-CB 3.95Å; I186-V274 HydrophobicContact CD1-CG2 4.11Å; I186-L277 HydrophobicContact CD1-CD1 3.51Å
187	H	93.1	Very high	89.4	Confident	5 Å²	5	23.2 Å²	23.2	2%	0.023	15%	0.148	C	C	.	.			trans	-69.5	150.6	178.7	71.3	80.8	0	0	0	111.9	Y185 G196 L215 Y217	Y185-H187 HydrophobicContact CE1-CB 3.8Å; H187-G196 PolarHBondContact CD2-N 3.4Å; H187-G196 VanDerWaalsContact CD2-N 3.29Å; H187-L215 PolarHBondContact CD2-O 3.32Å; H187-Y217 AromaticContact CD2-CE1 3.7Å; H187-Y217 AromaticContact CE1-CE1 3.53Å; H187-Y217 AromaticContact CE1-CZ 3.73Å; H187-Y217 AromaticContact ND1-CE1 3.96Å; H187-Y217 AromaticContact NE2-CD1 3.68Å; H187-Y217 AromaticContact NE2-CE1 3.35Å; H187-Y217 WeakPolarHBondContact NE2-CE1 3.31Å; H187-Y217 PolarHBondContact O-OH 2.85Å
188	G	85.9	Confident	91	Very high	13 Å²	13	22 Å²	22	13%	0.134	14%	0.136	C	C	.	.			trans	-89.7	-145.2	170.7	0	0	0	0	0	112.4	S267	G188-S267 WeakPolarHBondContact CA-O 3.42Å
189	G	78.4	Confident	91.6	Very high	10 Å²	10	21.1 Å²	21.1	10%	0.103	12%	0.116	C	C	.	.	S	Bend	trans	120.2	-136.3	-162.1	0	0	0	0	0	106.9	E193 I269	G189-E193 VanDerWaalsContact C-OE1 3.26Å; G189-E193 WeakPolarHBondContact CA-OE1 3.4Å; G189-I269 WeakPolarHBondContact O-CG1 3.24Å
190	S	82.3	Confident	91.8	Very high	16 Å²	16	24.1 Å²	24.1	11%	0.112	13%	0.127	C	C	.	.	S	Bend	trans	-132.5	31	177	-48	0	0	0	0	111.4	M192 E193	S190-M192 PolarHBondContact O-N 3.43Å; S190-M192 VanDerWaalsContact O-N 3.11Å; S190-E193 WeakPolarHBondContact CB-OE1 3.14Å; S190-E193 PolarHBondContact N-OE1 3Å; S190-E193 PolarHBondContact OG-OE1 2.83Å
191	Y	87.5	Confident	91.9	Very high	61 Å²	61	23.1 Å²	23.1	24%	0.239	12%	0.124	C	C	.	.	S	Bend	trans	63.6	-5.2	-160.5	-55	-79.2	0	0	0	114.8	V219 G220 F224 I269	Y191-V219 CarbonylContact O-C 3.51Å; Y191-V219 WeakPolarHBondContact O-CA 3.32Å; Y191-V219 VanDerWaalsContact O-CB 3.28Å; Y191-V219 WeakPolarHBondContact O-CB 3.38Å; Y191-G220 PolarHBondContact O-N 3.4Å; Y191-F224 AromaticContact CD1-CE1 3.92Å; Y191-F224 HydrophobicContact CD1-CE1 3.92Å; Y191-F224 AromaticContact CD1-CE2 3.93Å; Y191-F224 HydrophobicContact CD1-CE2 3.93Å; Y191-F224 AromaticContact CD1-CZ 3.54Å; Y191-F224 HydrophobicContact CD1-CZ 3.54Å; Y191-F224 HydrophobicContact CE1-CE1 4.39Å; Y191-F224 HydrophobicContact CE1-CZ 4.31Å; Y191-F224 HydrophobicContact CG-CE2 4.31Å; Y191-F224 HydrophobicContact CG-CZ 4.32Å; Y191-I269 HydrophobicContact CD1-CG2 3.49Å; Y191-I269 VanDerWaalsContact CD1-CG2 3.49Å; Y191-I269 HydrophobicContact CD2-CD1 4.29Å; Y191-I269 HydrophobicContact CD2-CG1 4.4Å; Y191-I269 HydrophobicContact CD2-CG2 3.76Å; Y191-I269 HydrophobicContact CE1-CG2 3.32Å; Y191-I269 HydrophobicContact CE2-CD1 3.71Å; Y191-I269 HydrophobicContact CE2-CG1 4.23Å; Y191-I269 HydrophobicContact CE2-CG2 3.6Å; Y191-I269 HydrophobicContact CG-CG2 3.71Å
192	M	89	Confident	91.8	Very high	91 Å²	91	21.2 Å²	21.2	45%	0.448	11%	0.112	S	C	.	.	S	Bend	trans	-104.4	-20.7	-172.5	-64.6	-65.4	-63	0	0	113	Q108 V114 S190 G220	Q108-M192 WeakPolarHBondContact CB-O 3.43Å; V114-M192 HydrophobicContact CG2-CG 4.47Å; S190-M192 PolarHBondContact O-N 3.43Å; S190-M192 VanDerWaalsContact O-N 3.11Å; M192-G220 WeakPolarHBondContact SD-CA 3.39Å
193	E	87.5	Confident	91.7	Very high	1 Å²	1	26.2 Å²	26.2	1%	0.005	14%	0.137	C	C	.	.	S	Bend	trans	-148.1	173.1	-176.2	65.3	-76.2	149.9	0	0	111.3	Q108 L119 F123 G189 S190	Q108-E193 HydrophobicContact CB-CB 4.34Å; Q108-E193 VanDerWaalsContact OE1-CA 3.32Å; L119-E193 HydrophobicContact CD2-CG 4.45Å; L119-E193 WeakPolarHBondContact CD2-OE1 3.32Å; F123-E193 HydrophobicContact CE1-CG 4.44Å; F123-E193 HydrophobicContact CZ-CG 4.15Å; G189-E193 VanDerWaalsContact C-OE1 3.26Å; G189-E193 WeakPolarHBondContact CA-OE1 3.4Å; S190-E193 WeakPolarHBondContact CB-OE1 3.14Å; S190-E193 PolarHBondContact N-OE1 3Å; S190-E193 PolarHBondContact OG-OE1 2.83Å
194	G	89.3	Confident	91.5	Very high	2 Å²	2	27.4 Å²	27.4	2%	0.021	14%	0.144	C	C	.	.			trans	114.6	167.8	179.1	0	0	0	0	0	112.9	Q108	Q108-G194 PolarHBondContact NE2-O 3.28Å
195	T	93.5	Very high	91.4	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	14%	0.144	C	C	.	.			trans	-159.2	145.3	176.3	172.4	0	0	0	0	109.2	V105 I134 N197 M198 N216	V105-T195 HydrophobicContact CG1-CG2 3.95Å; V105-T195 WeakPolarHBondContact CG1-OG1 3.32Å; I134-T195 HydrophobicContact CG1-CG2 4.16Å; T195-N197 HydrophobicContact CG2-CB 4.14Å; T195-N197 PolarHBondContact O-N 2.77Å; T195-N197 WeakPolarHBondContact OG1-CB 3.06Å; T195-N197 VanDerWaalsContact OG1-CG 3.25Å; T195-N197 PolarHBondContact OG1-N 3.29Å; T195-N197 VanDerWaalsContact OG1-N 3.1Å; T195-N197 PolarHBondContact OG1-ND2 2.8Å; T195-M198 HydrophobicContact CG2-CB 4.48Å; T195-M198 HydrophobicContact CG2-CE 3.79Å; T195-M198 HydrophobicContact CG2-CG 3.69Å; T195-M198 HydrophobicContact CG2-SD 4.11Å; T195-M198 VanDerWaalsContact O-CE 3.24Å; T195-M198 WeakPolarHBondContact O-CE 3.37Å; T195-N216 WeakPolarHBondContact CA-OD1 3.33Å; T195-N216 PolarHBondContact OG1-OD1 3.13Å
196	G	93.8	Very high	91.2	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	15%	0.147	C	C	.	.	G	3₁₀ helix	trans	-64.7	-20.1	170.8	0	0	0	0	0	112.6	H187 M198 I199 T214 N216	H187-G196 PolarHBondContact CD2-N 3.4Å; H187-G196 VanDerWaalsContact CD2-N 3.29Å; G196-M198 PolarHBondContact O-N 3.22Å; G196-I199 PolarHBondContact O-N 3.28Å; G196-T214 WeakPolarHBondContact O-CB 3.28Å; G196-T214 PolarHBondContact O-OG1 2.84Å; G196-N216 PolarHBondContact N-OD1 3.4Å
197	N	93.5	Very high	91	Very high	5 Å²	5	36.4 Å²	36.4	3%	0.027	18%	0.182	C	C	.	.	G	3₁₀ helix	trans	-66.3	-22.6	-177.6	-58.4	-13.4	0	0	0	113.2	F102 P103 Y133 N145 T195 I199	F102-N197 HydrophobicContact CD1-CB 3.83Å; F102-N197 HydrophobicContact CE1-CB 4.13Å; F102-N197 HydrophobicContact CG-CB 4.1Å; P103-N197 PolarHBondContact O-ND2 3.48Å; Y133-N197 HydrophobicContact CD1-CB 4.17Å; Y133-N197 WeakPolarHBondContact CE1-O 3.35Å; N145-N197 PolarHBondContact ND2-OD1 2.89Å; T195-N197 HydrophobicContact CG2-CB 4.14Å; T195-N197 PolarHBondContact O-N 2.77Å; T195-N197 WeakPolarHBondContact OG1-CB 3.06Å; T195-N197 VanDerWaalsContact OG1-CG 3.25Å; T195-N197 PolarHBondContact OG1-N 3.29Å; T195-N197 VanDerWaalsContact OG1-N 3.1Å; T195-N197 PolarHBondContact OG1-ND2 2.8Å; N197-I199 PolarHBondContact O-N 3.36Å
198	M	90.3	Very high	90.9	Very high	30 Å²	30	38 Å²	38	15%	0.148	20%	0.2	C	C	.	.	G	3₁₀ helix	trans	-72.1	-15.1	178.5	-74.3	175.4	-55.4	0	0	113.4	F123 V130 Y133 I134 T195 G196	F123-M198 HydrophobicContact CD2-CE 4.21Å; F123-M198 HydrophobicContact CD2-SD 3.94Å; F123-M198 HydrophobicContact CE2-CE 3.71Å; F123-M198 HydrophobicContact CE2-SD 3.57Å; F123-M198 VanDerWaalsContact CE2-SD 3.57Å; V130-M198 HydrophobicContact CG1-SD 4.02Å; V130-M198 HydrophobicContact CG2-SD 4.5Å; Y133-M198 HydrophobicContact CD1-CG 4.48Å; Y133-M198 HydrophobicContact CD2-CG 4.12Å; Y133-M198 HydrophobicContact CG-CG 3.9Å; I134-M198 HydrophobicContact CD1-SD 4.48Å; T195-M198 HydrophobicContact CG2-CB 4.48Å; T195-M198 HydrophobicContact CG2-CE 3.79Å; T195-M198 HydrophobicContact CG2-CG 3.69Å; T195-M198 HydrophobicContact CG2-SD 4.11Å; T195-M198 VanDerWaalsContact O-CE 3.24Å; T195-M198 WeakPolarHBondContact O-CE 3.37Å; G196-M198 PolarHBondContact O-N 3.22Å
199	I	90.5	Very high	91.3	Very high	48 Å²	48	40.5 Å²	40.5	25%	0.246	21%	0.21	C	C	.	.	S	Bend	trans	-107.9	109.4	-178.1	-57.1	-54.4	0	0	0	108.8	W122 Y185 G196 N197 G201 T214	W122-I199 HydrophobicContact CH2-CD1 4.23Å; Y185-I199 HydrophobicContact CD1-CB 4.3Å; Y185-I199 HydrophobicContact CD1-CG1 3.99Å; Y185-I199 HydrophobicContact CD1-CG2 4.44Å; Y185-I199 HydrophobicContact CE1-CB 4.25Å; Y185-I199 HydrophobicContact CE1-CD1 4.45Å; Y185-I199 HydrophobicContact CE1-CG1 3.45Å; Y185-I199 VanDerWaalsContact CE1-CG1 3.45Å; G196-I199 PolarHBondContact O-N 3.28Å; N197-I199 PolarHBondContact O-N 3.36Å; I199-G201 PolarHBondContact O-N 2.85Å; I199-T214 HydrophobicContact CB-CG2 4.15Å; I199-T214 HydrophobicContact CG2-CG2 4.25Å
200	D	94.3	Very high	92.1	Very high	94 Å²	94	40.8 Å²	40.8	50%	0.503	21%	0.21	S	C	.	.			trans	-79.6	111.1	170	-174.6	-1.4	0	0	0	110.2	Y147 S202	Y147-D200 VanDerWaalsContact CE1-OD1 3.31Å; Y147-D200 WeakPolarHBondContact CE1-OD1 3.49Å; D200-S202 VanDerWaalsContact C-N 3.26Å; D200-S202 PolarHBondContact O-N 2.81Å; D200-S202 WeakPolarHBondContact OD1-CB 3.48Å; D200-S202 PolarHBondContact OD1-N 2.84Å; D200-S202 PolarHBondContact OD1-OG 3.49Å
201	G	95.4	Very high	92.9	Very high	2 Å²	2	40 Å²	40	2%	0.021	21%	0.205	C	C	.	.			trans	-75.8	-7	178.8	0	0	0	0	0	114.6	I199 I203 L204 A205	I199-G201 PolarHBondContact O-N 2.85Å; G201-I203 PolarHBondContact O-N 2.88Å; G201-L204 PolarHBondContact O-N 2.86Å; G201-A205 VanDerWaalsContact O-CB 3.31Å; G201-A205 WeakPolarHBondContact O-CB 3.27Å; G201-A205 PolarHBondContact O-N 3.44Å
202	S	95.3	Very high	93.4	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-63.9	-43.8	-166.3	-53.7	0	0	0	0	113.8	V66 Q68 Y147 D200 A205 S206	V66-S202 WeakPolarHBondContact CG2-O 3.45Å; Q68-S202 PolarHBondContact NE2-OG 3.33Å; Y147-S202 VanDerWaalsContact CD1-OG 3.32Å; Y147-S202 WeakPolarHBondContact CD1-OG 3.31Å; D200-S202 VanDerWaalsContact C-N 3.26Å; D200-S202 PolarHBondContact O-N 2.81Å; D200-S202 WeakPolarHBondContact OD1-CB 3.48Å; D200-S202 PolarHBondContact OD1-N 2.84Å; D200-S202 PolarHBondContact OD1-OG 3.49Å; S202-A205 PolarHBondContact O-N 2.87Å; S202-S206 WeakPolarHBondContact O-CB 3.47Å; S202-S206 PolarHBondContact O-N 3.03Å
203	I	94.4	Very high	93.9	Very high	105 Å²	105	32.9 Å²	32.9	54%	0.538	17%	0.172	S	C	.	.	H	α-helix	trans	-64.9	-45.4	179.5	-64.7	175.5	0	0	0	110.4	L63 G201 A205 S206 Y207	L63-I203 HydrophobicContact CD1-CG2 4.15Å; G201-I203 PolarHBondContact O-N 2.88Å; I203-A205 VanDerWaalsContact C-N 3.34Å; I203-S206 PolarHBondContact O-N 3.25Å; I203-Y207 WeakPolarHBondContact O-CB 3.43Å; I203-Y207 PolarHBondContact O-N 3.47Å
204	L	94.9	Very high	94.4	Very high	70 Å²	70	32.9 Å²	32.9	37%	0.366	17%	0.172	S	C	.	.	H	α-helix	trans	-64.4	-40.8	178.7	178.7	61.4	0	0	0	111.3	M183 G201 G208 V212 F265	M183-L204 HydrophobicContact CE-CD2 4.27Å; M183-L204 HydrophobicContact SD-CD2 4.28Å; G201-L204 PolarHBondContact O-N 2.86Å; L204-G208 WeakPolarHBondContact O-CA 3.32Å; L204-G208 PolarHBondContact O-N 2.86Å; L204-V212 HydrophobicContact CB-CG2 4.08Å; L204-V212 HydrophobicContact CD2-CG2 3.89Å; L204-V212 HydrophobicContact CG-CG2 3.84Å; L204-F265 HydrophobicContact CD2-CZ 4.33Å
205	A	95.9	Very high	94.8	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-61.3	-52.5	177	0	0	0	0	0	111.3	P149 G201 S202 I203 N209 V210 V212	P149-A205 HydrophobicContact CB-CB 4.45Å; P149-A205 VanDerWaalsContact CB-O 3.29Å; P149-A205 WeakPolarHBondContact CB-O 3.31Å; P149-A205 WeakPolarHBondContact CG-O 3.49Å; G201-A205 VanDerWaalsContact O-CB 3.31Å; G201-A205 WeakPolarHBondContact O-CB 3.27Å; G201-A205 PolarHBondContact O-N 3.44Å; S202-A205 PolarHBondContact O-N 2.87Å; I203-A205 VanDerWaalsContact C-N 3.34Å; A205-N209 VanDerWaalsContact O-CA 3.3Å; A205-N209 WeakPolarHBondContact O-CA 3.23Å; A205-N209 PolarHBondContact O-N 3.42Å; A205-V210 WeakPolarHBondContact CA-O 3.45Å; A205-V210 WeakPolarHBondContact CB-O 3.42Å; A205-V210 PolarHBondContact O-N 3.02Å; A205-V212 HydrophobicContact CB-CB 4.47Å; A205-V212 HydrophobicContact CB-CG2 3.97Å
206	S	93.9	Very high	95	Very high	20 Å²	20	32.9 Å²	32.9	14%	0.14	17%	0.172	C	C	.	.	H	α-helix	trans	-65.8	-47.3	-178	-172.6	0	0	0	0	112.4	L58 G64 S202 I203	L58-S206 VanDerWaalsContact CD1-CB 3.47Å; G64-S206 PolarHBondContact N-OG 3.26Å; G64-S206 PolarHBondContact O-OG 2.9Å; S202-S206 WeakPolarHBondContact O-CB 3.47Å; S202-S206 PolarHBondContact O-N 3.03Å; I203-S206 PolarHBondContact O-N 3.25Å
207	Y	92.4	Very high	95.2	Very high	192 Å²	192	32.9 Å²	32.9	75%	0.753	17%	0.172	S	C	*	.	H	α-helix	trans	-69.3	-44	-179.3	-178.6	-97.3	0	0	0	112.7	L63 I203	L63-Y207 HydrophobicContact CD2-CD2 4.21Å; I203-Y207 WeakPolarHBondContact O-CB 3.43Å; I203-Y207 PolarHBondContact O-N 3.47Å
208	G	91.6	Very high	95.4	Very high	38 Å²	38	33 Å²	33	39%	0.392	17%	0.172	S	C	.	.	H	α-helix	trans	-83.7	-9.5	-176.5	0	0	0	0	0	114.4	L204 V210	L204-G208 WeakPolarHBondContact O-CA 3.32Å; L204-G208 PolarHBondContact O-N 2.86Å; G208-V210 WeakPolarHBondContact O-CG1 3.35Å; G208-V210 PolarHBondContact O-N 2.78Å
209	N	93.5	Very high	95.6	Very high	65 Å²	65	31.7 Å²	31.7	35%	0.348	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.4	45.2	-169.3	-169.2	27.4	0	0	0	112.3	K180 A205	K180-N209 PolarHBondContact NZ-OD1 3.18Å; A205-N209 VanDerWaalsContact O-CA 3.3Å; A205-N209 WeakPolarHBondContact O-CA 3.23Å; A205-N209 PolarHBondContact O-N 3.42Å
210	V	95.9	Very high	95.8	Very high	17 Å²	17	29.8 Å²	29.8	10%	0.103	16%	0.158	C	C	.	.			trans	-124.4	153.5	179.4	-65.3	0	0	0	0	110	P149 P181 M183 A205 G208 V212	P149-V210 VanDerWaalsContact CD-O 3.29Å; P149-V210 WeakPolarHBondContact CD-O 3.29Å; P149-V210 WeakPolarHBondContact CG-O 3.41Å; P181-V210 HydrophobicContact CB-CG1 3.88Å; P181-V210 HydrophobicContact CG-CG1 4.01Å; P181-V210 WeakPolarHBondContact O-CA 3.31Å; M183-V210 HydrophobicContact CG-CG2 4.38Å; M183-V210 HydrophobicContact SD-CG2 3.94Å; A205-V210 WeakPolarHBondContact CA-O 3.45Å; A205-V210 WeakPolarHBondContact CB-O 3.42Å; A205-V210 PolarHBondContact O-N 3.02Å; G208-V210 WeakPolarHBondContact O-CG1 3.35Å; G208-V210 PolarHBondContact O-N 2.78Å; V210-V212 HydrophobicContact CG2-CG2 4.08Å
211	I	98.1	Very high	95.9	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	128.2	168.1	-62.8	179.4	0	0	0	108.4	V146 Y147 V148 K180 P181 V182 M183 I213 I252 F255 G257	V146-I211 HydrophobicContact CG1-CG2 3.71Å; Y147-I211 WeakPolarHBondContact O-CA 3.45Å; V148-I211 HydrophobicContact CG1-CD1 4.33Å; V148-I211 HydrophobicContact CG1-CG1 4.28Å; V148-I211 HydrophobicContact CG2-CD1 4.33Å; V148-I211 HydrophobicContact CG2-CG1 4.41Å; V148-I211 HydrophobicContact CG2-CG2 4.39Å; K180-I211 HydrophobicContact CB-CG1 4.16Å; K180-I211 HydrophobicContact CD-CG1 4.46Å; P181-I211 PolarHBondContact O-N 3.02Å; V182-I211 CarbonylContact C-O 3.45Å; V182-I211 WeakPolarHBondContact CA-O 3.35Å; V182-I211 HydrophobicContact CG2-CB 4.47Å; M183-I211 PolarHBondContact N-O 3.25Å; I211-I213 HydrophobicContact CG2-CG1 4.2Å; I211-I252 HydrophobicContact CD1-CD1 4.38Å; I211-I252 HydrophobicContact CD1-CG1 4.36Å; I211-I252 HydrophobicContact CG2-CD1 3.98Å; I211-F255 HydrophobicContact CD1-CB 4.09Å; I211-F255 WeakPolarHBondContact CD1-O 3.47Å; I211-G257 VanDerWaalsContact CD1-CA 3.44Å
212	V	98.6	Very high	96	Very high	2 Å²	2	31 Å²	31	1%	0.012	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	136.1	175.4	-177.5	0	0	0	0	109	Y147 M183 L204 A205 V210	Y147-V212 WeakPolarHBondContact CD2-O 3.35Å; Y147-V212 PolarHBondContact N-O 2.98Å; Y147-V212 PolarHBondContact O-N 3.44Å; M183-V212 CarbonylContact O-C 3.46Å; M183-V212 WeakPolarHBondContact O-CA 3.29Å; L204-V212 HydrophobicContact CB-CG2 4.08Å; L204-V212 HydrophobicContact CD2-CG2 3.89Å; L204-V212 HydrophobicContact CG-CG2 3.84Å; A205-V212 HydrophobicContact CB-CB 4.47Å; A205-V212 HydrophobicContact CB-CG2 3.97Å; V210-V212 HydrophobicContact CG2-CG2 4.08Å
213	I	98.8	Very high	96	Very high	0 Å²	0	31 Å²	31	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	131	177.4	-56.5	-178.8	0	0	0	108.6	L144 N145 V146 V182 M183 V184 Y185 I211 V248 I252	L144-I213 HydrophobicContact CB-CG2 4.15Å; L144-I213 HydrophobicContact CD1-CG2 4.19Å; L144-I213 HydrophobicContact CD2-CG2 4.38Å; L144-I213 HydrophobicContact CG-CG2 4.49Å; N145-I213 VanDerWaalsContact O-CA 3.24Å; N145-I213 WeakPolarHBondContact O-CA 3.32Å; V146-I213 HydrophobicContact CG1-CG1 4.34Å; V146-I213 HydrophobicContact CG2-CG1 4.48Å; V182-I213 HydrophobicContact CG1-CD1 3.73Å; V182-I213 HydrophobicContact CG1-CG1 4.25Å; M183-I213 PolarHBondContact O-N 2.91Å; V184-I213 HydrophobicContact CG2-CB 4.3Å; V184-I213 HydrophobicContact CG2-CD1 4.32Å; Y185-I213 PolarHBondContact N-O 2.85Å; I211-I213 HydrophobicContact CG2-CG1 4.2Å; I213-V248 HydrophobicContact CD1-CB 4.26Å; I213-V248 HydrophobicContact CD1-CG1 3.67Å; I213-V248 HydrophobicContact CD1-CG2 3.51Å; I213-V248 HydrophobicContact CG2-CG2 4.42Å; I213-I252 HydrophobicContact CD1-CD1 3.62Å; I213-I252 HydrophobicContact CD1-CG1 4.34Å; I213-I252 HydrophobicContact CG1-CD1 4.49Å
214	T	98.4	Very high	96.2	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	145.8	167.8	67.9	0	0	0	0	108.8	L144 N145 Y147 Y185 G196 I199	L144-T214 CarbonylContact C-O 3.36Å; L144-T214 VanDerWaalsContact CA-O 3.23Å; L144-T214 WeakPolarHBondContact CA-O 3.39Å; L144-T214 WeakPolarHBondContact CB-O 3.33Å; N145-T214 PolarHBondContact N-O 3.46Å; N145-T214 PolarHBondContact ND2-OG1 3.4Å; N145-T214 VanDerWaalsContact ND2-OG1 3.13Å; N145-T214 PolarHBondContact O-N 2.93Å; Y147-T214 HydrophobicContact CE2-CG2 4.25Å; Y185-T214 HydrophobicContact CD1-CG2 4.32Å; G196-T214 WeakPolarHBondContact O-CB 3.28Å; G196-T214 PolarHBondContact O-OG1 2.84Å; I199-T214 HydrophobicContact CB-CG2 4.15Å; I199-T214 HydrophobicContact CG2-CG2 4.25Å
215	L	97.6	Very high	96.3	Very high	1 Å²	1	28.1 Å²	28.1	1%	0.005	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	152.4	-176.3	71.6	101.3	0	0	0	112.2	L144 V184 I186 H187 Y217 Q241 A244	L144-L215 HydrophobicContact CB-CB 3.89Å; V184-L215 HydrophobicContact CG1-CD2 3.64Å; I186-L215 HydrophobicContact CG1-CD2 4.28Å; H187-L215 PolarHBondContact CD2-O 3.32Å; L215-Y217 HydrophobicContact CD1-CD1 3.94Å; L215-Q241 HydrophobicContact CD1-CG 4.17Å; L215-A244 HydrophobicContact CD1-CB 4.36Å; L215-A244 HydrophobicContact CD2-CB 4.07Å
216	N	97.5	Very high	96.3	Very high	2 Å²	2	31.2 Å²	31.2	1%	0.011	17%	0.172	C	C	.	.			trans	-99.6	140.5	167.2	-69.8	-18	0	0	0	109.4	Y74 C141 Y143 T195 G196	Y74-N216 VanDerWaalsContact CE1-O 3.31Å; Y74-N216 WeakPolarHBondContact CE1-O 3.32Å; Y74-N216 PolarHBondContact OH-O 2.81Å; C141-N216 VanDerWaalsContact O-CB 3.24Å; C141-N216 WeakPolarHBondContact O-CB 3.46Å; Y143-N216 PolarHBondContact O-N 2.82Å; T195-N216 WeakPolarHBondContact CA-OD1 3.33Å; T195-N216 PolarHBondContact OG1-OD1 3.13Å; G196-N216 PolarHBondContact N-OD1 3.4Å
217	Y	98.1	Very high	96.4	Very high	0 Å²	0	34 Å²	34	0%	0	19%	0.188	C	C	.	.			trans	-132.8	156.3	173.2	58.5	-87.7	0	0	0	109.1	C106 I186 H187 L215 V219 F224 Q241	C106-Y217 VanDerWaalsContact SG-C 3.57Å; C106-Y217 PolarHBondContact SG-O 2.77Å; I186-Y217 HydrophobicContact CG2-CD1 4.37Å; I186-Y217 HydrophobicContact CG2-CE1 3.73Å; H187-Y217 AromaticContact CD2-CE1 3.7Å; H187-Y217 AromaticContact CE1-CE1 3.53Å; H187-Y217 AromaticContact CE1-CZ 3.73Å; H187-Y217 AromaticContact ND1-CE1 3.96Å; H187-Y217 AromaticContact NE2-CD1 3.68Å; H187-Y217 AromaticContact NE2-CE1 3.35Å; H187-Y217 WeakPolarHBondContact NE2-CE1 3.31Å; H187-Y217 PolarHBondContact O-OH 2.85Å; L215-Y217 HydrophobicContact CD1-CD1 3.94Å; Y217-V219 HydrophobicContact CD2-CG1 4.43Å; Y217-V219 HydrophobicContact CE2-CG1 4.14Å; Y217-V219 PolarHBondContact O-N 3.04Å; Y217-F224 HydrophobicContact CE2-CE2 4.42Å; Y217-F224 HydrophobicContact CE2-CZ 4.27Å; Y217-Q241 HydrophobicContact CD1-CG 4.06Å; Y217-Q241 HydrophobicContact CG-CG 4.01Å
218	R	98	Very high	96.6	Very high	7 Å²	7	28.3 Å²	28.3	3%	0.026	19%	0.188	C	C	.	.			trans	-57.9	131.1	178.9	-76	172.2	-76.5	-178	-4.5	110.6	P78 L85 L142 G223 F224 G237 D240	P78-R218 HydrophobicContact CG-CG 4.22Å; L85-R218 PolarHBondContact O-NH1 2.86Å; L85-R218 PolarHBondContact O-NH2 3.28Å; L142-R218 HydrophobicContact CD2-CG 4.15Å; R218-G223 VanDerWaalsContact CB-CA 3.49Å; R218-G223 WeakPolarHBondContact O-CA 3.37Å; R218-F224 WeakPolarHBondContact O-CE2 3.19Å; R218-G237 WeakPolarHBondContact O-CA 3.45Å; R218-D240 VanDerWaalsContact CB-OD2 3.23Å; R218-D240 WeakPolarHBondContact CB-OD2 3.44Å; R218-D240 VanDerWaalsContact CG-OD2 3.28Å; R218-D240 WeakPolarHBondContact CG-OD2 3.35Å; R218-D240 IonicContact CZ-OD1 2.74Å; R218-D240 IonicContact CZ-OD2 3.39Å; R218-D240 PolarHBondContact N-OD2 3.32Å; R218-D240 IonicContact NE-OD1 3.58Å; R218-D240 PolarHBondContact NE-OD1 2.86Å; R218-D240 IonicContact NE-OD2 2.81Å; R218-D240 PolarHBondContact NE-OD2 3.4Å; R218-D240 IonicContact NH2-OD1 3.12Å; R218-D240 PolarHBondContact NH2-OD1 3.05Å; R218-D240 IonicContact NH2-OD2 3.39Å
219	V	95.4	Very high	96.8	Very high	3 Å²	3	30.7 Å²	30.7	2%	0.018	19%	0.192	C	C	.	.			trans	-111.5	167	176.8	-64.3	0	0	0	0	111.2	C106 Q108 Y191 Y217 L222 G223	C106-V219 HydrophobicContact CB-CG2 4Å; Q108-V219 HydrophobicContact CB-CG2 4.11Å; Y191-V219 CarbonylContact O-C 3.51Å; Y191-V219 WeakPolarHBondContact O-CA 3.32Å; Y191-V219 VanDerWaalsContact O-CB 3.28Å; Y191-V219 WeakPolarHBondContact O-CB 3.38Å; Y217-V219 HydrophobicContact CD2-CG1 4.43Å; Y217-V219 HydrophobicContact CE2-CG1 4.14Å; Y217-V219 PolarHBondContact O-N 3.04Å; V219-L222 PolarHBondContact O-N 2.89Å; V219-G223 PolarHBondContact O-N 2.6Å; V219-G223 VanDerWaalsContact O-N 3.13Å
220	G	94.3	Very high	96.8	Very high	8 Å²	8	34.8 Å²	34.8	8%	0.082	21%	0.209	C	C	.	.	H	α-helix	trans	56.1	-139.1	176.4	0	0	0	0	0	113.9	Y191 M192 L222 G223 F224	Y191-G220 PolarHBondContact O-N 3.4Å; M192-G220 WeakPolarHBondContact SD-CA 3.39Å; G220-L222 VanDerWaalsContact C-N 3.25Å; G220-L222 PolarHBondContact O-N 3.4Å; G220-G223 PolarHBondContact O-N 3.1Å; G220-G223 VanDerWaalsContact O-N 3.14Å; G220-F224 PolarHBondContact O-N 3.34Å
221	V	95.7	Very high	96.7	Very high	91 Å²	91	38 Å²	38	55%	0.552	24%	0.238	S	C	*	.	H	α-helix	trans	-56.2	-42.7	-179.2	178.4	0	0	0	0	110.9	F84 G223 L225	F84-V221 HydrophobicContact CE1-CG1 4.33Å; F84-V221 WeakPolarHBondContact CE1-O 3.43Å; F84-V221 HydrophobicContact CZ-CG1 4.42Å; V221-G223 VanDerWaalsContact C-N 3.3Å; V221-G223 PolarHBondContact O-N 2.89Å; V221-L225 HydrophobicContact CG1-CB 4.07Å; V221-L225 HydrophobicContact CG1-CD1 3.67Å; V221-L225 WeakPolarHBondContact O-CB 3.24Å; V221-L225 PolarHBondContact O-N 2.92Å
222	L	97.1	Very high	96.5	Very high	30 Å²	30	38.3 Å²	38.3	16%	0.157	24%	0.24	C	C	.	.	H	α-helix	trans	-66.8	-31.4	-178.2	-61.9	177.4	0	0	0	112.9	R83 F84 P107 E139 V219 G220	R83-L222 HydrophobicContact CG-CD2 3.92Å; F84-L222 HydrophobicContact CE1-CD2 4.15Å; F84-L222 HydrophobicContact CZ-CD2 4.27Å; P107-L222 HydrophobicContact CB-CD1 4.14Å; P107-L222 HydrophobicContact CG-CD1 3.78Å; E139-L222 HydrophobicContact CG-CD1 3.83Å; V219-L222 PolarHBondContact O-N 2.89Å; G220-L222 VanDerWaalsContact C-N 3.25Å; G220-L222 PolarHBondContact O-N 3.4Å
223	G	96.8	Very high	96.4	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-88.2	-30.9	-179.6	0	0	0	0	0	114.6	R218 V219 G220 V221 Y236 G237	R218-G223 VanDerWaalsContact CB-CA 3.49Å; R218-G223 WeakPolarHBondContact O-CA 3.37Å; V219-G223 PolarHBondContact O-N 2.6Å; V219-G223 VanDerWaalsContact O-N 3.13Å; G220-G223 PolarHBondContact O-N 3.1Å; G220-G223 VanDerWaalsContact O-N 3.14Å; V221-G223 VanDerWaalsContact C-N 3.3Å; V221-G223 PolarHBondContact O-N 2.89Å; G223-Y236 WeakPolarHBondContact O-CA 3.5Å; G223-Y236 WeakPolarHBondContact O-CB 3.27Å; G223-Y236 PolarHBondContact O-N 2.9Å; G223-G237 PolarHBondContact O-N 2.69Å
224	F	96.8	Very high	96.3	Very high	48 Å²	48	44.7 Å²	44.7	21%	0.211	27%	0.269	C	S	.	.	H	α-helix	trans	-136.9	2.9	-161.9	-60.7	-81	0	0	0	115.1	Y191 Y217 R218 G220 S226 L238	Y191-F224 AromaticContact CD1-CE1 3.92Å; Y191-F224 HydrophobicContact CD1-CE1 3.92Å; Y191-F224 AromaticContact CD1-CE2 3.93Å; Y191-F224 HydrophobicContact CD1-CE2 3.93Å; Y191-F224 AromaticContact CD1-CZ 3.54Å; Y191-F224 HydrophobicContact CD1-CZ 3.54Å; Y191-F224 HydrophobicContact CE1-CE1 4.39Å; Y191-F224 HydrophobicContact CE1-CZ 4.31Å; Y191-F224 HydrophobicContact CG-CE2 4.31Å; Y191-F224 HydrophobicContact CG-CZ 4.32Å; Y217-F224 HydrophobicContact CE2-CE2 4.42Å; Y217-F224 HydrophobicContact CE2-CZ 4.27Å; R218-F224 WeakPolarHBondContact O-CE2 3.19Å; G220-F224 PolarHBondContact O-N 3.34Å; F224-S226 PolarHBondContact O-N 3.2Å; F224-L238 HydrophobicContact CE1-CG 4.25Å
225	L	97	Very high	96.2	Very high	66 Å²	66	49 Å²	49	35%	0.346	29%	0.293	S	S	.	.			trans	-57.8	125.7	173.9	179.1	141.4	0	0	0	110.8	F84 V221 A232 G234 Y236	F84-L225 HydrophobicContact CD1-CB 4.36Å; F84-L225 HydrophobicContact CD1-CD2 4.4Å; F84-L225 HydrophobicContact CE1-CB 4.11Å; F84-L225 HydrophobicContact CE1-CD2 4.45Å; V221-L225 HydrophobicContact CG1-CB 4.07Å; V221-L225 HydrophobicContact CG1-CD1 3.67Å; V221-L225 WeakPolarHBondContact O-CB 3.24Å; V221-L225 PolarHBondContact O-N 2.92Å; L225-A232 HydrophobicContact CD2-CB 3.69Å; L225-G234 WeakPolarHBondContact O-CA 3.38Å; L225-Y236 VanDerWaalsContact O-CE2 3.26Å; L225-Y236 WeakPolarHBondContact O-CE2 3.32Å
226	S	97.3	Very high	96.2	Very high	65 Å²	65	49.3 Å²	49.3	46%	0.455	29%	0.294	S	S	.	.			trans	-133.8	137.4	175.9	-174	0	0	0	0	109.7	F224 G228 A232 K233	F224-S226 PolarHBondContact O-N 3.2Å; S226-G228 PolarHBondContact OG-N 3.04Å; S226-A232 CarbonylContact C-O 3.55Å; S226-A232 VanDerWaalsContact CA-O 3.23Å; S226-A232 WeakPolarHBondContact CA-O 3.36Å; S226-A232 PolarHBondContact OG-O 2.97Å; S226-K233 PolarHBondContact OG-O 3.19Å
227	T	96.4	Very high	96.2	Very high	78 Å²	78	49.2 Å²	49.2	48%	0.479	29%	0.293	S	S	.	.			trans	-90.4	-6.8	170.5	47.5	0	0	0	0	112.1	D229 A232	T227-D229 WeakPolarHBondContact CB-OD1 3.4Å; T227-D229 PolarHBondContact O-N 3.03Å; T227-D229 PolarHBondContact OG1-OD1 3.31Å; T227-A232 HydrophobicContact CG2-CB 4.03Å; T227-A232 PolarHBondContact N-O 3.24Å; T227-A232 PolarHBondContact OG1-N 3.07Å; T227-A232 PolarHBondContact OG1-O 3.33Å
228	G	95.5	Very high	96.2	Very high	74 Å²	74	50.3 Å²	50.3	76%	0.763	30%	0.299	S	S	*	.	S	Bend	trans	74.7	8	-173.2	0	0	0	0	0	114.1	S226	S226-G228 PolarHBondContact OG-N 3.04Å
229	D	95.4	Very high	96.2	Very high	87 Å²	87	51.9 Å²	51.9	47%	0.465	31%	0.308	S	S	.	.	S	Bend	trans	-135.1	-163.2	178.3	68.2	18	0	0	0	111.7	T227 A231	T227-D229 WeakPolarHBondContact CB-OD1 3.4Å; T227-D229 PolarHBondContact O-N 3.03Å; T227-D229 PolarHBondContact OG1-OD1 3.31Å; D229-A231 VanDerWaalsContact C-N 3.32Å; D229-A231 VanDerWaalsContact OD1-CB 3.26Å; D229-A231 WeakPolarHBondContact OD1-CB 3.47Å; D229-A231 PolarHBondContact OD1-N 3.42Å
230	Q	94.2	Very high	96.3	Very high	151 Å²	151	51.8 Å²	51.8	71%	0.706	31%	0.307	S	S	*	.	S	Bend	trans	-77.6	-12.8	-177.8	-60.7	-60.1	-58.1	0	0	114
231	A	93.6	Very high	96.5	Very high	85 Å²	85	51.4 Å²	51.4	70%	0.702	30%	0.303	S	S	*	.	S	Bend	trans	-70.1	-43.9	-177.6	0	0	0	0	0	111.5	D229	D229-A231 VanDerWaalsContact C-N 3.32Å; D229-A231 VanDerWaalsContact OD1-CB 3.26Å; D229-A231 WeakPolarHBondContact OD1-CB 3.47Å; D229-A231 PolarHBondContact OD1-N 3.42Å
232	A	95.1	Very high	96.6	Very high	7 Å²	7	47.6 Å²	47.6	6%	0.058	28%	0.279	C	S	.	.			trans	-144.3	101.7	171.9	0	0	0	0	0	109.7	L225 S226 T227 G234 Y236	L225-A232 HydrophobicContact CD2-CB 3.69Å; S226-A232 CarbonylContact C-O 3.55Å; S226-A232 VanDerWaalsContact CA-O 3.23Å; S226-A232 WeakPolarHBondContact CA-O 3.36Å; S226-A232 PolarHBondContact OG-O 2.97Å; T227-A232 HydrophobicContact CG2-CB 4.03Å; T227-A232 PolarHBondContact N-O 3.24Å; T227-A232 PolarHBondContact OG1-N 3.07Å; T227-A232 PolarHBondContact OG1-O 3.33Å; A232-G234 VanDerWaalsContact C-N 3.28Å; A232-G234 PolarHBondContact O-N 3.15Å; A232-Y236 WeakPolarHBondContact CA-OH 3.28Å; A232-Y236 WeakPolarHBondContact CB-OH 3.23Å
233	K	95.5	Very high	96.6	Very high	130 Å²	130	47.3 Å²	47.3	57%	0.565	28%	0.277	S	S	*	.			trans	-70	-26.9	-178	-63.8	178.5	-177.1	-178	0	112.6	S226 Y236	S226-K233 PolarHBondContact OG-O 3.19Å; K233-Y236 PolarHBondContact N-OH 2.79Å
234	G	96	Very high	96.7	Very high	5 Å²	5	47.3 Å²	47.3	5%	0.052	28%	0.277	C	S	.	.			trans	80.9	-163.8	-174.1	0	0	0	0	0	113	L225 A232 Y236	L225-G234 WeakPolarHBondContact O-CA 3.38Å; A232-G234 VanDerWaalsContact C-N 3.28Å; A232-G234 PolarHBondContact O-N 3.15Å; G234-Y236 PolarHBondContact N-OH 2.97Å; G234-Y236 VanDerWaalsContact N-OH 3.17Å; G234-Y236 PolarHBondContact O-N 2.86Å
235	N	96.7	Very high	96.7	Very high	92 Å²	92	45.3 Å²	45.3	49%	0.492	27%	0.269	S	S	.	.			trans	58.1	22.7	-178.1	-61.7	-33.8	0	0	0	115.1	G237 L238 L239	N235-G237 VanDerWaalsContact C-N 3.27Å; N235-G237 PolarHBondContact O-N 2.67Å; N235-L238 HydrophobicContact CB-CB 4.46Å; N235-L238 HydrophobicContact CB-CD1 4.23Å; N235-L238 PolarHBondContact O-N 3.07Å; N235-L239 WeakPolarHBondContact O-CG 3.24Å; N235-L239 PolarHBondContact O-N 2.57Å
236	Y	98.1	Very high	96.7	Very high	7 Å²	7	47 Å²	47	3%	0.027	27%	0.271	C	S	.	.	H	α-helix	trans	-59.2	-38.5	178.9	-46.4	-60.2	0	0	0	112.2	F84 G223 L225 A232 K233 G234 L238 L239 D240	F84-Y236 HydrophobicContact CB-CD2 4.45Å; F84-Y236 HydrophobicContact CB-CE1 4.48Å; F84-Y236 HydrophobicContact CB-CE2 3.69Å; F84-Y236 HydrophobicContact CD1-CD2 4.25Å; F84-Y236 AromaticContact CD1-CE2 3.86Å; F84-Y236 HydrophobicContact CD1-CE2 3.86Å; F84-Y236 HydrophobicContact CG-CE2 4.25Å; F84-Y236 WeakPolarHBondContact O-CE1 3.45Å; F84-Y236 PolarHBondContact O-OH 2.95Å; G223-Y236 WeakPolarHBondContact O-CA 3.5Å; G223-Y236 WeakPolarHBondContact O-CB 3.27Å; G223-Y236 PolarHBondContact O-N 2.9Å; L225-Y236 VanDerWaalsContact O-CE2 3.26Å; L225-Y236 WeakPolarHBondContact O-CE2 3.32Å; A232-Y236 WeakPolarHBondContact CA-OH 3.28Å; A232-Y236 WeakPolarHBondContact CB-OH 3.23Å; K233-Y236 PolarHBondContact N-OH 2.79Å; G234-Y236 PolarHBondContact N-OH 2.97Å; G234-Y236 VanDerWaalsContact N-OH 3.17Å; G234-Y236 PolarHBondContact O-N 2.86Å; Y236-L238 VanDerWaalsContact C-N 3.32Å; Y236-L238 PolarHBondContact O-N 3.24Å; Y236-L239 WeakPolarHBondContact O-CB 3.4Å; Y236-L239 PolarHBondContact O-N 2.93Å; Y236-D240 PolarHBondContact O-N 2.99Å
237	G	97.4	Very high	96.8	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-64	-31.8	174.7	0	0	0	0	0	113.9	R218 G223 N235 D240 Q241	R218-G237 WeakPolarHBondContact O-CA 3.45Å; G223-G237 PolarHBondContact O-N 2.69Å; N235-G237 VanDerWaalsContact C-N 3.27Å; N235-G237 PolarHBondContact O-N 2.67Å; G237-D240 WeakPolarHBondContact O-CB 3.4Å; G237-Q241 WeakPolarHBondContact O-CG 3.35Å; G237-Q241 PolarHBondContact O-N 2.93Å
238	L	97.1	Very high	96.9	Very high	22 Å²	22	40.2 Å²	40.2	12%	0.115	23%	0.226	C	C	.	.	H	α-helix	trans	-74.6	-37.4	172.8	-64.9	175.8	0	0	0	111.3	F224 N235 Y236 D240 Q241 I242 C273 L276	F224-L238 HydrophobicContact CE1-CG 4.25Å; N235-L238 HydrophobicContact CB-CB 4.46Å; N235-L238 HydrophobicContact CB-CD1 4.23Å; N235-L238 PolarHBondContact O-N 3.07Å; Y236-L238 VanDerWaalsContact C-N 3.32Å; Y236-L238 PolarHBondContact O-N 3.24Å; L238-D240 VanDerWaalsContact C-N 3.28Å; L238-D240 PolarHBondContact O-N 3.19Å; L238-Q241 WeakPolarHBondContact O-CB 3.4Å; L238-Q241 PolarHBondContact O-N 2.81Å; L238-I242 WeakPolarHBondContact O-CG1 3.24Å; L238-I242 PolarHBondContact O-N 2.94Å; L238-C273 HydrophobicContact CD2-CB 4.24Å; L238-L276 HydrophobicContact CD1-CB 4.39Å; L238-L276 HydrophobicContact CD1-CD1 4.03Å; L238-L276 HydrophobicContact CD2-CD1 4.41Å
239	L	98	Very high	96.9	Very high	41 Å²	41	38.2 Å²	38.2	22%	0.215	20%	0.2	C	C	.	.	H	α-helix	trans	-64.3	-35.6	174.4	-64.8	172	0	0	0	111.4	P86 P87 N235 Y236 I242 Q243	P86-L239 HydrophobicContact CB-CD1 4.05Å; P86-L239 HydrophobicContact CG-CD1 4.05Å; P87-L239 HydrophobicContact CG-CB 4.26Å; P87-L239 WeakPolarHBondContact CG-O 3.46Å; N235-L239 WeakPolarHBondContact O-CG 3.24Å; N235-L239 PolarHBondContact O-N 2.57Å; Y236-L239 WeakPolarHBondContact O-CB 3.4Å; Y236-L239 PolarHBondContact O-N 2.93Å; L239-I242 HydrophobicContact CD2-CD1 4.35Å; L239-I242 PolarHBondContact O-N 2.89Å; L239-Q243 WeakPolarHBondContact O-CB 3.34Å; L239-Q243 PolarHBondContact O-N 3.13Å
240	D	98.6	Very high	96.9	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-60.2	-45.8	172.1	-65.5	-17.8	0	0	0	111.5	Y74 P87 L142 R218 Y236 G237 L238 I242 Q243 A244	Y74-D240 VanDerWaalsContact CE2-O 3.27Å; Y74-D240 WeakPolarHBondContact CE2-O 3.38Å; P87-D240 WeakPolarHBondContact CB-OD1 3.49Å; P87-D240 WeakPolarHBondContact CG-OD1 3.49Å; L142-D240 HydrophobicContact CD2-CB 4.18Å; L142-D240 WeakPolarHBondContact CD2-OD2 3.47Å; R218-D240 VanDerWaalsContact CB-OD2 3.23Å; R218-D240 WeakPolarHBondContact CB-OD2 3.44Å; R218-D240 VanDerWaalsContact CG-OD2 3.28Å; R218-D240 WeakPolarHBondContact CG-OD2 3.35Å; R218-D240 IonicContact CZ-OD1 2.74Å; R218-D240 IonicContact CZ-OD2 3.39Å; R218-D240 PolarHBondContact N-OD2 3.32Å; R218-D240 IonicContact NE-OD1 3.58Å; R218-D240 PolarHBondContact NE-OD1 2.86Å; R218-D240 IonicContact NE-OD2 2.81Å; R218-D240 PolarHBondContact NE-OD2 3.4Å; R218-D240 IonicContact NH2-OD1 3.12Å; R218-D240 PolarHBondContact NH2-OD1 3.05Å; R218-D240 IonicContact NH2-OD2 3.39Å; Y236-D240 PolarHBondContact O-N 2.99Å; G237-D240 WeakPolarHBondContact O-CB 3.4Å; L238-D240 VanDerWaalsContact C-N 3.28Å; L238-D240 PolarHBondContact O-N 3.19Å; D240-I242 VanDerWaalsContact C-N 3.32Å; D240-I242 PolarHBondContact O-N 3.32Å; D240-Q243 PolarHBondContact O-N 3.45Å; D240-A244 PolarHBondContact O-N 2.81Å
241	Q	98.1	Very high	97.1	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-61.4	-41	175.7	-66	163.3	18.6	0	0	111.7	I186 L215 Y217 G237 L238 A244 L245 C273 L277	I186-Q241 HydrophobicContact CD1-CB 4.41Å; I186-Q241 HydrophobicContact CD1-CG 4.25Å; L215-Q241 HydrophobicContact CD1-CG 4.17Å; Y217-Q241 HydrophobicContact CD1-CG 4.06Å; Y217-Q241 HydrophobicContact CG-CG 4.01Å; G237-Q241 WeakPolarHBondContact O-CG 3.35Å; G237-Q241 PolarHBondContact O-N 2.93Å; L238-Q241 WeakPolarHBondContact O-CB 3.4Å; L238-Q241 PolarHBondContact O-N 2.81Å; Q241-A244 PolarHBondContact O-N 3.29Å; Q241-L245 VanDerWaalsContact O-CG 3.31Å; Q241-L245 WeakPolarHBondContact O-CG 3.4Å; Q241-L245 PolarHBondContact O-N 3.36Å; Q241-C273 PolarHBondContact NE2-SG 3.18Å; Q241-C273 VanDerWaalsContact NE2-SG 3.45Å; Q241-L277 HydrophobicContact CB-CD1 4.22Å; Q241-L277 HydrophobicContact CB-CD2 4.4Å
242	I	97.4	Very high	97.3	Very high	11 Å²	11	27.6 Å²	27.6	6%	0.056	13%	0.134	C	C	.	.	H	α-helix	trans	-63.6	-43.9	175.5	-68.6	161	0	0	0	110.9	L238 L239 D240 A244 L245 R246 L277 H282 I286	L238-I242 WeakPolarHBondContact O-CG1 3.24Å; L238-I242 PolarHBondContact O-N 2.94Å; L239-I242 HydrophobicContact CD2-CD1 4.35Å; L239-I242 PolarHBondContact O-N 2.89Å; D240-I242 VanDerWaalsContact C-N 3.32Å; D240-I242 PolarHBondContact O-N 3.32Å; I242-A244 VanDerWaalsContact C-N 3.34Å; I242-A244 PolarHBondContact O-N 3.24Å; I242-L245 PolarHBondContact O-N 2.96Å; I242-R246 WeakPolarHBondContact O-CG 3.44Å; I242-R246 PolarHBondContact O-N 3.27Å; I242-L277 HydrophobicContact CD1-CD2 4.03Å; I242-L277 HydrophobicContact CG1-CD2 3.5Å; I242-H282 HydrophobicContact CD1-CB 3.75Å; I242-I286 HydrophobicContact CG2-CD1 4.44Å
243	Q	98.2	Very high	97.3	Very high	24 Å²	24	30.1 Å²	30.1	11%	0.112	15%	0.154	C	C	.	.	H	α-helix	trans	-63.9	-39.2	177	178.9	54.7	49.1	0	0	111.7	Y74 A75 P87 L239 D240 R246 W247	Y74-Q243 HydrophobicContact CD2-CB 4.44Å; Y74-Q243 HydrophobicContact CD2-CG 4.1Å; Y74-Q243 HydrophobicContact CE2-CB 4.42Å; Y74-Q243 HydrophobicContact CE2-CG 4.43Å; Y74-Q243 PolarHBondContact O-NE2 3.42Å; A75-Q243 HydrophobicContact CB-CG 3.94Å; P87-Q243 HydrophobicContact CB-CB 4.11Å; P87-Q243 HydrophobicContact CB-CG 4.1Å; P87-Q243 HydrophobicContact CG-CB 3.56Å; P87-Q243 HydrophobicContact CG-CG 4.06Å; L239-Q243 WeakPolarHBondContact O-CB 3.34Å; L239-Q243 PolarHBondContact O-N 3.13Å; D240-Q243 PolarHBondContact O-N 3.45Å; Q243-R246 PolarHBondContact O-N 3.31Å; Q243-W247 PolarHBondContact O-N 2.89Å
244	A	98.3	Very high	97.4	Very high	1 Å²	1	28 Å²	28	1%	0.008	15%	0.145	C	C	.	.	H	α-helix	trans	-61.4	-45.1	172.7	0	0	0	0	0	111.3	Y74 L215 D240 Q241 I242 R246 W247 V248	Y74-A244 HydrophobicContact CD1-CB 4.13Å; Y74-A244 HydrophobicContact CD2-CB 3.69Å; Y74-A244 HydrophobicContact CE1-CB 4.15Å; Y74-A244 HydrophobicContact CE2-CB 3.76Å; Y74-A244 HydrophobicContact CG-CB 3.9Å; L215-A244 HydrophobicContact CD1-CB 4.36Å; L215-A244 HydrophobicContact CD2-CB 4.07Å; D240-A244 PolarHBondContact O-N 2.81Å; Q241-A244 PolarHBondContact O-N 3.29Å; I242-A244 VanDerWaalsContact C-N 3.34Å; I242-A244 PolarHBondContact O-N 3.24Å; A244-R246 VanDerWaalsContact C-N 3.34Å; A244-R246 PolarHBondContact O-N 2.84Å; A244-W247 WeakPolarHBondContact O-CB 3.46Å; A244-W247 PolarHBondContact O-N 3.29Å; A244-V248 VanDerWaalsContact O-CG2 3.29Å; A244-V248 WeakPolarHBondContact O-CG2 3.28Å; A244-V248 PolarHBondContact O-N 3.29Å
245	L	97.8	Very high	97.4	Very high	6 Å²	6	28.3 Å²	28.3	3%	0.031	15%	0.145	C	C	.	.	H	α-helix	trans	-64	-37.2	177.5	-70.1	173	0	0	0	112.8	V184 Q241 I242 V248 S249 V264 L277 I286	V184-L245 HydrophobicContact CB-CD2 4.18Å; V184-L245 HydrophobicContact CG1-CD2 3.98Å; V184-L245 HydrophobicContact CG2-CD2 4.14Å; Q241-L245 VanDerWaalsContact O-CG 3.31Å; Q241-L245 WeakPolarHBondContact O-CG 3.4Å; Q241-L245 PolarHBondContact O-N 3.36Å; I242-L245 PolarHBondContact O-N 2.96Å; L245-V248 PolarHBondContact O-N 3.39Å; L245-S249 WeakPolarHBondContact O-CB 3.39Å; L245-S249 PolarHBondContact O-N 3.4Å; L245-V264 HydrophobicContact CD1-CG2 4.17Å; L245-V264 HydrophobicContact CD2-CG2 3.62Å; L245-L277 HydrophobicContact CD1-CD1 4.15Å; L245-I286 HydrophobicContact CB-CD1 3.84Å; L245-I286 HydrophobicContact CB-CG2 4.2Å
246	R	97.1	Very high	97.3	Very high	101 Å²	101	25.6 Å²	25.6	38%	0.381	14%	0.139	S	C	.	.	H	α-helix	trans	-62	-48.8	171.8	-72.2	172.9	-176.7	-98.1	-7.2	111	I242 Q243 A244 V248 S249 E250 H282 I286	I242-R246 WeakPolarHBondContact O-CG 3.44Å; I242-R246 PolarHBondContact O-N 3.27Å; Q243-R246 PolarHBondContact O-N 3.31Å; A244-R246 VanDerWaalsContact C-N 3.34Å; A244-R246 PolarHBondContact O-N 2.84Å; R246-V248 VanDerWaalsContact C-N 3.29Å; R246-V248 PolarHBondContact O-N 2.99Å; R246-S249 PolarHBondContact O-N 3.09Å; R246-E250 WeakPolarHBondContact O-CG 3.34Å; R246-E250 PolarHBondContact O-N 3.13Å; R246-H282 PolarHBondContact NH2-O 3.24Å; R246-I286 HydrophobicContact CG-CD1 4.22Å
247	W	98.2	Very high	97.2	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-56.7	-44.1	176.1	-174.7	99	0	0	0	111.6	T46 F48 V72 L144 Q243 A244 E250 N251 F255	T46-W247 HydrophobicContact CG2-CZ2 4.24Å; F48-W247 AromaticContact CD2-NE1 3.65Å; F48-W247 AromaticContact CE2-CD1 3.58Å; F48-W247 AromaticContact CE2-NE1 3.68Å; V72-W247 HydrophobicContact CG1-CH2 3.67Å; V72-W247 HydrophobicContact CG1-CZ2 3.43Å; V72-W247 VanDerWaalsContact CG1-CZ2 3.43Å; L144-W247 HydrophobicContact CD1-CE3 4.24Å; L144-W247 HydrophobicContact CD1-CH2 4.2Å; L144-W247 HydrophobicContact CD1-CZ3 3.77Å; L144-W247 HydrophobicContact CD2-CD2 4.23Å; L144-W247 HydrophobicContact CD2-CE3 3.63Å; L144-W247 HydrophobicContact CD2-CZ3 4.03Å; L144-W247 HydrophobicContact CG-CE3 4.48Å; L144-W247 HydrophobicContact CG-CZ3 4.48Å; Q243-W247 PolarHBondContact O-N 2.89Å; A244-W247 WeakPolarHBondContact O-CB 3.46Å; A244-W247 PolarHBondContact O-N 3.29Å; W247-E250 PolarHBondContact O-N 3.31Å; W247-N251 HydrophobicContact CD2-CB 4.23Å; W247-N251 HydrophobicContact CE3-CB 4.25Å; W247-N251 HydrophobicContact CH2-CB 4.03Å; W247-N251 HydrophobicContact CZ2-CB 4.01Å; W247-N251 HydrophobicContact CZ3-CB 4.16Å; W247-N251 WeakPolarHBondContact O-CB 3.26Å; W247-N251 PolarHBondContact O-N 2.95Å; W247-N251 PolarHBondContact O-ND2 2.98Å; W247-F255 AromaticContact CH2-CE2 3.86Å; W247-F255 HydrophobicContact CH2-CE2 3.86Å; W247-F255 HydrophobicContact CH2-CZ 4.08Å; W247-F255 HydrophobicContact CZ3-CE2 4.5Å
248	V	98.1	Very high	97.1	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-62	-49.6	176.9	171.7	0	0	0	0	110.4	L144 V182 V184 I213 A244 L245 R246 E250 N251 I252 I262	L144-V248 HydrophobicContact CD2-CG2 4.21Å; V182-V248 HydrophobicContact CG1-CG1 4.01Å; V184-V248 HydrophobicContact CG2-CG1 4.25Å; I213-V248 HydrophobicContact CD1-CB 4.26Å; I213-V248 HydrophobicContact CD1-CG1 3.67Å; I213-V248 HydrophobicContact CD1-CG2 3.51Å; I213-V248 HydrophobicContact CG2-CG2 4.42Å; A244-V248 VanDerWaalsContact O-CG2 3.29Å; A244-V248 WeakPolarHBondContact O-CG2 3.28Å; A244-V248 PolarHBondContact O-N 3.29Å; L245-V248 PolarHBondContact O-N 3.39Å; R246-V248 VanDerWaalsContact C-N 3.29Å; R246-V248 PolarHBondContact O-N 2.99Å; V248-E250 PolarHBondContact O-N 3.25Å; V248-N251 PolarHBondContact O-N 3.03Å; V248-I252 HydrophobicContact CG1-CB 4.03Å; V248-I252 HydrophobicContact CG1-CG1 4.3Å; V248-I252 HydrophobicContact CG1-CG2 4.32Å; V248-I252 WeakPolarHBondContact O-CB 3.47Å; V248-I252 WeakPolarHBondContact O-CG2 3.15Å; V248-I252 PolarHBondContact O-N 3.22Å; V248-I262 HydrophobicContact CG1-CD1 3.99Å; V248-I262 HydrophobicContact CG1-CG1 4.46Å
249	S	95.4	Very high	96.9	Very high	32 Å²	32	26.4 Å²	26.4	22%	0.224	15%	0.146	C	C	.	.	H	α-helix	trans	-57	-35.4	178.9	-173	0	0	0	0	112.8	L245 R246 P259 P287	L245-S249 WeakPolarHBondContact O-CB 3.39Å; L245-S249 PolarHBondContact O-N 3.4Å; R246-S249 PolarHBondContact O-N 3.09Å; S249-P259 WeakPolarHBondContact O-CB 3.4Å; S249-P287 WeakPolarHBondContact OG-CD 3.19Å
250	E	96.1	Very high	96.5	Very high	101 Å²	101	32.4 Å²	32.4	47%	0.472	17%	0.166	S	C	.	.	H	α-helix	trans	-84.6	-29.6	-177.9	-69.4	169.5	-170.2	0	0	113.1	H47 R246 W247 V248	H47-E250 PolarHBondContact CD2-O 3.32Å; H47-E250 VanDerWaalsContact CD2-O 3.28Å; H47-E250 PolarHBondContact NE2-O 2.79Å; R246-E250 WeakPolarHBondContact O-CG 3.34Å; R246-E250 PolarHBondContact O-N 3.13Å; W247-E250 PolarHBondContact O-N 3.31Å; V248-E250 PolarHBondContact O-N 3.25Å
251	N	98	Very high	96.2	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-114.2	-17.5	-168.7	-65.3	-87.5	0	0	0	114.6	T46 H47 W247 V248 A253 F254 F255	T46-N251 WeakPolarHBondContact CB-OD1 3.37Å; H47-N251 PolarHBondContact CD2-OD1 2.87Å; H47-N251 PolarHBondContact N-OD1 3.4Å; W247-N251 HydrophobicContact CD2-CB 4.23Å; W247-N251 HydrophobicContact CE3-CB 4.25Å; W247-N251 HydrophobicContact CH2-CB 4.03Å; W247-N251 HydrophobicContact CZ2-CB 4.01Å; W247-N251 HydrophobicContact CZ3-CB 4.16Å; W247-N251 WeakPolarHBondContact O-CB 3.26Å; W247-N251 PolarHBondContact O-N 2.95Å; W247-N251 PolarHBondContact O-ND2 2.98Å; V248-N251 PolarHBondContact O-N 3.03Å; N251-A253 PolarHBondContact O-N 3.2Å; N251-F254 HydrophobicContact CB-CD2 4.37Å; N251-F254 WeakPolarHBondContact O-CB 3.35Å; N251-F254 VanDerWaalsContact O-CD2 3.31Å; N251-F254 WeakPolarHBondContact O-CD2 3.18Å; N251-F254 PolarHBondContact O-N 2.04Å; N251-F255 WeakPolarHBondContact O-CD2 2.99Å
252	I	97.6	Very high	96.1	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	17%	0.174	C	C	.	.	G	3₁₀ helix	trans	-68	-22.7	-169.2	-155.7	58.6	0	0	0	113.7	V146 V182 I211 I213 V248 F254 F255 G256 G257 P259	V146-I252 HydrophobicContact CG1-CD1 4.22Å; V182-I252 HydrophobicContact CB-CG1 4.45Å; V182-I252 HydrophobicContact CG1-CD1 4.5Å; V182-I252 HydrophobicContact CG1-CG1 3.98Å; V182-I252 HydrophobicContact CG2-CB 4.42Å; V182-I252 HydrophobicContact CG2-CG1 3.59Å; V182-I252 HydrophobicContact CG2-CG2 4.02Å; I211-I252 HydrophobicContact CD1-CD1 4.38Å; I211-I252 HydrophobicContact CD1-CG1 4.36Å; I211-I252 HydrophobicContact CG2-CD1 3.98Å; I213-I252 HydrophobicContact CD1-CD1 3.62Å; I213-I252 HydrophobicContact CD1-CG1 4.34Å; I213-I252 HydrophobicContact CG1-CD1 4.49Å; V248-I252 HydrophobicContact CG1-CB 4.03Å; V248-I252 HydrophobicContact CG1-CG1 4.3Å; V248-I252 HydrophobicContact CG1-CG2 4.32Å; V248-I252 WeakPolarHBondContact O-CB 3.47Å; V248-I252 WeakPolarHBondContact O-CG2 3.15Å; V248-I252 PolarHBondContact O-N 3.22Å; I252-F254 PolarHBondContact O-N 3.3Å; I252-F255 HydrophobicContact CD1-CB 4.14Å; I252-F255 HydrophobicContact CD1-CD2 4.12Å; I252-F255 HydrophobicContact CD1-CG 4.3Å; I252-F255 WeakPolarHBondContact O-CB 3.23Å; I252-F255 PolarHBondContact O-N 3.18Å; I252-G256 PolarHBondContact O-N 3.42Å; I252-G257 PolarHBondContact O-N 3.17Å; I252-P259 HydrophobicContact CG2-CB 4.09Å
253	A	96.3	Very high	96	Very high	59 Å²	59	36.7 Å²	36.7	49%	0.488	19%	0.188	S	C	.	.	G	3₁₀ helix	trans	-57.7	-35	172.5	0	0	0	0	0	112.5	N251 F255 G256 G257	N251-A253 PolarHBondContact O-N 3.2Å; A253-F255 PolarHBondContact O-N 3.01Å; A253-G256 PolarHBondContact O-N 3.22Å; A253-G257 WeakPolarHBondContact CA-O 3.06Å
254	F	96.8	Very high	96	Very high	86 Å²	86	36.9 Å²	36.9	38%	0.377	19%	0.191	S	C	.	.	G	3₁₀ helix	trans	-68.7	-18.2	177.2	-59.7	-66.1	0	0	0	113.7	V44 N45 H47 N251 I252	V44-F254 HydrophobicContact CG1-CB 3.73Å; V44-F254 WeakPolarHBondContact CG1-O 3.46Å; N45-F254 WeakPolarHBondContact O-CB 3.36Å; N45-F254 WeakPolarHBondContact O-CD1 3.44Å; N45-F254 VanDerWaalsContact O-CD2 3.31Å; N45-F254 WeakPolarHBondContact O-CD2 3.47Å; N45-F254 WeakPolarHBondContact O-CG 3.03Å; H47-F254 AromaticContact CD2-CE2 3.63Å; H47-F254 AromaticContact NE2-CE2 3.64Å; H47-F254 AromaticContact NE2-CZ 3.88Å; N251-F254 HydrophobicContact CB-CD2 4.37Å; N251-F254 WeakPolarHBondContact O-CB 3.35Å; N251-F254 VanDerWaalsContact O-CD2 3.31Å; N251-F254 WeakPolarHBondContact O-CD2 3.18Å; N251-F254 PolarHBondContact O-N 2.04Å; I252-F254 PolarHBondContact O-N 3.3Å
255	F	96.9	Very high	95.8	Very high	11 Å²	11	39.8 Å²	39.8	5%	0.048	20%	0.203	C	C	.	.	G	3₁₀ helix	trans	-94.7	5.3	174.8	-61.6	-96.8	0	0	0	112.2	V44 T46 L51 Y69 V146 V148 I211 W247 N251 I252 A253	V44-F255 HydrophobicContact CB-CD1 4.4Å; V44-F255 HydrophobicContact CB-CE1 4.2Å; V44-F255 HydrophobicContact CG1-CD1 4.07Å; V44-F255 HydrophobicContact CG1-CD2 4.11Å; V44-F255 HydrophobicContact CG1-CE1 3.91Å; V44-F255 HydrophobicContact CG1-CE2 3.96Å; V44-F255 HydrophobicContact CG1-CG 4.18Å; V44-F255 HydrophobicContact CG1-CZ 3.87Å; V44-F255 HydrophobicContact CG2-CD1 4.21Å; V44-F255 HydrophobicContact CG2-CE1 4.46Å; T46-F255 HydrophobicContact CG2-CE2 4.12Å; T46-F255 HydrophobicContact CG2-CZ 4.18Å; L51-F255 HydrophobicContact CD1-CZ 3.94Å; Y69-F255 AromaticContact CD1-CE1 3.99Å; Y69-F255 HydrophobicContact CD1-CE1 3.99Å; Y69-F255 AromaticContact CD2-CD1 3.87Å; Y69-F255 HydrophobicContact CD2-CD1 3.87Å; Y69-F255 AromaticContact CD2-CE1 3.68Å; Y69-F255 HydrophobicContact CD2-CE1 3.68Å; Y69-F255 HydrophobicContact CE1-CE1 4.19Å; Y69-F255 AromaticContact CE2-CD1 3.79Å; Y69-F255 HydrophobicContact CE2-CD1 3.79Å; Y69-F255 AromaticContact CE2-CE1 3.91Å; Y69-F255 HydrophobicContact CE2-CE1 3.91Å; Y69-F255 HydrophobicContact CG-CD1 4.39Å; Y69-F255 AromaticContact CG-CE1 3.73Å; Y69-F255 HydrophobicContact CG-CE1 3.73Å; V146-F255 HydrophobicContact CB-CE1 4.43Å; V146-F255 HydrophobicContact CG1-CD1 4Å; V146-F255 HydrophobicContact CG1-CE1 4.36Å; V146-F255 HydrophobicContact CG1-CG 4.33Å; V146-F255 HydrophobicContact CG2-CE1 4.46Å; V148-F255 WeakPolarHBondContact CG1-O 3.38Å; V148-F255 HydrophobicContact CG2-CB 4.05Å; V148-F255 HydrophobicContact CG2-CD1 4.13Å; I211-F255 HydrophobicContact CD1-CB 4.09Å; I211-F255 WeakPolarHBondContact CD1-O 3.47Å; W247-F255 AromaticContact CH2-CE2 3.86Å; W247-F255 HydrophobicContact CH2-CE2 3.86Å; W247-F255 HydrophobicContact CH2-CZ 4.08Å; W247-F255 HydrophobicContact CZ3-CE2 4.5Å; N251-F255 WeakPolarHBondContact O-CD2 2.99Å; I252-F255 HydrophobicContact CD1-CB 4.14Å; I252-F255 HydrophobicContact CD1-CD2 4.12Å; I252-F255 HydrophobicContact CD1-CG 4.3Å; I252-F255 WeakPolarHBondContact O-CB 3.23Å; I252-F255 PolarHBondContact O-N 3.18Å; A253-F255 PolarHBondContact O-N 3.01Å
256	G	94.8	Very high	95.6	Very high	35 Å²	35	40.6 Å²	40.6	36%	0.361	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	79.7	17.6	-174.5	0	0	0	0	0	114	A179 K180 I252 A253	A179-G256 CarbonylContact C-O 3.59Å; A179-G256 WeakPolarHBondContact CA-O 3.37Å; K180-G256 PolarHBondContact N-O 3.4Å; I252-G256 PolarHBondContact O-N 3.42Å; A253-G256 PolarHBondContact O-N 3.22Å
257	G	95.5	Very high	95.1	Very high	2 Å²	2	38.7 Å²	38.7	2%	0.021	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	154.1	176	0	0	0	0	0	113.2	K180 I211 I252 A253 P259	K180-G257 CarbonylContact O-C 3.46Å; K180-G257 WeakPolarHBondContact O-CA 3.45Å; I211-G257 VanDerWaalsContact CD1-CA 3.44Å; I252-G257 PolarHBondContact O-N 3.17Å; A253-G257 WeakPolarHBondContact CA-O 3.06Å; G257-P259 WeakPolarHBondContact O-CD 3.34Å
258	D	94	Very high	94.6	Very high	9 Å²	9	41.2 Å²	41.2	5%	0.048	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	110.3	175.1	-175.1	-6.1	0	0	0	110.3	A179 K180 R260 R261	A179-D258 HydrophobicContact CB-CB 3.8Å; K180-D258 PolarHBondContact O-N 3.01Å; D258-R260 PolarHBondContact O-N 2.94Å; D258-R260 VanDerWaalsContact O-N 3.12Å; D258-R260 VanDerWaalsContact OD1-CB 3.28Å; D258-R260 WeakPolarHBondContact OD1-CB 3.37Å; D258-R260 PolarHBondContact OD1-N 2.89Å; D258-R260 IonicContact OD1-NE 3.66Å; D258-R261 HydrophobicContact CB-CB 4.24Å; D258-R261 PolarHBondContact O-N 3.23Å; D258-R261 IonicContact OD2-CZ 3.54Å; D258-R261 IonicContact OD2-NE 2.76Å; D258-R261 PolarHBondContact OD2-NE 3.13Å; D258-R261 IonicContact OD2-NH2 2.73Å; D258-R261 PolarHBondContact OD2-NH2 3.22Å
259	P	93	Very high	94.1	Very high	36 Å²	36	43.1 Å²	43.1	23%	0.234	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	-13	179.3	29.3	-35.6	0	0	0	112.9	S249 I252 G257 I262 P287	S249-P259 WeakPolarHBondContact O-CB 3.4Å; I252-P259 HydrophobicContact CG2-CB 4.09Å; G257-P259 WeakPolarHBondContact O-CD 3.34Å; P259-I262 WeakPolarHBondContact O-CD1 3.28Å; P259-P287 WeakPolarHBondContact O-CB 3.41Å
260	R	90.9	Very high	93.8	Very high	166 Å²	166	41.6 Å²	41.6	63%	0.626	24%	0.24	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-86	-11.7	175.6	-55.9	-179.1	-62	173	2.5	113.4	D258	D258-R260 PolarHBondContact O-N 2.94Å; D258-R260 VanDerWaalsContact O-N 3.12Å; D258-R260 VanDerWaalsContact OD1-CB 3.28Å; D258-R260 WeakPolarHBondContact OD1-CB 3.37Å; D258-R260 PolarHBondContact OD1-N 2.89Å; D258-R260 IonicContact OD1-NE 3.66Å
261	R	92	Very high	93.6	Very high	46 Å²	46	39 Å²	39	17%	0.174	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	55.5	-177.3	-68.8	-172.3	-66	150.8	8.8	111.5	I174 S177 A179 V182 D258	I174-R261 PolarHBondContact O-NH1 3.37Å; S177-R261 PolarHBondContact OG-NH2 3.29Å; A179-R261 PolarHBondContact O-NH2 3.18Å; V182-R261 PolarHBondContact N-O 3.14Å; D258-R261 HydrophobicContact CB-CB 4.24Å; D258-R261 PolarHBondContact O-N 3.23Å; D258-R261 IonicContact OD2-CZ 3.54Å; D258-R261 IonicContact OD2-NE 2.76Å; D258-R261 PolarHBondContact OD2-NE 3.13Å; D258-R261 IonicContact OD2-NH2 2.73Å; D258-R261 PolarHBondContact OD2-NH2 3.22Å
262	I	95.7	Very high	93.3	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	129.6	173.6	-57.9	170.2	0	0	0	109.5	V182 V184 V248 P259 V264 T288 S289	V182-I262 HydrophobicContact CB-CG1 4.2Å; V182-I262 CarbonylContact O-C 3.53Å; V182-I262 WeakPolarHBondContact O-CA 3.16Å; V184-I262 HydrophobicContact CG2-CG2 3.85Å; V248-I262 HydrophobicContact CG1-CD1 3.99Å; V248-I262 HydrophobicContact CG1-CG1 4.46Å; P259-I262 WeakPolarHBondContact O-CD1 3.28Å; I262-V264 HydrophobicContact CG2-CG2 4.47Å; I262-T288 CarbonylContact O-C 3.54Å; I262-T288 WeakPolarHBondContact O-CA 3.33Å; I262-T288 WeakPolarHBondContact O-CB 2.9Å; I262-S289 PolarHBondContact O-N 3.16Å
263	T	96.3	Very high	93.1	Very high	56 Å²	56	41.3 Å²	41.3	34%	0.344	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	119.7	173.8	-60.1	0	0	0	0	108.9	V182 M183 V184 S289	V182-T263 PolarHBondContact O-N 3.38Å; M183-T263 CarbonylContact C-O 3.53Å; M183-T263 WeakPolarHBondContact CA-O 3.4Å; V184-T263 PolarHBondContact N-O 3.1Å; T263-S289 PolarHBondContact OG1-OG 2.8Å
264	V	96.9	Very high	92.9	Very high	28 Å²	28	39.9 Å²	39.9	17%	0.17	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	132.1	176.7	-163.5	0	0	0	0	109.1	V184 I186 L245 I262 V274 T288	V184-V264 WeakPolarHBondContact O-CA 3.42Å; I186-V264 HydrophobicContact CD1-CG1 3.6Å; I186-V264 HydrophobicContact CG1-CG1 4.02Å; L245-V264 HydrophobicContact CD1-CG2 4.17Å; L245-V264 HydrophobicContact CD2-CG2 3.62Å; I262-V264 HydrophobicContact CG2-CG2 4.47Å; V264-V274 HydrophobicContact CG1-CG2 3.86Å; V264-T288 HydrophobicContact CG2-CG2 4.2Å
265	F	95.7	Very high	92.7	Very high	61 Å²	61	39 Å²	39	27%	0.268	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143	159.5	-179.9	73.2	-66.7	0	0	0	110.9	M183 V184 Y185 I186 L204	M183-F265 HydrophobicContact CB-CD1 4.28Å; M183-F265 HydrophobicContact CB-CE1 3.75Å; M183-F265 HydrophobicContact CE-CD1 4.09Å; M183-F265 HydrophobicContact CE-CE1 3.97Å; M183-F265 HydrophobicContact CE-CE2 4.45Å; M183-F265 HydrophobicContact CE-CG 4.43Å; M183-F265 HydrophobicContact CE-CZ 4.14Å; V184-F265 VanDerWaalsContact O-CD1 3.24Å; V184-F265 WeakPolarHBondContact O-CD1 3.37Å; V184-F265 PolarHBondContact O-N 2.82Å; Y185-F265 CarbonylContact C-O 3.55Å; Y185-F265 WeakPolarHBondContact CA-O 3.41Å; Y185-F265 AromaticContact CD2-CD2 3.78Å; Y185-F265 HydrophobicContact CD2-CD2 3.78Å; Y185-F265 HydrophobicContact CD2-CE1 4.28Å; Y185-F265 AromaticContact CD2-CE2 3.45Å; Y185-F265 HydrophobicContact CD2-CE2 3.45Å; Y185-F265 VanDerWaalsContact CD2-CE2 3.45Å; Y185-F265 HydrophobicContact CD2-CG 4.35Å; Y185-F265 AromaticContact CD2-CZ 3.72Å; Y185-F265 HydrophobicContact CD2-CZ 3.72Å; Y185-F265 HydrophobicContact CE2-CD2 4.44Å; Y185-F265 HydrophobicContact CE2-CE2 4.23Å; Y185-F265 HydrophobicContact CG-CE2 4.28Å; Y185-F265 HydrophobicContact CG-CZ 4.11Å; I186-F265 PolarHBondContact N-O 3.44Å; L204-F265 HydrophobicContact CD2-CZ 4.33Å
266	G	91.9	Very high	92.4	Very high	23 Å²	23	42 Å²	42	24%	0.237	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-165.5	170.2	-178.2	0	0	0	0	0	111.3	I186	I186-G266 VanDerWaalsContact O-CA 3.24Å; I186-G266 WeakPolarHBondContact O-CA 3.18Å
267	S	86.4	Confident	92.3	Very high	61 Å²	61	40.9 Å²	40.9	43%	0.427	24%	0.244	S	C	.	.	S	Bend	trans	-126.1	144.9	177.9	-175.5	0	0	0	0	110.9	G188 I269 G270	G188-S267 WeakPolarHBondContact CA-O 3.42Å; S267-I269 PolarHBondContact O-N 2.76Å; S267-G270 WeakPolarHBondContact O-CA 3.26Å; S267-G270 PolarHBondContact O-N 3.31Å
268	G	88.1	Confident	91.9	Very high	53 Å²	53	43 Å²	43	55%	0.546	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.1	-122.9	-177.3	0	0	0	0	0	112.1	G270 A271 S272	G268-G270 PolarHBondContact O-N 2.84Å; G268-A271 WeakPolarHBondContact O-CB 3.38Å; G268-A271 PolarHBondContact O-N 3Å; G268-S272 PolarHBondContact O-N 2.74Å
269	I	88.6	Confident	91.6	Very high	40 Å²	40	49 Å²	49	21%	0.205	29%	0.287	C	S	.	.	H	α-helix	trans	-59.6	-30.4	173.1	-68.5	-51.8	0	0	0	112.8	G189 Y191 S267 A271 S272 C273	G189-I269 WeakPolarHBondContact O-CG1 3.24Å; Y191-I269 HydrophobicContact CD1-CG2 3.49Å; Y191-I269 VanDerWaalsContact CD1-CG2 3.49Å; Y191-I269 HydrophobicContact CD2-CD1 4.29Å; Y191-I269 HydrophobicContact CD2-CG1 4.4Å; Y191-I269 HydrophobicContact CD2-CG2 3.76Å; Y191-I269 HydrophobicContact CE1-CG2 3.32Å; Y191-I269 HydrophobicContact CE2-CD1 3.71Å; Y191-I269 HydrophobicContact CE2-CG1 4.23Å; Y191-I269 HydrophobicContact CE2-CG2 3.6Å; Y191-I269 HydrophobicContact CG-CG2 3.71Å; S267-I269 PolarHBondContact O-N 2.76Å; I269-A271 VanDerWaalsContact C-N 3.26Å; I269-A271 PolarHBondContact O-N 2.81Å; I269-S272 CarbonylContact O-C 3.54Å; I269-S272 WeakPolarHBondContact O-CA 3.46Å; I269-S272 VanDerWaalsContact O-CB 3.28Å; I269-S272 WeakPolarHBondContact O-CB 3.31Å; I269-S272 PolarHBondContact O-N 3.12Å; I269-C273 PolarHBondContact O-N 2.56Å; I269-C273 PolarHBondContact O-SG 2.91Å
270	G	88.7	Confident	91.2	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-60.3	-36	173.2	0	0	0	0	0	112.5	I186 S267 G268 C273 V274	I186-G270 WeakPolarHBondContact O-CA 3.19Å; S267-G270 WeakPolarHBondContact O-CA 3.26Å; S267-G270 PolarHBondContact O-N 3.31Å; G268-G270 PolarHBondContact O-N 2.84Å; G270-C273 WeakPolarHBondContact O-CB 3.08Å; G270-C273 PolarHBondContact O-N 3.17Å; G270-V274 WeakPolarHBondContact O-CG2 3.5Å; G270-V274 PolarHBondContact O-N 3.05Å
271	A	91.1	Very high	90.8	Very high	46 Å²	46	46.5 Å²	46.5	38%	0.38	28%	0.283	S	S	.	.	H	α-helix	trans	-71.1	-32.9	172.9	0	0	0	0	0	112.2	G268 I269 V274 S275	G268-A271 WeakPolarHBondContact O-CB 3.38Å; G268-A271 PolarHBondContact O-N 3Å; I269-A271 VanDerWaalsContact C-N 3.26Å; I269-A271 PolarHBondContact O-N 2.81Å; A271-V274 PolarHBondContact O-N 3.3Å; A271-S275 PolarHBondContact O-N 2.74Å
272	S	92.2	Very high	90	Very high	49 Å²	49	48.4 Å²	48.4	34%	0.343	29%	0.294	S	S	.	.	H	α-helix	trans	-64.3	-42.7	172.3	-57.4	0	0	0	0	111.1	G268 I269 S275 L276	G268-S272 PolarHBondContact O-N 2.74Å; I269-S272 CarbonylContact O-C 3.54Å; I269-S272 WeakPolarHBondContact O-CA 3.46Å; I269-S272 VanDerWaalsContact O-CB 3.28Å; I269-S272 WeakPolarHBondContact O-CB 3.31Å; I269-S272 PolarHBondContact O-N 3.12Å; S272-S275 WeakPolarHBondContact O-CB 3.31Å; S272-S275 PolarHBondContact O-N 3.22Å; S272-L276 WeakPolarHBondContact O-CG 3.5Å; S272-L276 PolarHBondContact O-N 2.92Å
273	C	92.8	Very high	88.8	Confident	0 Å²	0	49 Å²	49	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-56.7	-49.2	171	-68.4	0	0	0	0	111.3	I186 L238 Q241 I269 G270 S275 L276 L277	I186-C273 HydrophobicContact CG2-CB 3.95Å; L238-C273 HydrophobicContact CD2-CB 4.24Å; Q241-C273 PolarHBondContact NE2-SG 3.18Å; Q241-C273 VanDerWaalsContact NE2-SG 3.45Å; I269-C273 PolarHBondContact O-N 2.56Å; I269-C273 PolarHBondContact O-SG 2.91Å; G270-C273 WeakPolarHBondContact O-CB 3.08Å; G270-C273 PolarHBondContact O-N 3.17Å; C273-S275 VanDerWaalsContact C-N 3.29Å; C273-S275 PolarHBondContact O-N 3Å; C273-L276 PolarHBondContact O-N 3.19Å; C273-L276 VanDerWaalsContact O-N 3.1Å; C273-L277 VanDerWaalsContact O-CG 3.28Å; C273-L277 WeakPolarHBondContact O-CG 3.43Å; C273-L277 PolarHBondContact O-N 2.99Å
274	V	92.5	Very high	87.5	Confident	30 Å²	30	52.7 Å²	52.7	18%	0.182	31%	0.311	C	S	.	.	H	α-helix	trans	-56.2	-44.7	175.6	173.8	0	0	0	0	111.3	I186 V264 G270 A271 L276 L277 T278	I186-V274 HydrophobicContact CD1-CG2 4.11Å; V264-V274 HydrophobicContact CG1-CG2 3.86Å; G270-V274 WeakPolarHBondContact O-CG2 3.5Å; G270-V274 PolarHBondContact O-N 3.05Å; A271-V274 PolarHBondContact O-N 3.3Å; V274-L276 PolarHBondContact O-N 3.4Å; V274-L277 PolarHBondContact O-N 3.11Å; V274-T278 WeakPolarHBondContact O-CG2 3.41Å; V274-T278 PolarHBondContact O-N 3.03Å; V274-T278 VanDerWaalsContact O-N 3.12Å
275	S	92.1	Very high	85.7	Confident	66 Å²	66	55.1 Å²	55.1	46%	0.462	34%	0.342	S	S	.	.	H	α-helix	trans	-59.5	-46.6	175.4	-171	0	0	0	0	111.7	A271 S272 C273 L277 T278 L279	A271-S275 PolarHBondContact O-N 2.74Å; S272-S275 WeakPolarHBondContact O-CB 3.31Å; S272-S275 PolarHBondContact O-N 3.22Å; C273-S275 VanDerWaalsContact C-N 3.29Å; C273-S275 PolarHBondContact O-N 3Å; S275-L277 VanDerWaalsContact C-N 3.35Å; S275-L277 PolarHBondContact O-N 2.77Å; S275-T278 PolarHBondContact O-N 3.26Å; S275-T278 PolarHBondContact O-OG1 3.24Å; S275-L279 PolarHBondContact O-N 2.61Å
276	L	91.9	Very high	84.2	Confident	76 Å²	76	53 Å²	53	40%	0.398	33%	0.333	S	S	.	.	H	α-helix	trans	-63.8	-39	178.4	-69.7	170.1	0	0	0	112.2	L238 S272 C273 V274 T278 L279 S280	L238-L276 HydrophobicContact CD1-CB 4.39Å; L238-L276 HydrophobicContact CD1-CD1 4.03Å; L238-L276 HydrophobicContact CD2-CD1 4.41Å; S272-L276 WeakPolarHBondContact O-CG 3.5Å; S272-L276 PolarHBondContact O-N 2.92Å; C273-L276 PolarHBondContact O-N 3.19Å; C273-L276 VanDerWaalsContact O-N 3.1Å; V274-L276 PolarHBondContact O-N 3.4Å; L276-T278 VanDerWaalsContact C-N 3.29Å; L276-T278 PolarHBondContact O-N 3.17Å; L276-L279 PolarHBondContact O-N 3.47Å; L276-L279 VanDerWaalsContact O-N 3.13Å; L276-S280 PolarHBondContact O-N 3.04Å
277	L	91.8	Very high	82.6	Confident	11 Å²	11	54.3 Å²	54.3	6%	0.058	34%	0.337	C	S	.	.	H	α-helix	trans	-61.9	-37.6	176.7	-70.8	174.1	0	0	0	111.9	I186 Q241 I242 L245 C273 V274 S275 L279 S280 S283	I186-L277 HydrophobicContact CD1-CD1 3.51Å; Q241-L277 HydrophobicContact CB-CD1 4.22Å; Q241-L277 HydrophobicContact CB-CD2 4.4Å; I242-L277 HydrophobicContact CD1-CD2 4.03Å; I242-L277 HydrophobicContact CG1-CD2 3.5Å; L245-L277 HydrophobicContact CD1-CD1 4.15Å; C273-L277 VanDerWaalsContact O-CG 3.28Å; C273-L277 WeakPolarHBondContact O-CG 3.43Å; C273-L277 PolarHBondContact O-N 2.99Å; V274-L277 PolarHBondContact O-N 3.11Å; S275-L277 VanDerWaalsContact C-N 3.35Å; S275-L277 PolarHBondContact O-N 2.77Å; L277-L279 PolarHBondContact O-N 3.35Å; L277-S280 PolarHBondContact O-N 3.46Å; L277-S283 VanDerWaalsContact O-CB 3.25Å; L277-S283 WeakPolarHBondContact O-CB 3.21Å; L277-S283 PolarHBondContact O-OG 3.31Å
278	T	87.3	Confident	80.8	Confident	46 Å²	46	54.3 Å²	54.3	28%	0.282	34%	0.335	S	S	.	.	H	α-helix	trans	-69.1	-19.5	176.8	60.5	0	0	0	0	114.1	V274 S275 L276 F298	V274-T278 WeakPolarHBondContact O-CG2 3.41Å; V274-T278 PolarHBondContact O-N 3.03Å; V274-T278 VanDerWaalsContact O-N 3.12Å; S275-T278 PolarHBondContact O-N 3.26Å; S275-T278 PolarHBondContact O-OG1 3.24Å; L276-T278 VanDerWaalsContact C-N 3.29Å; L276-T278 PolarHBondContact O-N 3.17Å; T278-F298 HydrophobicContact CG2-CD1 4.16Å; T278-F298 HydrophobicContact CG2-CE1 4.11Å; T278-F298 VanDerWaalsContact O-CD1 3.23Å; T278-F298 WeakPolarHBondContact O-CD1 3.19Å; T278-F298 WeakPolarHBondContact O-CD2 3.42Å; T278-F298 WeakPolarHBondContact O-CG 3.38Å
279	L	89	Confident	78.6	Confident	134 Å²	134	55.1 Å²	55.1	70%	0.702	33%	0.332	S	S	*	.	H	α-helix	trans	-94.9	-10.1	177.9	-62.2	173.7	0	0	0	112.8	S275 L276 L277	S275-L279 PolarHBondContact O-N 2.61Å; L276-L279 PolarHBondContact O-N 3.47Å; L276-L279 VanDerWaalsContact O-N 3.13Å; L277-L279 PolarHBondContact O-N 3.35Å
280	S	84.2	Confident	76.1	Confident	30 Å²	30	58.7 Å²	58.7	21%	0.21	34%	0.343	C	S	.	.			trans	-89.5	126.8	-174.3	-176.8	0	0	0	0	111.9	L276 L277 H282 S283	L276-S280 PolarHBondContact O-N 3.04Å; L277-S280 PolarHBondContact O-N 3.46Å; S280-H282 PolarHBondContact O-N 3.38Å; S280-H282 PolarHBondContact OG-N 2.93Å; S280-S283 WeakPolarHBondContact O-CB 3.48Å; S280-S283 PolarHBondContact O-N 3.45Å; S280-S283 VanDerWaalsContact O-N 3.08Å
281	H	81.9	Confident	73.2	Confident	121 Å²	121	63 Å²	63	56%	0.56	37%	0.373	S	S	*	.	G	3₁₀ helix	trans	-60.7	-23.9	171.8	71.2	-79.9	0	0	0	112.7	S283 E284	H281-S283 PolarHBondContact O-N 2.84Å; H281-E284 WeakPolarHBondContact O-CB 3.41Å; H281-E284 PolarHBondContact O-N 2.98Å; H281-E284 VanDerWaalsContact O-N 3.12Å
282	H	74.7	Confident	70.3	Confident	85 Å²	85	65.6 Å²	65.6	39%	0.394	39%	0.386	S	S	.	.	G	3₁₀ helix	trans	-68.3	-15.9	176.9	-68.9	-66.6	0	0	0	113.8	I242 R246 S280	I242-H282 HydrophobicContact CD1-CB 3.75Å; R246-H282 PolarHBondContact NH2-O 3.24Å; S280-H282 PolarHBondContact O-N 3.38Å; S280-H282 PolarHBondContact OG-N 2.93Å
283	S	69.9	Low	67.2	Low	13 Å²	13	74.4 Å²	74.4	9%	0.091	41%	0.412	C	S	.	.	G	3₁₀ helix	trans	-90.1	-8.1	175.2	-51.3	0	0	0	0	112.8	L277 S280 H281 I286	L277-S283 VanDerWaalsContact O-CB 3.25Å; L277-S283 WeakPolarHBondContact O-CB 3.21Å; L277-S283 PolarHBondContact O-OG 3.31Å; S280-S283 WeakPolarHBondContact O-CB 3.48Å; S280-S283 PolarHBondContact O-N 3.45Å; S280-S283 VanDerWaalsContact O-N 3.08Å; H281-S283 PolarHBondContact O-N 2.84Å; S283-I286 PolarHBondContact O-N 3.12Å
284	E	69.5	Low	64	Low	133 Å²	133	78.8 Å²	78.8	62%	0.621	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	137	177.9	-68.7	179	178.6	0	0	110.7	H281 I286	H281-E284 WeakPolarHBondContact O-CB 3.41Å; H281-E284 PolarHBondContact O-N 2.98Å; H281-E284 VanDerWaalsContact O-N 3.12Å; E284-I286 VanDerWaalsContact C-N 3.34Å
285	G	58.8	Low	61.1	Low	79 Å²	79	82.8 Å²	82.8	81%	0.814	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.2	-7.1	-178	0	0	0	0	0	115.2	P287	G285-P287 WeakPolarHBondContact O-CD 3.02Å
286	I	64.5	Low	58.5	Low	18 Å²	18	85 Å²	85	9%	0.092	48%	0.481	C	S	.	.	S	Bend	trans	-78.8	117	168.4	-56.6	178.3	0	0	0	107.8	I242 L245 R246 S283 E284 T288	I242-I286 HydrophobicContact CG2-CD1 4.44Å; L245-I286 HydrophobicContact CB-CD1 3.84Å; L245-I286 HydrophobicContact CB-CG2 4.2Å; R246-I286 HydrophobicContact CG-CD1 4.22Å; S283-I286 PolarHBondContact O-N 3.12Å; E284-I286 VanDerWaalsContact C-N 3.34Å; I286-T288 HydrophobicContact CG2-CG2 4.4Å; I286-T288 PolarHBondContact O-N 2.99Å
287	P	57.8	Low	55.5	Low	49 Å²	49	84.6 Å²	84.6	32%	0.318	49%	0.485	S	S	.	.			trans	-74.3	86.8	-173.7	-11.5	27.2	0	0	0	111.6	S249 P259 G285	S249-P287 WeakPolarHBondContact OG-CD 3.19Å; P259-P287 WeakPolarHBondContact O-CB 3.41Å; G285-P287 WeakPolarHBondContact O-CD 3.02Å
288	T	49.6	Very low	52.8	Low	61 Å²	61	89.2 Å²	89.2	37%	0.374	50%	0.504	S	S	.	.	B	Isolated β-bridge	trans	-91.3	140.7	170.1	58.7	0	0	0	0	110.3	I262 V264 I286 R290	I262-T288 CarbonylContact O-C 3.54Å; I262-T288 WeakPolarHBondContact O-CA 3.33Å; I262-T288 WeakPolarHBondContact O-CB 2.9Å; V264-T288 HydrophobicContact CG2-CG2 4.2Å; I286-T288 HydrophobicContact CG2-CG2 4.4Å; I286-T288 PolarHBondContact O-N 2.99Å; T288-R290 PolarHBondContact O-N 3.27Å; T288-R290 VanDerWaalsContact O-N 3.14Å
289	S	42.3	Very low	50	Low	70 Å²	70	91.4 Å²	91.4	49%	0.49	52%	0.518	S	S	.	.			trans	-57.9	121.6	-174.9	73.5	0	0	0	0	112.2	I262 T263	I262-S289 PolarHBondContact O-N 3.16Å; T263-S289 PolarHBondContact OG1-OG 2.8Å
290	R	35.4	Very low	47.2	Very low	115 Å²	115	90.2 Å²	90.2	43%	0.434	52%	0.518	S	S	.	.			trans	-124	137.7	167.1	-172.8	-173.9	176.8	121	-1	106.7	T288 T294 S297	T288-R290 PolarHBondContact O-N 3.27Å; T288-R290 VanDerWaalsContact O-N 3.14Å; R290-T294 PolarHBondContact NH2-O 3.36Å; R290-T294 PolarHBondContact NH2-OG1 3.41Å; R290-S297 PolarHBondContact NH1-O 3.36Å; R290-S297 PolarHBondContact NH2-O 3.38Å
291	S	27.9	Very low	44.3	Very low	91 Å²	91	99.1 Å²	99.1	64%	0.636	55%	0.547	S	S	*	.			trans	-63.2	134.7	168.8	-178.9	0	0	0	0	109.8	R293	S291-R293 PolarHBondContact O-N 3.4Å
292	P	30.5	Very low	41.7	Very low	100 Å²	100	98.9 Å²	98.9	65%	0.649	56%	0.556	S	S	*	*	S	Bend	trans	-78.5	93.5	-174.4	31	-31.4	0	0	0	109.5
293	R	25.9	Very low	39.7	Very low	234 Å²	234	101.2 Å²	101.2	88%	0.883	58%	0.577	S	S	*	*			trans	176.3	87.6	154.8	-100.7	172.9	-114.7	-144.6	1.3	108.9	S291	S291-R293 PolarHBondContact O-N 3.4Å
294	T	26.3	Very low	38.1	Very low	93 Å²	93	104.4 Å²	104.4	57%	0.571	60%	0.604	S	S	*	*			trans	168.3	127.2	148.3	27.8	0	0	0	0	109.5	R290	R290-T294 PolarHBondContact NH2-O 3.36Å; R290-T294 PolarHBondContact NH2-OG1 3.41Å
295	P	32.1	Very low	36.1	Very low	114 Å²	114	106.2 Å²	106.2	74%	0.74	62%	0.617	S	S	*	*			trans	-74.8	149.4	171.4	32.4	-30.5	0	0	0	110.1
296	S	36.5	Very low	34.5	Very low	113 Å²	113	114 Å²	114	79%	0.79	62%	0.622	S	S	*	*	S	Bend	trans	46.5	87.1	164.7	62.7	0	0	0	0	117.3
297	S	29.8	Very low	32.6	Very low	67 Å²	67	122.7 Å²	122.7	47%	0.469	66%	0.659	S	S	.	*			trans	168	128.2	144.2	52.5	0	0	0	0	108.6	R290 T299	R290-S297 PolarHBondContact NH1-O 3.36Å; R290-S297 PolarHBondContact NH2-O 3.38Å; S297-T299 VanDerWaalsContact C-N 3.26Å; S297-T299 PolarHBondContact O-N 3.01Å
298	F	35.6	Very low	30.9	Very low	108 Å²	108	131.5 Å²	131.5	47%	0.474	69%	0.686	S	S	.	*			trans	-61.4	90.3	162.5	-90	-88.4	0	0	0	108.5	T278	T278-F298 HydrophobicContact CG2-CD1 4.16Å; T278-F298 HydrophobicContact CG2-CE1 4.11Å; T278-F298 VanDerWaalsContact O-CD1 3.23Å; T278-F298 WeakPolarHBondContact O-CD1 3.19Å; T278-F298 WeakPolarHBondContact O-CD2 3.42Å; T278-F298 WeakPolarHBondContact O-CG 3.38Å
299	T	27	Very low	29.9	Very low	92 Å²	92	134 Å²	134	56%	0.564	70%	0.704	S	S	*	*			trans	-96.1	111.6	165	45.8	0	0	0	0	107.4	S297 R301	S297-T299 VanDerWaalsContact C-N 3.26Å; S297-T299 PolarHBondContact O-N 3.01Å; T299-R301 PolarHBondContact O-N 3.2Å
300	P	30.4	Very low	29.3	Very low	109 Å²	109	132.6 Å²	132.6	71%	0.708	70%	0.7	S	S	*	*			trans	-63.9	125.4	173.5	24.5	-29.8	0	0	0	108.8	P302	P300-P302 WeakPolarHBondContact O-CD 3.38Å
301	R	23.3	Very low	29.2	Very low	217 Å²	217	133.1 Å²	133.1	82%	0.819	72%	0.718	S	S	*	*			trans	-82.6	116.7	152.6	-82.4	-169.3	-176.3	-155.4	2.3	106.4	T299 T303	T299-R301 PolarHBondContact O-N 3.2Å; R301-T303 VanDerWaalsContact C-N 3.31Å; R301-T303 PolarHBondContact O-N 3.4Å
302	P	27.5	Very low	29.7	Very low	115 Å²	115	136.4 Å²	136.4	75%	0.747	73%	0.728	S	S	*	*			trans	-72.1	93.2	169.6	29.2	-29.2	0	0	0	107.4	P300	P300-P302 WeakPolarHBondContact O-CD 3.38Å
303	T	34.1	Very low	29.8	Very low	134 Å²	134	137.7 Å²	137.7	82%	0.822	74%	0.735	S	S	*	*			trans	-86.6	12.2	161.2	-16.4	0	0	0	0	111.5	R301 L305	R301-T303 VanDerWaalsContact C-N 3.31Å; R301-T303 PolarHBondContact O-N 3.4Å; T303-L305 PolarHBondContact O-N 2.74Å
304	A	35.6	Very low	30	Very low	81 Å²	81	134.1 Å²	134.1	67%	0.669	73%	0.731	S	S	*	*			trans	-83.7	88.7	162.9	0	0	0	0	0	108.5
305	L	27.7	Very low	30.1	Very low	171 Å²	171	135.4 Å²	135.4	90%	0.895	74%	0.741	S	S	*	*			trans	152.8	65.3	155.1	-81.5	162.4	0	0	0	109.6	T303	T303-L305 PolarHBondContact O-N 2.74Å
306	R	25	Very low	30	Very low	243 Å²	243	139.1 Å²	139.1	92%	0.917	75%	0.749	S	S	*	*			trans	-104.2	108.6	141	-118.7	-178.7	-167.7	-119.2	2.8	106.2	W308	R306-W308 PolarHBondContact O-N 3.25Å; R306-W308 VanDerWaalsContact O-N 3.15Å
307	K	23.9	Very low	29.7	Very low	199 Å²	199	140 Å²	140	87%	0.865	75%	0.75	S	S	*	*			trans	-49.3	117.7	174.1	-146.2	177.3	-173.2	-177.2	0	107.6	P309	K307-P309 VanDerWaalsContact O-CD 3.29Å; K307-P309 WeakPolarHBondContact O-CD 3.47Å
308	W	23.5	Very low	29.6	Very low	234 Å²	234	142.6 Å²	142.6	89%	0.886	77%	0.768	S	S	*	*			trans	-64.4	115.6	167.4	-171.3	-81.9	0	0	0	107	R306 G310	R306-W308 PolarHBondContact O-N 3.25Å; R306-W308 VanDerWaalsContact O-N 3.15Å; W308-G310 PolarHBondContact O-N 3.45Å
309	P	26.8	Very low	29.3	Very low	115 Å²	115	142.6 Å²	142.6	75%	0.747	78%	0.781	S	S	*	*			trans	-77	100.2	178	29.4	-27.1	0	0	0	107.7	K307	K307-P309 VanDerWaalsContact O-CD 3.29Å; K307-P309 WeakPolarHBondContact O-CD 3.47Å
310	G	29.7	Very low	29.4	Very low	40 Å²	40	144.8 Å²	144.8	41%	0.412	79%	0.794	S	S	.	*			trans	-63.7	151.1	165.4	0	0	0	0	0	110.5	W308 N312	W308-G310 PolarHBondContact O-N 3.45Å; G310-N312 PolarHBondContact O-N 3.3Å
311	P	33.5	Very low	29.2	Very low	126 Å²	126	149.3 Å²	149.3	82%	0.818	80%	0.803	S	S	*	*	S	Bend	trans	-77.6	91.8	179.7	31.6	-29.9	0	0	0	108.5
312	N	40.1	Very low	29.5	Very low	159 Å²	159	145 Å²	145	85%	0.85	80%	0.802	S	S	*	*			trans	148	87.1	156	-77.7	-20.1	0	0	0	109.6	G310	G310-N312 PolarHBondContact O-N 3.3Å
313	T	31.1	Very low	29.6	Very low	128 Å²	128	145.5 Å²	145.5	79%	0.785	81%	0.808	S	S	*	*			trans	-131.7	108.7	157.6	49.7	0	0	0	0	108.8
314	I	30.4	Very low	29.7	Very low	158 Å²	158	146.3 Å²	146.3	81%	0.81	84%	0.843	S	S	*	*			trans	-60.4	137.7	164.3	-60.4	168.1	0	0	0	107.3	E316	I314-E316 PolarHBondContact O-N 3.38Å
315	P	29.2	Very low	29.4	Very low	120 Å²	120	149.6 Å²	149.6	78%	0.779	85%	0.851	S	S	*	*			trans	-76.4	111.8	-175.9	28.6	-30.8	0	0	0	110.6
316	E	30	Very low	29.4	Very low	193 Å²	193	148.5 Å²	148.5	90%	0.902	85%	0.849	S	S	*	*	P	Polyproline II helix	trans	-83.2	126.6	164	-81.4	-171.3	160.9	0	0	110.3	I314	I314-E316 PolarHBondContact O-N 3.38Å
317	T	28.8	Very low	29.7	Very low	132 Å²	132	143.2 Å²	143.2	81%	0.81	85%	0.845	S	S	*	*	P	Polyproline II helix	trans	-69.7	136.9	179.4	45	0	0	0	0	112.1
318	S	28.6	Very low	30	Very low	121 Å²	121	139.9 Å²	139.9	85%	0.846	84%	0.844	S	S	*	*	P	Polyproline II helix	trans	-58	129.1	174	53.1	0	0	0	0	113.5
319	S	29.5	Very low	30.4	Very low	107 Å²	107	134.1 Å²	134.1	75%	0.748	84%	0.842	S	S	*	*			trans	-121.4	113.4	157.2	55.7	0	0	0	0	110.2
320	T	29.5	Very low	30.7	Very low	138 Å²	138	135.3 Å²	135.3	85%	0.847	85%	0.848	S	S	*	*	P	Polyproline II helix	trans	-65.5	127.1	169.7	19.7	0	0	0	0	110.6
321	F	25.7	Very low	30.7	Very low	204 Å²	204	142.1 Å²	142.1	90%	0.895	88%	0.879	S	S	*	*	P	Polyproline II helix	trans	-97.6	117.6	163.9	-110	-93.6	0	0	0	109.2
322	T	28.5	Very low	30.5	Very low	128 Å²	128	143.4 Å²	143.4	79%	0.785	88%	0.884	S	S	*	*	P	Polyproline II helix	trans	-84.9	138.6	167	40.2	0	0	0	0	110.2
323	S	30.3	Very low	29.7	Very low	125 Å²	125	142.1 Å²	142.1	87%	0.874	89%	0.887	S	S	*	*	P	Polyproline II helix	trans	-61.6	134.7	172.8	51.1	0	0	0	0	112.6
324	G	35.3	Very low	29.6	Very low	151 Å²	151	143.4 Å²	143.4	100%	1.557	90%	0.896	S	S	*	*			trans	-131.4	0	160.8	0	0	0	0	0	109.3

Retrieved 324 of 324 residues in 82.1 ms (Link to these results)

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