A0A087Y429_POEFO Loading...

DNA replication complex GINS protein SLD5

Required for initiation of chromosomal DNA replication. Core component of CDC45-MCM-GINS (CMG) helicase, the molecular machine that unwinds template DNA during replication, and around which the replisome is built.

AlphaFold DB , UniProt , Accession A0A087Y429, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 225 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	41.7	Very low	38.7	Very low	234 Å²	234	138.1 Å²	138.1	100%	1.153	81%	0.809	S	S	*	*				0	84.3	0	-65.8	179.3	-175.7	0	0	105.1
2	S	38.5	Very low	39	Very low	111 Å²	111	138.4 Å²	138.4	78%	0.776	80%	0.802	S	S	*	*				75.2	85	103.3	53.5	0	0	0	0	109.8
3	D	35.8	Very low	38.7	Very low	170 Å²	170	138.5 Å²	138.5	91%	0.909	80%	0.798	S	S	*	*				76.7	135.8	69.1	-140.9	7.9	0	0	0	113.7
4	A	43.4	Very low	38.6	Very low	80 Å²	80	141.9 Å²	141.9	66%	0.661	80%	0.803	S	S	*	*			trans	-92.8	-176.7	-159.3	0	0	0	0	0	114.9
5	L	40.9	Very low	38.4	Very low	168 Å²	168	141.1 Å²	141.1	88%	0.88	80%	0.796	S	S	*	*			trans	93.1	144.1	170.9	-56.8	150.5	0	0	0	114.1
6	S	38.9	Very low	38.3	Very low	91 Å²	91	142.2 Å²	142.2	64%	0.636	80%	0.799	S	S	*	*			cis	179	150.8	-4.4	41.6	0	0	0	0	106.5
7	E	39.1	Very low	38.3	Very low	192 Å²	192	138.8 Å²	138.8	90%	0.897	79%	0.787	S	S	*	*			trans	33.9	147.3	136	-72.8	177.8	165.2	0	0	120.2
8	D	36.3	Very low	38.4	Very low	159 Å²	159	140.9 Å²	140.9	85%	0.85	79%	0.789	S	S	*	*			cis	174.3	163.3	18.1	166.4	42.4	0	0	0	105.9
9	G	32	Very low	38.5	Very low	59 Å²	59	143.1 Å²	143.1	61%	0.608	79%	0.792	S	S	*	*			trans	80.9	142.8	154.2	0	0	0	0	0	117.4
10	S	36.3	Very low	38.8	Very low	99 Å²	99	144.5 Å²	144.5	69%	0.692	79%	0.792	S	S	*	*			cis	-173.5	135.1	7.3	45.8	0	0	0	0	107.7	I12	S10-I12 PolarHBondContact O-N 2.68Å
11	D	43.2	Very low	39.6	Very low	156 Å²	156	145 Å²	145	83%	0.834	79%	0.794	S	S	*	*			trans	-46.1	123.1	157.9	-96.6	-44	0	0	0	109.9
12	I	41.4	Very low	40.7	Very low	142 Å²	142	139.6 Å²	139.6	73%	0.728	77%	0.774	S	S	*	*			trans	-113.7	88.2	162.4	-57.1	178.1	0	0	0	106.1	S10 Q14	S10-I12 PolarHBondContact O-N 2.68Å; I12-Q14 PolarHBondContact O-N 2.63Å
13	N	35.2	Very low	42.7	Very low	140 Å²	140	138 Å²	138	75%	0.749	76%	0.756	S	S	*	*			trans	-57.1	111	154.6	-79.9	-42.2	0	0	0	107.2	D15	N13-D15 PolarHBondContact O-N 2.74Å
14	Q	37.5	Very low	45.2	Very low	185 Å²	185	132.8 Å²	132.8	86%	0.864	73%	0.73	S	S	*	*			trans	-70	88.7	160.1	-82.1	175.8	-23.7	0	0	107	I12 D16	I12-Q14 PolarHBondContact O-N 2.63Å; Q14-D16 VanDerWaalsContact C-N 3.29Å; Q14-D16 PolarHBondContact O-N 2.84Å; Q14-D16 VanDerWaalsContact O-N 3.1Å
15	D	35.3	Very low	47.3	Very low	131 Å²	131	133 Å²	133	70%	0.701	73%	0.725	S	S	*	*			trans	-71.2	92.5	163.2	-166.2	22	0	0	0	106.8	N13 S17	N13-D15 PolarHBondContact O-N 2.74Å; D15-S17 PolarHBondContact O-N 2.8Å; D15-S17 PolarHBondContact O-OG 3.45Å
16	D	37.5	Very low	49.6	Very low	158 Å²	158	128.7 Å²	128.7	85%	0.845	71%	0.713	S	S	*	*			trans	-68.7	73.3	170	-138.7	10.9	0	0	0	106.9	Q14 Q18	Q14-D16 VanDerWaalsContact C-N 3.29Å; Q14-D16 PolarHBondContact O-N 2.84Å; Q14-D16 VanDerWaalsContact O-N 3.1Å; D16-Q18 VanDerWaalsContact C-N 3.34Å; D16-Q18 PolarHBondContact O-N 3Å
17	S	38.8	Very low	52.2	Low	84 Å²	84	129 Å²	129	59%	0.587	71%	0.705	S	S	*	*			trans	-69.9	97.5	174.6	5	0	0	0	0	106	D15 E19	D15-S17 PolarHBondContact O-N 2.8Å; D15-S17 PolarHBondContact O-OG 3.45Å; S17-E19 VanDerWaalsContact C-N 3.35Å; S17-E19 PolarHBondContact O-N 2.59Å
18	Q	40.1	Very low	54.8	Low	178 Å²	178	120.5 Å²	120.5	83%	0.832	67%	0.665	S	S	*	*			trans	-47.7	106.7	159.2	-69.6	175	-6.5	0	0	106.4	D16 E20	D16-Q18 VanDerWaalsContact C-N 3.34Å; D16-Q18 PolarHBondContact O-N 3Å; Q18-E20 PolarHBondContact O-N 3.46Å
19	E	39.3	Very low	57.5	Low	181 Å²	181	114.6 Å²	114.6	85%	0.846	63%	0.633	S	S	*	*			trans	-59.2	94.7	164.4	-74.4	-179.2	158.6	0	0	105.3	S17 D21	S17-E19 VanDerWaalsContact C-N 3.35Å; S17-E19 PolarHBondContact O-N 2.59Å; E19-D21 PolarHBondContact O-N 2.98Å
20	E	45.1	Very low	60.5	Low	171 Å²	171	114.3 Å²	114.3	80%	0.799	63%	0.625	S	S	*	*			trans	-55.7	99.3	159	-77.9	-175.5	170.3	0	0	104.7	Q18 V22	Q18-E20 PolarHBondContact O-N 3.46Å; E20-V22 WeakPolarHBondContact O-CG2 3.3Å; E20-V22 PolarHBondContact O-N 3.29Å
21	D	55.3	Low	63.3	Low	156 Å²	156	114.4 Å²	114.4	83%	0.834	61%	0.613	S	S	*	*			trans	-64.7	89.9	-177.7	-150	5.8	0	0	0	106.9	E19 M23	E19-D21 PolarHBondContact O-N 2.98Å; D21-M23 VanDerWaalsContact C-N 3.31Å; D21-M23 PolarHBondContact O-N 3.09Å
22	V	64.3	Low	65.8	Low	120 Å²	120	107 Å²	107	73%	0.727	57%	0.574	S	S	*	*			trans	-68.4	92.7	-174.5	-178.6	0	0	0	0	107.6	E20 T24	E20-V22 WeakPolarHBondContact O-CG2 3.3Å; E20-V22 PolarHBondContact O-N 3.29Å; V22-T24 PolarHBondContact O-N 3.41Å
23	M	80.1	Confident	68.4	Low	79 Å²	79	104 Å²	104	39%	0.389	56%	0.557	S	S	.	*			trans	-58.9	122.2	177.4	-169.7	178.8	-43.2	0	0	109.9	D21 E27 L28 K31	D21-M23 VanDerWaalsContact C-N 3.31Å; D21-M23 PolarHBondContact O-N 3.09Å; M23-E27 HydrophobicContact CG-CB 3.99Å; M23-L28 HydrophobicContact SD-CB 4.19Å; M23-L28 HydrophobicContact SD-CD1 4.09Å; M23-K31 HydrophobicContact CE-CD 4.06Å; M23-K31 HydrophobicContact SD-CD 3.76Å
24	T	89.3	Confident	71.2	Confident	59 Å²	59	99.8 Å²	99.8	36%	0.362	53%	0.532	S	S	.	.			trans	-72.5	154.1	179.2	67.4	0	0	0	0	110.7	V22 A26 E27 L28	V22-T24 PolarHBondContact O-N 3.41Å; T24-A26 PolarHBondContact O-N 2.94Å; T24-E27 WeakPolarHBondContact CB-OE2 3.25Å; T24-E27 PolarHBondContact N-OE2 3Å; T24-E27 PolarHBondContact O-N 3.03Å; T24-E27 VanDerWaalsContact O-N 3.15Å; T24-E27 VanDerWaalsContact OG1-CG 3.24Å; T24-E27 WeakPolarHBondContact OG1-CG 3.48Å; T24-E27 PolarHBondContact OG1-N 3.37Å; T24-E27 PolarHBondContact OG1-OE2 2.86Å; T24-L28 PolarHBondContact O-N 2.88Å
25	P	86.9	Confident	74	Confident	86 Å²	86	91.6 Å²	91.6	56%	0.558	50%	0.496	S	S	*	.	H	α-helix	trans	-57.2	-32	175.2	-27.2	35.2	0	0	0	113.5	L28 I29	P25-L28 PolarHBondContact O-N 3.37Å; P25-I29 WeakPolarHBondContact O-CG1 3.31Å; P25-I29 PolarHBondContact O-N 2.88Å; P25-I29 VanDerWaalsContact O-N 3.15Å
26	A	90	Very high	77	Confident	77 Å²	77	87.4 Å²	87.4	64%	0.636	47%	0.47	S	S	*	.	H	α-helix	trans	-68.8	-42.8	177.9	0	0	0	0	0	111.9	T24 L28 I29 A30	T24-A26 PolarHBondContact O-N 2.94Å; A26-L28 VanDerWaalsContact C-N 3.32Å; A26-I29 PolarHBondContact O-N 2.78Å; A26-A30 PolarHBondContact O-N 3.24Å
27	E	92.9	Very high	79.8	Confident	98 Å²	98	82.2 Å²	82.2	46%	0.458	44%	0.442	S	S	.	.	H	α-helix	trans	-65.1	-37.6	175	-71.7	157.9	169.7	0	0	111.6	M23 T24 I29 A30 K31	M23-E27 HydrophobicContact CG-CB 3.99Å; T24-E27 WeakPolarHBondContact CB-OE2 3.25Å; T24-E27 PolarHBondContact N-OE2 3Å; T24-E27 PolarHBondContact O-N 3.03Å; T24-E27 VanDerWaalsContact O-N 3.15Å; T24-E27 VanDerWaalsContact OG1-CG 3.24Å; T24-E27 WeakPolarHBondContact OG1-CG 3.48Å; T24-E27 PolarHBondContact OG1-N 3.37Å; T24-E27 PolarHBondContact OG1-OE2 2.86Å; E27-I29 PolarHBondContact O-N 3.32Å; E27-A30 PolarHBondContact O-N 2.99Å; E27-K31 WeakPolarHBondContact O-CG 3.46Å; E27-K31 PolarHBondContact O-N 2.93Å
28	L	93.7	Very high	82.6	Confident	13 Å²	13	78.6 Å²	78.6	7%	0.068	42%	0.416	C	S	.	.	H	α-helix	trans	-59	-46	174.9	179.6	66.2	0	0	0	111.7	M23 T24 P25 A26 K31 L32 V52 C55 V56 Q59	M23-L28 HydrophobicContact SD-CB 4.19Å; M23-L28 HydrophobicContact SD-CD1 4.09Å; T24-L28 PolarHBondContact O-N 2.88Å; P25-L28 PolarHBondContact O-N 3.37Å; A26-L28 VanDerWaalsContact C-N 3.32Å; L28-K31 PolarHBondContact O-N 3.1Å; L28-L32 PolarHBondContact O-N 2.77Å; L28-V52 HydrophobicContact CD1-CB 4.35Å; L28-V52 HydrophobicContact CD1-CG1 3.95Å; L28-C55 HydrophobicContact CD1-CB 3.83Å; L28-C55 HydrophobicContact CD2-CB 3.68Å; L28-C55 HydrophobicContact CG-CB 4.42Å; L28-V56 HydrophobicContact CD1-CG2 4.08Å; L28-V56 HydrophobicContact CD2-CG2 3.78Å; L28-V56 HydrophobicContact CG-CG2 3.66Å; L28-Q59 HydrophobicContact CD2-CG 4.33Å
29	I	94.3	Very high	85.3	Confident	35 Å²	35	70.2 Å²	70.2	18%	0.179	38%	0.377	C	S	.	.	H	α-helix	trans	-65.2	-40.4	176	-61.7	-51.3	0	0	0	111.3	P25 A26 E27 K31 L32 E33 V56 I87	P25-I29 WeakPolarHBondContact O-CG1 3.31Å; P25-I29 PolarHBondContact O-N 2.88Å; P25-I29 VanDerWaalsContact O-N 3.15Å; A26-I29 PolarHBondContact O-N 2.78Å; E27-I29 PolarHBondContact O-N 3.32Å; I29-K31 VanDerWaalsContact C-N 3.33Å; I29-K31 PolarHBondContact O-N 3.45Å; I29-L32 WeakPolarHBondContact O-CB 3.38Å; I29-L32 PolarHBondContact O-N 2.85Å; I29-E33 HydrophobicContact CG2-CG 4.37Å; I29-E33 WeakPolarHBondContact O-CG 3.36Å; I29-E33 PolarHBondContact O-N 3.28Å; I29-V56 HydrophobicContact CD1-CG2 4.3Å; I29-I87 HydrophobicContact CD1-CB 4.45Å; I29-I87 HydrophobicContact CD1-CD1 3.79Å; I29-I87 HydrophobicContact CD1-CG1 3.9Å; I29-I87 HydrophobicContact CD1-CG2 3.68Å; I29-I87 HydrophobicContact CG1-CD1 4.19Å; I29-I87 HydrophobicContact CG1-CG1 4.45Å
30	A	94.3	Very high	88	Confident	53 Å²	53	66.8 Å²	66.8	44%	0.438	36%	0.36	S	S	.	.	H	α-helix	trans	-61.8	-40	176.1	0	0	0	0	0	112.4	A26 E27 E33 Q34	A26-A30 PolarHBondContact O-N 3.24Å; E27-A30 PolarHBondContact O-N 2.99Å; A30-E33 PolarHBondContact O-N 3.04Å; A30-Q34 WeakPolarHBondContact O-CB 3.2Å; A30-Q34 PolarHBondContact O-N 2.85Å
31	K	94.5	Very high	90.4	Very high	100 Å²	100	62 Å²	62	44%	0.435	34%	0.337	S	S	.	.	H	α-helix	trans	-64.8	-41	173.8	-73.7	-173.7	-177.1	-179.1	0	111.9	M23 E27 L28 I29 Q34 A35 V52	M23-K31 HydrophobicContact CE-CD 4.06Å; M23-K31 HydrophobicContact SD-CD 3.76Å; E27-K31 WeakPolarHBondContact O-CG 3.46Å; E27-K31 PolarHBondContact O-N 2.93Å; L28-K31 PolarHBondContact O-N 3.1Å; I29-K31 VanDerWaalsContact C-N 3.33Å; I29-K31 PolarHBondContact O-N 3.45Å; K31-Q34 PolarHBondContact O-N 3.23Å; K31-A35 WeakPolarHBondContact O-CB 3.35Å; K31-A35 PolarHBondContact O-N 3.49Å; K31-V52 HydrophobicContact CB-CG1 4.5Å; K31-V52 HydrophobicContact CB-CG2 4.3Å
32	L	95.9	Very high	92.4	Very high	2 Å²	2	54.9 Å²	54.9	1%	0.01	30%	0.299	C	S	.	.	H	α-helix	trans	-61.6	-46.7	174.6	176.8	67.9	0	0	0	111.5	L28 I29 Q34 A35 W36 V52 V56 I87 V90 L91 Y94	L28-L32 PolarHBondContact O-N 2.77Å; I29-L32 WeakPolarHBondContact O-CB 3.38Å; I29-L32 PolarHBondContact O-N 2.85Å; L32-Q34 VanDerWaalsContact C-N 3.34Å; L32-Q34 PolarHBondContact O-N 3.42Å; L32-A35 PolarHBondContact O-N 3.45Å; L32-W36 VanDerWaalsContact O-CB 3.25Å; L32-W36 WeakPolarHBondContact O-CB 3.01Å; L32-W36 PolarHBondContact O-N 2.72Å; L32-V52 HydrophobicContact CB-CG1 3.94Å; L32-V52 HydrophobicContact CD1-CG1 4.4Å; L32-V56 HydrophobicContact CB-CG2 4.45Å; L32-V56 HydrophobicContact CD2-CG1 4.08Å; L32-V56 HydrophobicContact CD2-CG2 4.13Å; L32-I87 HydrophobicContact CD2-CG2 4.38Å; L32-V90 HydrophobicContact CD2-CB 4.38Å; L32-V90 HydrophobicContact CD2-CG1 3.93Å; L32-V90 HydrophobicContact CG-CG1 3.91Å; L32-L91 HydrophobicContact CD1-CD1 3.99Å; L32-L91 HydrophobicContact CD2-CB 4.24Å; L32-Y94 HydrophobicContact CD1-CD1 4.5Å
33	E	95.7	Very high	93.9	Very high	79 Å²	79	50.1 Å²	50.1	37%	0.369	27%	0.27	S	S	.	.	H	α-helix	trans	-63.2	-40.4	178.7	-72.7	-176.3	167.2	0	0	111.7	I29 A30 W36 L37 V90	I29-E33 HydrophobicContact CG2-CG 4.37Å; I29-E33 WeakPolarHBondContact O-CG 3.36Å; I29-E33 PolarHBondContact O-N 3.28Å; A30-E33 PolarHBondContact O-N 3.04Å; E33-W36 PolarHBondContact O-N 3.28Å; E33-L37 WeakPolarHBondContact O-CG 3.42Å; E33-L37 PolarHBondContact O-N 3.09Å; E33-V90 HydrophobicContact CG-CG1 4.33Å
34	Q	95.1	Very high	94.6	Very high	51 Å²	51	47.5 Å²	47.5	24%	0.238	26%	0.257	C	S	.	.	H	α-helix	trans	-60.5	-50.8	173.6	159.2	161	5.6	0	0	111.9	A30 K31 L32 W36 L37 N38 Q223	A30-Q34 WeakPolarHBondContact O-CB 3.2Å; A30-Q34 PolarHBondContact O-N 2.85Å; K31-Q34 PolarHBondContact O-N 3.23Å; L32-Q34 VanDerWaalsContact C-N 3.34Å; L32-Q34 PolarHBondContact O-N 3.42Å; Q34-W36 VanDerWaalsContact C-N 3.29Å; Q34-W36 PolarHBondContact O-N 3.27Å; Q34-L37 PolarHBondContact O-N 3.05Å; Q34-N38 WeakPolarHBondContact O-CB 3.33Å; Q34-N38 PolarHBondContact O-N 3.34Å; Q34-Q223 VanDerWaalsContact CB-OE1 3.25Å; Q34-Q223 PolarHBondContact O-NE2 2.77Å
35	A	96.1	Very high	94.9	Very high	13 Å²	13	44.9 Å²	44.9	11%	0.107	24%	0.241	C	C	.	.	H	α-helix	trans	-60.9	-41.5	177.9	0	0	0	0	0	111	K31 L32 E39 R49 Y94	K31-A35 WeakPolarHBondContact O-CB 3.35Å; K31-A35 PolarHBondContact O-N 3.49Å; L32-A35 PolarHBondContact O-N 3.45Å; A35-E39 WeakPolarHBondContact O-CB 3.23Å; A35-E39 PolarHBondContact O-N 3.16Å; A35-R49 HydrophobicContact CB-CG 4.24Å; A35-Y94 HydrophobicContact CB-CE2 4.08Å
36	W	97.3	Very high	95.3	Very high	42 Å²	42	41.6 Å²	41.6	16%	0.159	22%	0.219	C	C	.	.	H	α-helix	trans	-60.2	-49.7	176.8	172	49.6	0	0	0	113	L32 E33 Q34 K40 F89 V90 S93	L32-W36 VanDerWaalsContact O-CB 3.25Å; L32-W36 WeakPolarHBondContact O-CB 3.01Å; L32-W36 PolarHBondContact O-N 2.72Å; E33-W36 PolarHBondContact O-N 3.28Å; Q34-W36 VanDerWaalsContact C-N 3.29Å; Q34-W36 PolarHBondContact O-N 3.27Å; W36-K40 WeakPolarHBondContact O-CB 3.23Å; W36-K40 PolarHBondContact O-N 2.9Å; W36-F89 HydrophobicContact CH2-CE1 4.48Å; W36-F89 HydrophobicContact CZ2-CE1 4.31Å; W36-V90 HydrophobicContact CB-CG1 4.01Å; W36-V90 HydrophobicContact CD2-CG1 3.92Å; W36-V90 HydrophobicContact CE3-CG1 3.86Å; W36-V90 HydrophobicContact CE3-CG2 4.39Å; W36-V90 HydrophobicContact CG-CG1 4Å; W36-V90 HydrophobicContact CZ3-CG2 4.36Å; W36-S93 VanDerWaalsContact NE1-CB 3.33Å; W36-S93 PolarHBondContact NE1-OG 3.39Å
37	L	96.8	Very high	95.4	Very high	49 Å²	49	40.1 Å²	40.1	26%	0.257	20%	0.198	S	C	.	.	H	α-helix	trans	-67.3	-44.5	179.6	-70.3	174.3	0	0	0	111.4	E33 Q34 E39 K40 F41 Q223	E33-L37 WeakPolarHBondContact O-CG 3.42Å; E33-L37 PolarHBondContact O-N 3.09Å; Q34-L37 PolarHBondContact O-N 3.05Å; L37-E39 VanDerWaalsContact C-N 3.33Å; L37-E39 PolarHBondContact O-N 3.42Å; L37-K40 PolarHBondContact O-N 3.04Å; L37-K40 VanDerWaalsContact O-N 3.13Å; L37-F41 HydrophobicContact CD2-CE2 3.98Å; L37-F41 WeakPolarHBondContact O-CD2 3.47Å; L37-F41 PolarHBondContact O-N 3.48Å; L37-F41 VanDerWaalsContact O-N 3.12Å; L37-Q223 VanDerWaalsContact CB-NE2 3.32Å
38	N	97.1	Very high	95.3	Very high	8 Å²	8	36.7 Å²	36.7	4%	0.043	18%	0.183	C	C	.	.	H	α-helix	trans	-58.4	-47.3	176.5	-78.7	-12	0	0	0	110.9	Q34 K40 F41 S42 L46 V217 Q223 L224	Q34-N38 WeakPolarHBondContact O-CB 3.33Å; Q34-N38 PolarHBondContact O-N 3.34Å; N38-K40 VanDerWaalsContact C-N 3.29Å; N38-K40 PolarHBondContact O-N 3.41Å; N38-F41 PolarHBondContact O-N 2.93Å; N38-S42 VanDerWaalsContact O-CB 3.29Å; N38-S42 WeakPolarHBondContact O-CB 3.39Å; N38-S42 PolarHBondContact O-N 2.87Å; N38-S42 PolarHBondContact O-OG 3.09Å; N38-S42 VanDerWaalsContact O-OG 3.07Å; N38-L46 HydrophobicContact CB-CD1 3.63Å; N38-V217 HydrophobicContact CB-CG1 4.2Å; N38-Q223 PolarHBondContact OD1-NE2 2.83Å; N38-L224 PolarHBondContact OD1-N 2.95Å
39	E	97.2	Very high	95.3	Very high	2 Å²	2	41.1 Å²	41.1	1%	0.009	20%	0.199	C	C	.	.	H	α-helix	trans	-64.6	-33.2	177.7	-167.6	68.7	-111.7	0	0	112.1	A35 L37 L46 Y94 R98 K101	A35-E39 WeakPolarHBondContact O-CB 3.23Å; A35-E39 PolarHBondContact O-N 3.16Å; L37-E39 VanDerWaalsContact C-N 3.33Å; L37-E39 PolarHBondContact O-N 3.42Å; E39-L46 PolarHBondContact OE1-N 3.17Å; E39-Y94 HydrophobicContact CB-CD2 3.9Å; E39-Y94 HydrophobicContact CB-CE2 3.91Å; E39-Y94 HydrophobicContact CG-CD2 4.14Å; E39-Y94 HydrophobicContact CG-CE2 4.07Å; E39-R98 HydrophobicContact CG-CG 3.6Å; E39-R98 IonicContact OE2-CZ 2.83Å; E39-R98 IonicContact OE2-NH1 3.64Å; E39-R98 PolarHBondContact OE2-NH1 3.08Å; E39-K101 WeakPolarHBondContact O-CE 3.32Å; E39-K101 PolarHBondContact O-NZ 3.09Å; E39-K101 WeakPolarHBondContact OE1-CD 3.42Å; E39-K101 IonicContact OE1-NZ 3.12Å; E39-K101 PolarHBondContact OE1-NZ 3.36Å
40	K	95.9	Very high	95.1	Very high	110 Å²	110	41.1 Å²	41.1	48%	0.478	20%	0.202	S	C	.	.	H	α-helix	trans	-69.3	-36.1	179.5	-171.7	177.4	179.4	-172.6	0	112.9	W36 L37 N38	W36-K40 WeakPolarHBondContact O-CB 3.23Å; W36-K40 PolarHBondContact O-N 2.9Å; L37-K40 PolarHBondContact O-N 3.04Å; L37-K40 VanDerWaalsContact O-N 3.13Å; N38-K40 VanDerWaalsContact C-N 3.29Å; N38-K40 PolarHBondContact O-N 3.41Å
41	F	96.4	Very high	94.9	Very high	71 Å²	71	46.2 Å²	46.2	31%	0.311	22%	0.217	S	C	.	.	H	α-helix	trans	-103.8	-12.1	-172.2	-63.3	-63.9	0	0	0	114.3	L37 N38 V173 L224 I225	L37-F41 HydrophobicContact CD2-CE2 3.98Å; L37-F41 WeakPolarHBondContact O-CD2 3.47Å; L37-F41 PolarHBondContact O-N 3.48Å; L37-F41 VanDerWaalsContact O-N 3.12Å; N38-F41 PolarHBondContact O-N 2.93Å; F41-V173 WeakPolarHBondContact O-CG1 3.47Å; F41-L224 HydrophobicContact CB-CB 3.78Å; F41-L224 HydrophobicContact CB-CD1 4.11Å; F41-L224 HydrophobicContact CD2-CB 4.4Å; F41-I225 VanDerWaalsContact CE2-C 3.43Å; F41-I225 VanDerWaalsContact CE2-OXT 3.23Å; F41-I225 WeakPolarHBondContact CE2-OXT 3.46Å; F41-I225 VanDerWaalsContact CZ-OXT 3.23Å; F41-I225 WeakPolarHBondContact CZ-OXT 3.31Å
42	S	96.4	Very high	94.9	Very high	6 Å²	6	42.3 Å²	42.3	4%	0.042	20%	0.201	C	C	.	.			trans	-74.9	141.3	173.5	63.5	0	0	0	0	111.6	N38 E44 L46 K101	N38-S42 VanDerWaalsContact O-CB 3.29Å; N38-S42 WeakPolarHBondContact O-CB 3.39Å; N38-S42 PolarHBondContact O-N 2.87Å; N38-S42 PolarHBondContact O-OG 3.09Å; N38-S42 VanDerWaalsContact O-OG 3.07Å; S42-E44 VanDerWaalsContact C-N 3.3Å; S42-E44 PolarHBondContact O-N 2.94Å; S42-E44 PolarHBondContact OG-O 3.12Å; S42-L46 WeakPolarHBondContact OG-CG 3.26Å; S42-K101 VanDerWaalsContact O-CE 3.22Å; S42-K101 WeakPolarHBondContact O-CE 3.11Å; S42-K101 PolarHBondContact O-NZ 3.39Å; S42-K101 PolarHBondContact OG-NZ 2.81Å
43	P	95.6	Very high	94.8	Very high	19 Å²	19	43.2 Å²	43.2	12%	0.123	21%	0.207	C	C	.	.	S	Bend	trans	-75.2	-20.2	179.2	30.2	-34.7	0	0	0	113.3	Y105 C168 Y210	P43-Y105 WeakPolarHBondContact O-CE2 3.29Å; P43-Y105 PolarHBondContact O-OH 2.99Å; P43-C168 VanDerWaalsContact CB-O 3.29Å; P43-C168 WeakPolarHBondContact CB-O 3.49Å; P43-C168 WeakPolarHBondContact CG-O 3.19Å; P43-Y210 HydrophobicContact CG-CD1 3.43Å; P43-Y210 VanDerWaalsContact CG-CD1 3.43Å; P43-Y210 HydrophobicContact CG-CD2 4.3Å; P43-Y210 HydrophobicContact CG-CE1 4.01Å; P43-Y210 HydrophobicContact CG-CG 3.59Å
44	E	94.9	Very high	94.7	Very high	25 Å²	25	45 Å²	45	12%	0.117	22%	0.215	C	C	.	.	S	Bend	trans	-114.1	166.8	179.8	65.7	171.8	172.9	0	0	112.2	S42 L46 K101 R112 P167 L169 Y210	S42-E44 VanDerWaalsContact C-N 3.3Å; S42-E44 PolarHBondContact O-N 2.94Å; S42-E44 PolarHBondContact OG-O 3.12Å; E44-L46 HydrophobicContact CG-CD2 4.5Å; E44-K101 PolarHBondContact O-NZ 3.24Å; E44-R112 IonicContact OE2-CZ 3.49Å; E44-R112 IonicContact OE2-NH1 2.77Å; E44-R112 PolarHBondContact OE2-NH1 2.95Å; E44-R112 IonicContact OE2-NH2 3.56Å; E44-P167 HydrophobicContact CB-CB 3.73Å; E44-P167 HydrophobicContact CB-CG 4.21Å; E44-L169 HydrophobicContact CB-CD2 4.14Å; E44-L169 HydrophobicContact CG-CD2 4.12Å; E44-Y210 HydrophobicContact CG-CE1 3.67Å; E44-Y210 WeakPolarHBondContact OE1-CE1 3.26Å; E44-Y210 PolarHBondContact OE1-OH 3.13Å
45	L	95.6	Very high	94.6	Very high	3 Å²	3	45.2 Å²	45.2	2%	0.016	22%	0.222	C	C	.	.	P	Polyproline II helix	trans	-72.4	128.6	172.6	-173.5	67.8	0	0	0	109.9	R98 K101 I102 V109 L123 L124	L45-R98 HydrophobicContact CD1-CB 4.08Å; L45-R98 HydrophobicContact CD1-CG 4.14Å; L45-K101 HydrophobicContact CD1-CB 4.2Å; L45-K101 HydrophobicContact CD1-CD 4.44Å; L45-I102 HydrophobicContact CD1-CG1 4.28Å; L45-I102 HydrophobicContact CD2-CD1 4.3Å; L45-I102 HydrophobicContact CD2-CG1 3.68Å; L45-V109 HydrophobicContact CB-CG2 4.45Å; L45-V109 HydrophobicContact CD2-CG1 3.87Å; L45-V109 HydrophobicContact CD2-CG2 4.2Å; L45-L123 HydrophobicContact CB-CD2 4.34Å; L45-L123 HydrophobicContact CD2-CD2 4.2Å; L45-L123 HydrophobicContact CG-CD2 4.42Å; L45-L124 HydrophobicContact CD2-CD2 3.61Å
46	L	94.7	Very high	94.5	Very high	18 Å²	18	44.7 Å²	44.7	9%	0.094	22%	0.217	C	C	.	.	P	Polyproline II helix	trans	-87.4	169.1	177.5	-57.6	-178.7	0	0	0	111.7	N38 E39 S42 E44 R98 Y210 V217	N38-L46 HydrophobicContact CB-CD1 3.63Å; E39-L46 PolarHBondContact OE1-N 3.17Å; S42-L46 WeakPolarHBondContact OG-CG 3.26Å; E44-L46 HydrophobicContact CG-CD2 4.5Å; L46-R98 PolarHBondContact O-NH1 3.11Å; L46-Y210 WeakPolarHBondContact CD2-OH 3.36Å; L46-V217 HydrophobicContact CD1-CG1 4.24Å
47	E	93	Very high	94.4	Very high	45 Å²	45	47.2 Å²	47.2	21%	0.21	23%	0.232	C	C	.	.	P	Polyproline II helix	trans	-51.6	137.4	171.8	-69.8	165	-146.6	0	0	111.5	R49 P121 L123 S218	E47-R49 IonicContact OE2-NH2 3.45Å; E47-P121 HydrophobicContact CG-CB 4.45Å; E47-P121 HydrophobicContact CG-CG 4.12Å; E47-L123 HydrophobicContact CG-CD1 4.39Å; E47-S218 PolarHBondContact OE1-OG 3.32Å
48	N	91.3	Very high	94.2	Very high	27 Å²	27	51.1 Å²	51.1	14%	0.144	25%	0.249	C	C	.	.	P	Polyproline II helix	trans	-72.9	133.2	178.4	-179.3	19.6	0	0	0	110.7	S50 S122 S125	N48-S50 PolarHBondContact ND2-OG 2.86Å; N48-S50 PolarHBondContact OD1-N 3.49Å; N48-S122 PolarHBondContact N-O 3.34Å; N48-S125 WeakPolarHBondContact ND2-CA 3.5Å; N48-S125 WeakPolarHBondContact ND2-CB 3.16Å; N48-S125 PolarHBondContact ND2-N 3.4Å
49	R	92.4	Very high	94	Very high	106 Å²	106	54.7 Å²	54.7	40%	0.4	27%	0.265	S	S	.	.			trans	-103.3	57.9	174.3	-56.9	-61.5	-177	168.7	-2.8	110.6	A35 E47 E51 V52 V53 S218	A35-R49 HydrophobicContact CB-CG 4.24Å; E47-R49 IonicContact OE2-NH2 3.45Å; R49-E51 VanDerWaalsContact C-N 3.29Å; R49-E51 PolarHBondContact O-N 3.23Å; R49-V52 HydrophobicContact CB-CB 4.2Å; R49-V52 HydrophobicContact CB-CG2 4.26Å; R49-V52 PolarHBondContact O-N 3.27Å; R49-V52 VanDerWaalsContact O-N 3.17Å; R49-V53 PolarHBondContact O-N 3.42Å; R49-V53 VanDerWaalsContact O-N 3.1Å; R49-S218 PolarHBondContact NH2-O 3.26Å
50	S	90.6	Very high	93.8	Very high	35 Å²	35	55 Å²	55	25%	0.245	27%	0.267	C	S	.	.	H	α-helix	trans	-52.8	-45.8	-178.7	-74.8	0	0	0	0	112.4	N48 V52 V53 E54	N48-S50 PolarHBondContact ND2-OG 2.86Å; N48-S50 PolarHBondContact OD1-N 3.49Å; S50-V52 VanDerWaalsContact C-N 3.3Å; S50-V52 PolarHBondContact O-N 3.48Å; S50-V53 WeakPolarHBondContact O-CB 3.48Å; S50-V53 PolarHBondContact O-N 2.96Å; S50-E54 WeakPolarHBondContact O-CB 3.39Å; S50-E54 WeakPolarHBondContact O-CG 3.46Å; S50-E54 PolarHBondContact O-N 3.43Å
51	E	91.6	Very high	93.7	Very high	160 Å²	160	53.8 Å²	53.8	75%	0.748	27%	0.269	S	S	*	.	H	α-helix	trans	-55.7	-45	-179.5	-62.1	173.3	-177.7	0	0	111.8	R49 C55	R49-E51 VanDerWaalsContact C-N 3.29Å; R49-E51 PolarHBondContact O-N 3.23Å; E51-C55 WeakPolarHBondContact O-CB 3.42Å; E51-C55 PolarHBondContact O-N 2.84Å; E51-C55 PolarHBondContact O-SG 3.43Å
52	V	93.1	Very high	93.5	Very high	17 Å²	17	55.6 Å²	55.6	10%	0.103	28%	0.278	C	S	.	.	H	α-helix	trans	-65.9	-43.1	177.9	177.1	0	0	0	0	110.7	L28 K31 L32 R49 S50 V56	L28-V52 HydrophobicContact CD1-CB 4.35Å; L28-V52 HydrophobicContact CD1-CG1 3.95Å; K31-V52 HydrophobicContact CB-CG1 4.5Å; K31-V52 HydrophobicContact CB-CG2 4.3Å; L32-V52 HydrophobicContact CB-CG1 3.94Å; L32-V52 HydrophobicContact CD1-CG1 4.4Å; R49-V52 HydrophobicContact CB-CB 4.2Å; R49-V52 HydrophobicContact CB-CG2 4.26Å; R49-V52 PolarHBondContact O-N 3.27Å; R49-V52 VanDerWaalsContact O-N 3.17Å; S50-V52 VanDerWaalsContact C-N 3.3Å; S50-V52 PolarHBondContact O-N 3.48Å; V52-V56 HydrophobicContact CG1-CG2 4.4Å; V52-V56 WeakPolarHBondContact O-CB 3.42Å; V52-V56 WeakPolarHBondContact O-CG2 3.18Å; V52-V56 PolarHBondContact O-N 3.03Å
53	V	94.1	Very high	93.2	Very high	22 Å²	22	57.6 Å²	57.6	13%	0.133	29%	0.288	C	S	.	.	H	α-helix	trans	-62.9	-47.8	179.2	169.6	0	0	0	0	111.2	R49 S50 V56 M57 L91 Y94 L95	R49-V53 PolarHBondContact O-N 3.42Å; R49-V53 VanDerWaalsContact O-N 3.1Å; S50-V53 WeakPolarHBondContact O-CB 3.48Å; S50-V53 PolarHBondContact O-N 2.96Å; V53-V56 PolarHBondContact O-N 3.23Å; V53-M57 HydrophobicContact CG1-CG 4.43Å; V53-M57 WeakPolarHBondContact O-CB 3.3Å; V53-M57 VanDerWaalsContact O-CG 3.24Å; V53-M57 WeakPolarHBondContact O-CG 3.42Å; V53-M57 PolarHBondContact O-N 3.21Å; V53-L91 HydrophobicContact CB-CD1 4.5Å; V53-L91 HydrophobicContact CG1-CD1 4.19Å; V53-L91 HydrophobicContact CG2-CD1 4.14Å; V53-Y94 HydrophobicContact CG2-CD1 4.18Å; V53-Y94 HydrophobicContact CG2-CE1 3.68Å; V53-L95 HydrophobicContact CG1-CD2 4.42Å; V53-L95 HydrophobicContact CG2-CD2 4.34Å
54	E	93.3	Very high	93	Very high	116 Å²	116	60 Å²	60	54%	0.542	30%	0.297	S	S	.	.	H	α-helix	trans	-62	-51.6	179.9	-72.9	172.7	-162.7	0	0	110.8	S50 V56 M57 E58	S50-E54 WeakPolarHBondContact O-CB 3.39Å; S50-E54 WeakPolarHBondContact O-CG 3.46Å; S50-E54 PolarHBondContact O-N 3.43Å; E54-V56 VanDerWaalsContact C-N 3.33Å; E54-V56 PolarHBondContact O-N 3.35Å; E54-M57 PolarHBondContact O-N 3.12Å; E54-M57 VanDerWaalsContact O-N 3.16Å; E54-E58 WeakPolarHBondContact O-CG 3.48Å; E54-E58 PolarHBondContact O-N 3.35Å
55	C	93.8	Very high	92.8	Very high	56 Å²	56	60.5 Å²	60.5	38%	0.378	31%	0.305	S	S	.	.	H	α-helix	trans	-58.8	-42.6	177.5	-69.2	0	0	0	0	112.1	L28 E51 E58 Q59	L28-C55 HydrophobicContact CD1-CB 3.83Å; L28-C55 HydrophobicContact CD2-CB 3.68Å; L28-C55 HydrophobicContact CG-CB 4.42Å; E51-C55 WeakPolarHBondContact O-CB 3.42Å; E51-C55 PolarHBondContact O-N 2.84Å; E51-C55 PolarHBondContact O-SG 3.43Å; C55-E58 PolarHBondContact O-N 2.88Å; C55-Q59 VanDerWaalsContact O-CG 3.28Å; C55-Q59 WeakPolarHBondContact O-CG 3.39Å; C55-Q59 PolarHBondContact O-N 3.17Å
56	V	94.6	Very high	92.5	Very high	1 Å²	1	63.2 Å²	63.2	1%	0.006	32%	0.32	C	S	.	.	H	α-helix	trans	-65.3	-42.6	177.9	172.1	0	0	0	0	111	L28 I29 L32 V52 V53 E54 E58 Q59 L60 I87 L91	L28-V56 HydrophobicContact CD1-CG2 4.08Å; L28-V56 HydrophobicContact CD2-CG2 3.78Å; L28-V56 HydrophobicContact CG-CG2 3.66Å; I29-V56 HydrophobicContact CD1-CG2 4.3Å; L32-V56 HydrophobicContact CB-CG2 4.45Å; L32-V56 HydrophobicContact CD2-CG1 4.08Å; L32-V56 HydrophobicContact CD2-CG2 4.13Å; V52-V56 HydrophobicContact CG1-CG2 4.4Å; V52-V56 WeakPolarHBondContact O-CB 3.42Å; V52-V56 WeakPolarHBondContact O-CG2 3.18Å; V52-V56 PolarHBondContact O-N 3.03Å; V53-V56 PolarHBondContact O-N 3.23Å; E54-V56 VanDerWaalsContact C-N 3.33Å; E54-V56 PolarHBondContact O-N 3.35Å; V56-E58 VanDerWaalsContact C-N 3.34Å; V56-E58 PolarHBondContact O-N 2.92Å; V56-Q59 PolarHBondContact O-N 2.98Å; V56-L60 HydrophobicContact CG1-CD1 3.96Å; V56-L60 HydrophobicContact CG1-CG 4.22Å; V56-L60 WeakPolarHBondContact O-CB 3.41Å; V56-L60 VanDerWaalsContact O-CG 3.26Å; V56-L60 WeakPolarHBondContact O-CG 3.37Å; V56-L60 PolarHBondContact O-N 3.42Å; V56-I87 HydrophobicContact CG1-CG2 3.66Å; V56-L91 HydrophobicContact CG1-CD2 4.09Å
57	M	94.1	Very high	92.2	Very high	96 Å²	96	64.2 Å²	64.2	47%	0.473	33%	0.325	S	S	.	.	H	α-helix	trans	-60.9	-42.5	177.6	-78.1	-70.1	-71	0	0	112	V53 E54 T61 L91	V53-M57 HydrophobicContact CG1-CG 4.43Å; V53-M57 WeakPolarHBondContact O-CB 3.3Å; V53-M57 VanDerWaalsContact O-CG 3.24Å; V53-M57 WeakPolarHBondContact O-CG 3.42Å; V53-M57 PolarHBondContact O-N 3.21Å; E54-M57 PolarHBondContact O-N 3.12Å; E54-M57 VanDerWaalsContact O-N 3.16Å; M57-T61 WeakPolarHBondContact O-CB 3.43Å; M57-T61 PolarHBondContact O-N 3.15Å; M57-T61 PolarHBondContact O-OG1 2.84Å; M57-L91 HydrophobicContact CG-CD2 3.81Å; M57-L91 HydrophobicContact SD-CD2 3.49Å; M57-L91 WeakPolarHBondContact SD-CD2 3.22Å
58	E	93.8	Very high	91.9	Very high	130 Å²	130	69.9 Å²	69.9	61%	0.607	35%	0.352	S	S	*	.	H	α-helix	trans	-63.4	-47.4	175.3	-72.2	-176.8	173	0	0	111.9	E54 C55 V56 L60 T61 H62	E54-E58 WeakPolarHBondContact O-CG 3.48Å; E54-E58 PolarHBondContact O-N 3.35Å; C55-E58 PolarHBondContact O-N 2.88Å; V56-E58 VanDerWaalsContact C-N 3.34Å; V56-E58 PolarHBondContact O-N 2.92Å; E58-L60 PolarHBondContact O-N 3.32Å; E58-T61 PolarHBondContact O-N 3.28Å; E58-H62 WeakPolarHBondContact O-CB 3.39Å; E58-H62 PolarHBondContact O-N 3.1Å
59	Q	91.7	Very high	91.7	Very high	83 Å²	83	78.1 Å²	78.1	39%	0.388	38%	0.381	S	S	.	.	H	α-helix	trans	-61.7	-42.6	178.2	-70.1	-57.7	-44.9	0	0	111.9	L28 C55 V56 H62 M63	L28-Q59 HydrophobicContact CD2-CG 4.33Å; C55-Q59 VanDerWaalsContact O-CG 3.28Å; C55-Q59 WeakPolarHBondContact O-CG 3.39Å; C55-Q59 PolarHBondContact O-N 3.17Å; V56-Q59 PolarHBondContact O-N 2.98Å; Q59-H62 PolarHBondContact O-N 3.37Å; Q59-M63 WeakPolarHBondContact O-CB 3.39Å; Q59-M63 VanDerWaalsContact O-CG 3.3Å; Q59-M63 WeakPolarHBondContact O-CG 3.42Å; Q59-M63 PolarHBondContact O-N 3.19Å
60	L	93.1	Very high	91.4	Very high	8 Å²	8	75.7 Å²	75.7	4%	0.042	38%	0.377	C	S	.	.	H	α-helix	trans	-60.2	-46.8	174.8	-73.9	176.1	0	0	0	111.5	V56 E58 H62 M63 E64 I84 I87 R88 L91	V56-L60 HydrophobicContact CG1-CD1 3.96Å; V56-L60 HydrophobicContact CG1-CG 4.22Å; V56-L60 WeakPolarHBondContact O-CB 3.41Å; V56-L60 VanDerWaalsContact O-CG 3.26Å; V56-L60 WeakPolarHBondContact O-CG 3.37Å; V56-L60 PolarHBondContact O-N 3.42Å; E58-L60 PolarHBondContact O-N 3.32Å; L60-H62 PolarHBondContact O-N 3.41Å; L60-M63 PolarHBondContact O-N 3.33Å; L60-E64 WeakPolarHBondContact O-CB 3.12Å; L60-E64 WeakPolarHBondContact O-CG 3.4Å; L60-E64 PolarHBondContact O-N 3.49Å; L60-I84 HydrophobicContact CD2-CB 4.4Å; L60-I84 HydrophobicContact CD2-CG1 4.35Å; L60-I84 HydrophobicContact CD2-CG2 4.16Å; L60-I87 HydrophobicContact CD1-CG2 4.15Å; L60-I87 HydrophobicContact CD2-CB 4Å; L60-I87 HydrophobicContact CD2-CG2 3.86Å; L60-I87 HydrophobicContact CG-CG2 4.2Å; L60-R88 HydrophobicContact CD1-CB 4.48Å; L60-L91 HydrophobicContact CD1-CD2 4.17Å
61	T	93.9	Very high	90.9	Very high	85 Å²	85	82.9 Å²	82.9	52%	0.521	40%	0.404	S	S	.	.	H	α-helix	trans	-61.9	-43.9	179.4	-57.3	0	0	0	0	111.4	M57 E58 E64 A65	M57-T61 WeakPolarHBondContact O-CB 3.43Å; M57-T61 PolarHBondContact O-N 3.15Å; M57-T61 PolarHBondContact O-OG1 2.84Å; E58-T61 PolarHBondContact O-N 3.28Å; T61-E64 PolarHBondContact O-N 3.22Å; T61-A65 WeakPolarHBondContact O-CB 3.34Å; T61-A65 PolarHBondContact O-N 3.17Å
62	H	92.1	Very high	90.3	Very high	109 Å²	109	85.6 Å²	85.6	51%	0.505	41%	0.414	S	S	.	.	H	α-helix	trans	-64.5	-44.2	177.4	179.9	-115.1	0	0	0	112	E58 Q59 L60 A65 N66	E58-H62 WeakPolarHBondContact O-CB 3.39Å; E58-H62 PolarHBondContact O-N 3.1Å; Q59-H62 PolarHBondContact O-N 3.37Å; L60-H62 PolarHBondContact O-N 3.41Å; H62-A65 PolarHBondContact O-N 3.33Å; H62-N66 PolarHBondContact CE1-ND2 3.18Å; H62-N66 PolarHBondContact ND1-ND2 2.85Å; H62-N66 PolarHBondContact NE2-ND2 3.11Å; H62-N66 VanDerWaalsContact NE2-ND2 3.19Å; H62-N66 VanDerWaalsContact O-CG 3.29Å; H62-N66 PolarHBondContact O-N 3.37Å; H62-N66 PolarHBondContact O-ND2 3.48Å
63	M	89.9	Confident	89.6	Confident	49 Å²	49	88.9 Å²	88.9	24%	0.241	45%	0.451	C	S	.	.	H	α-helix	trans	-63.5	-41.1	176.7	-73.5	-176.2	67.5	0	0	112.2	Q59 L60 N66 L67 H80 I84	Q59-M63 WeakPolarHBondContact O-CB 3.39Å; Q59-M63 VanDerWaalsContact O-CG 3.3Å; Q59-M63 WeakPolarHBondContact O-CG 3.42Å; Q59-M63 PolarHBondContact O-N 3.19Å; L60-M63 PolarHBondContact O-N 3.33Å; M63-N66 PolarHBondContact O-N 3.03Å; M63-L67 WeakPolarHBondContact O-CG 3.45Å; M63-L67 PolarHBondContact O-N 3.23Å; M63-H80 HydrophobicContact CE-CB 4.41Å; M63-I84 HydrophobicContact CB-CD1 3.77Å; M63-I84 HydrophobicContact CB-CG1 4.13Å; M63-I84 HydrophobicContact CE-CD1 4.29Å; M63-I84 HydrophobicContact CE-CG1 3.94Å; M63-I84 HydrophobicContact SD-CG1 4.42Å
64	E	90.8	Very high	89.1	Confident	69 Å²	69	91.7 Å²	91.7	32%	0.322	47%	0.465	S	S	.	.	H	α-helix	trans	-61.9	-46.6	175.5	-77.4	177.1	-159	0	0	112.2	L60 T61 N66 L67 Q68 I84 R88	L60-E64 WeakPolarHBondContact O-CB 3.12Å; L60-E64 WeakPolarHBondContact O-CG 3.4Å; L60-E64 PolarHBondContact O-N 3.49Å; T61-E64 PolarHBondContact O-N 3.22Å; E64-N66 VanDerWaalsContact C-N 3.27Å; E64-N66 PolarHBondContact O-N 3.01Å; E64-L67 PolarHBondContact O-N 3.45Å; E64-Q68 WeakPolarHBondContact O-CG 3.24Å; E64-Q68 PolarHBondContact O-N 3.49Å; E64-Q68 VanDerWaalsContact O-N 3.09Å; E64-I84 HydrophobicContact CG-CD1 4.19Å; E64-I84 HydrophobicContact CG-CG2 4.27Å; E64-R88 IonicContact OE1-CZ 2.72Å; E64-R88 IonicContact OE1-NE 3.88Å; E64-R88 IonicContact OE1-NH2 4Å; E64-R88 PolarHBondContact OE1-NH2 3.48Å
65	A	92.1	Very high	88.8	Confident	35 Å²	35	89.4 Å²	89.4	29%	0.289	47%	0.466	S	S	.	.	H	α-helix	trans	-60.7	-38.3	177.6	0	0	0	0	0	111.9	T61 H62 Q68	T61-A65 WeakPolarHBondContact O-CB 3.34Å; T61-A65 PolarHBondContact O-N 3.17Å; H62-A65 PolarHBondContact O-N 3.33Å; A65-Q68 PolarHBondContact O-N 3.49Å
66	N	88.6	Confident	88.4	Confident	60 Å²	60	93.1 Å²	93.1	32%	0.321	48%	0.476	S	S	.	.	H	α-helix	trans	-67.6	-41.5	175.7	-71.9	-28.8	0	0	0	111.9	H62 M63 E64 Q68 R69	H62-N66 PolarHBondContact CE1-ND2 3.18Å; H62-N66 PolarHBondContact ND1-ND2 2.85Å; H62-N66 PolarHBondContact NE2-ND2 3.11Å; H62-N66 VanDerWaalsContact NE2-ND2 3.19Å; H62-N66 VanDerWaalsContact O-CG 3.29Å; H62-N66 PolarHBondContact O-N 3.37Å; H62-N66 PolarHBondContact O-ND2 3.48Å; M63-N66 PolarHBondContact O-N 3.03Å; E64-N66 VanDerWaalsContact C-N 3.27Å; E64-N66 PolarHBondContact O-N 3.01Å; N66-Q68 VanDerWaalsContact C-N 3.29Å; N66-Q68 PolarHBondContact O-N 3.17Å; N66-R69 WeakPolarHBondContact O-CB 3.36Å; N66-R69 PolarHBondContact O-N 3.06Å
67	L	88.6	Confident	88.2	Confident	39 Å²	39	94.1 Å²	94.1	20%	0.204	49%	0.485	C	S	.	.	H	α-helix	trans	-63.8	-31.5	177.4	-75.1	178.9	0	0	0	113.4	M63 E64 R69 V70 A77 H80 R81 I84	M63-L67 WeakPolarHBondContact O-CG 3.45Å; M63-L67 PolarHBondContact O-N 3.23Å; E64-L67 PolarHBondContact O-N 3.45Å; L67-R69 PolarHBondContact O-N 2.93Å; L67-V70 HydrophobicContact CD2-CG2 4.43Å; L67-V70 PolarHBondContact O-N 3.23Å; L67-A77 HydrophobicContact CD2-CB 3.95Å; L67-H80 HydrophobicContact CD1-CB 4.14Å; L67-H80 HydrophobicContact CD2-CB 3.86Å; L67-H80 HydrophobicContact CG-CB 4.42Å; L67-R81 HydrophobicContact CD1-CB 4.29Å; L67-I84 HydrophobicContact CD1-CD1 3.33Å; L67-I84 HydrophobicContact CG-CD1 4.41Å
68	Q	86.9	Confident	87.9	Confident	165 Å²	165	91.3 Å²	91.3	77%	0.771	48%	0.48	S	S	*	.	H	α-helix	trans	-62.4	-24.2	174	-69.3	178.8	14.6	0	0	112.9	E64 A65 N66	E64-Q68 WeakPolarHBondContact O-CG 3.24Å; E64-Q68 PolarHBondContact O-N 3.49Å; E64-Q68 VanDerWaalsContact O-N 3.09Å; A65-Q68 PolarHBondContact O-N 3.49Å; N66-Q68 VanDerWaalsContact C-N 3.29Å; N66-Q68 PolarHBondContact O-N 3.17Å
69	R	86.9	Confident	87.8	Confident	199 Å²	199	92 Å²	92	75%	0.751	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.1	-10.2	-179.8	-59.4	172.5	-178.8	169.1	-0.6	113.1	N66 L67	N66-R69 WeakPolarHBondContact O-CB 3.36Å; N66-R69 PolarHBondContact O-N 3.06Å; L67-R69 PolarHBondContact O-N 2.93Å
70	V	86.7	Confident	87.8	Confident	55 Å²	55	91.6 Å²	91.6	33%	0.333	48%	0.48	S	S	.	.	S	Bend	trans	-78.4	142.5	-177.5	-176.3	0	0	0	0	111.1	L67 D74 A77	L67-V70 HydrophobicContact CD2-CG2 4.43Å; L67-V70 PolarHBondContact O-N 3.23Å; V70-D74 HydrophobicContact CG1-CB 3.92Å; V70-A77 HydrophobicContact CB-CB 4.35Å; V70-A77 HydrophobicContact CG1-CB 3.91Å
71	K	79.8	Confident	87.7	Confident	187 Å²	187	99.4 Å²	99.4	81%	0.813	51%	0.508	S	S	*	.	P	Polyproline II helix	trans	-64.6	139.8	178.1	-66.8	-179.1	-179.1	177.3	0	110.9	G73	K71-G73 PolarHBondContact O-N 3Å
72	K	77.8	Confident	87.7	Confident	216 Å²	216	101.2 Å²	101.2	94%	0.939	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	129.7	175.1	-66.1	-176.4	179.5	-179.7	0	110.1
73	G	78.4	Confident	87.8	Confident	86 Å²	86	99.4 Å²	99.4	89%	0.887	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	105.1	-1.5	177.9	0	0	0	0	0	115.6	K71 A75	K71-G73 PolarHBondContact O-N 3Å; G73-A75 PolarHBondContact O-N 3.03Å
74	D	85.1	Confident	88	Confident	81 Å²	81	97.2 Å²	97.2	43%	0.433	49%	0.493	S	S	.	.			trans	-76.5	119.3	173.1	-173.1	-2.6	0	0	0	111.4	V70 K76 A77	V70-D74 HydrophobicContact CG1-CB 3.92Å; D74-K76 PolarHBondContact O-N 3.35Å; D74-K76 VanDerWaalsContact OD1-CB 3.3Å; D74-K76 WeakPolarHBondContact OD1-CB 3.47Å; D74-K76 PolarHBondContact OD1-N 3.42Å; D74-A77 HydrophobicContact CB-CB 4.32Å; D74-A77 WeakPolarHBondContact O-CB 3.45Å; D74-A77 PolarHBondContact O-N 3.36Å
75	A	85.8	Confident	88.2	Confident	69 Å²	69	97.7 Å²	97.7	57%	0.57	50%	0.498	S	S	*	.	H	α-helix	trans	-61.8	-31.1	176.4	0	0	0	0	0	112.3	G73 A77 G78 F79	G73-A75 PolarHBondContact O-N 3.03Å; A75-A77 VanDerWaalsContact C-N 3.3Å; A75-A77 PolarHBondContact O-N 3.41Å; A75-G78 WeakPolarHBondContact O-CA 3.43Å; A75-G78 PolarHBondContact O-N 2.97Å; A75-F79 HydrophobicContact CB-CE2 4.43Å; A75-F79 WeakPolarHBondContact O-CD2 3.41Å; A75-F79 PolarHBondContact O-N 2.75Å; A75-F79 VanDerWaalsContact O-N 3.16Å
76	K	86.9	Confident	88.5	Confident	133 Å²	133	103 Å²	103	58%	0.578	51%	0.511	S	S	*	.	H	α-helix	trans	-62.9	-37.4	177.4	-169.6	177.3	178	179.9	0	111.8	D74 G78 F79 H80	D74-K76 PolarHBondContact O-N 3.35Å; D74-K76 VanDerWaalsContact OD1-CB 3.3Å; D74-K76 WeakPolarHBondContact OD1-CB 3.47Å; D74-K76 PolarHBondContact OD1-N 3.42Å; K76-G78 VanDerWaalsContact C-N 3.26Å; K76-G78 PolarHBondContact O-N 3.33Å; K76-F79 PolarHBondContact O-N 2.99Å; K76-H80 VanDerWaalsContact CE-NE2 3.34Å; K76-H80 WeakPolarHBondContact CE-NE2 3.42Å; K76-H80 PolarHBondContact O-CD2 3.33Å; K76-H80 PolarHBondContact O-N 3.04Å; K76-H80 VanDerWaalsContact O-N 3.08Å
77	A	88.9	Confident	88.8	Confident	23 Å²	23	100.9 Å²	100.9	19%	0.19	50%	0.499	C	S	.	.	H	α-helix	trans	-63.3	-35	173.6	0	0	0	0	0	112	L67 V70 D74 A75 R81	L67-A77 HydrophobicContact CD2-CB 3.95Å; V70-A77 HydrophobicContact CB-CB 4.35Å; V70-A77 HydrophobicContact CG1-CB 3.91Å; D74-A77 HydrophobicContact CB-CB 4.32Å; D74-A77 WeakPolarHBondContact O-CB 3.45Å; D74-A77 PolarHBondContact O-N 3.36Å; A75-A77 VanDerWaalsContact C-N 3.3Å; A75-A77 PolarHBondContact O-N 3.41Å; A77-R81 WeakPolarHBondContact O-CB 3.41Å; A77-R81 PolarHBondContact O-N 2.93Å
78	G	89.3	Confident	89.2	Confident	37 Å²	37	102.9 Å²	102.9	38%	0.381	50%	0.504	S	S	.	.	H	α-helix	trans	-61.1	-50.4	173.7	0	0	0	0	0	112.3	A75 K76 H80 R81 M82	A75-G78 WeakPolarHBondContact O-CA 3.43Å; A75-G78 PolarHBondContact O-N 2.97Å; K76-G78 VanDerWaalsContact C-N 3.26Å; K76-G78 PolarHBondContact O-N 3.33Å; G78-H80 PolarHBondContact O-N 3.21Å; G78-R81 PolarHBondContact O-N 3.33Å; G78-M82 WeakPolarHBondContact O-CG 3.49Å; G78-M82 PolarHBondContact O-N 2.74Å
79	F	91.3	Very high	89.7	Confident	145 Å²	145	100.6 Å²	100.6	64%	0.636	49%	0.492	S	S	*	.	H	α-helix	trans	-61.6	-44.6	178.3	-67	-64.4	0	0	0	112.8	A75 K76 R81 M82 E83	A75-F79 HydrophobicContact CB-CE2 4.43Å; A75-F79 WeakPolarHBondContact O-CD2 3.41Å; A75-F79 PolarHBondContact O-N 2.75Å; A75-F79 VanDerWaalsContact O-N 3.16Å; K76-F79 PolarHBondContact O-N 2.99Å; F79-R81 VanDerWaalsContact C-N 3.3Å; F79-R81 PolarHBondContact O-N 3.07Å; F79-M82 PolarHBondContact O-N 2.92Å; F79-E83 PolarHBondContact O-N 3.49Å
80	H	91.4	Very high	90.2	Very high	74 Å²	74	91.8 Å²	91.8	34%	0.343	46%	0.46	S	S	.	.	H	α-helix	trans	-62.6	-37.1	176.5	-76.2	-55.9	0	0	0	112.5	M63 L67 K76 G78 E83 I84	M63-H80 HydrophobicContact CE-CB 4.41Å; L67-H80 HydrophobicContact CD1-CB 4.14Å; L67-H80 HydrophobicContact CD2-CB 3.86Å; L67-H80 HydrophobicContact CG-CB 4.42Å; K76-H80 VanDerWaalsContact CE-NE2 3.34Å; K76-H80 WeakPolarHBondContact CE-NE2 3.42Å; K76-H80 PolarHBondContact O-CD2 3.33Å; K76-H80 PolarHBondContact O-N 3.04Å; K76-H80 VanDerWaalsContact O-N 3.08Å; G78-H80 PolarHBondContact O-N 3.21Å; H80-E83 PolarHBondContact O-N 3.37Å; H80-I84 VanDerWaalsContact O-CG1 3.29Å; H80-I84 WeakPolarHBondContact O-CG1 3.33Å; H80-I84 PolarHBondContact O-N 3.38Å
81	R	91.3	Very high	90.7	Very high	171 Å²	171	89.3 Å²	89.3	65%	0.645	45%	0.445	S	S	*	.	H	α-helix	trans	-65.8	-42	176.2	-168	170.5	-170.6	155.3	4.1	112.1	L67 A77 G78 F79 E83 I84 D85	L67-R81 HydrophobicContact CD1-CB 4.29Å; A77-R81 WeakPolarHBondContact O-CB 3.41Å; A77-R81 PolarHBondContact O-N 2.93Å; G78-R81 PolarHBondContact O-N 3.33Å; F79-R81 VanDerWaalsContact C-N 3.3Å; F79-R81 PolarHBondContact O-N 3.07Å; R81-E83 VanDerWaalsContact C-N 3.28Å; R81-E83 PolarHBondContact O-N 3.12Å; R81-I84 PolarHBondContact O-N 3.13Å; R81-D85 VanDerWaalsContact O-CG 3.3Å; R81-D85 PolarHBondContact O-N 2.95Å
82	M	93.8	Very high	91.5	Very high	124 Å²	124	82.6 Å²	82.6	61%	0.611	42%	0.422	S	S	*	.	H	α-helix	trans	-59.1	-41.6	174.1	-68.8	175	65.2	0	0	111.6	G78 F79 D85 R86	G78-M82 WeakPolarHBondContact O-CG 3.49Å; G78-M82 PolarHBondContact O-N 2.74Å; F79-M82 PolarHBondContact O-N 2.92Å; M82-D85 PolarHBondContact O-N 3.42Å; M82-R86 WeakPolarHBondContact O-CG 3.29Å; M82-R86 PolarHBondContact O-N 3.44Å
83	E	93.8	Very high	92.5	Very high	70 Å²	70	73.2 Å²	73.2	33%	0.327	38%	0.383	S	S	.	.	H	α-helix	trans	-70	-41.4	-179.9	-169	63	-177.3	0	0	112.6	F79 H80 R81 D85 R86 I87	F79-E83 PolarHBondContact O-N 3.49Å; H80-E83 PolarHBondContact O-N 3.37Å; R81-E83 VanDerWaalsContact C-N 3.28Å; R81-E83 PolarHBondContact O-N 3.12Å; E83-D85 VanDerWaalsContact C-N 3.26Å; E83-D85 PolarHBondContact O-N 2.87Å; E83-R86 WeakPolarHBondContact O-CB 3.4Å; E83-R86 PolarHBondContact O-N 2.83Å; E83-R86 VanDerWaalsContact O-N 3.17Å; E83-R86 IonicContact OE1-NH1 2.63Å; E83-R86 PolarHBondContact OE1-NH1 2.93Å; E83-R86 IonicContact OE2-CZ 3.94Å; E83-R86 IonicContact OE2-NE 2.74Å; E83-R86 IonicContact OE2-NH1 3.21Å; E83-R86 PolarHBondContact OE2-NH1 2.88Å; E83-I87 HydrophobicContact CG-CD1 3.94Å; E83-I87 HydrophobicContact CG-CG1 4.5Å; E83-I87 WeakPolarHBondContact O-CG1 3.39Å; E83-I87 PolarHBondContact O-N 3.2Å
84	I	93.8	Very high	93.4	Very high	3 Å²	3	69.3 Å²	69.3	2%	0.015	34%	0.342	C	S	.	.	H	α-helix	trans	-55.3	-44.7	171.7	-74.5	169.3	0	0	0	110.6	L60 M63 E64 L67 H80 R81 R86 I87 R88	L60-I84 HydrophobicContact CD2-CB 4.4Å; L60-I84 HydrophobicContact CD2-CG1 4.35Å; L60-I84 HydrophobicContact CD2-CG2 4.16Å; M63-I84 HydrophobicContact CB-CD1 3.77Å; M63-I84 HydrophobicContact CB-CG1 4.13Å; M63-I84 HydrophobicContact CE-CD1 4.29Å; M63-I84 HydrophobicContact CE-CG1 3.94Å; M63-I84 HydrophobicContact SD-CG1 4.42Å; E64-I84 HydrophobicContact CG-CD1 4.19Å; E64-I84 HydrophobicContact CG-CG2 4.27Å; L67-I84 HydrophobicContact CD1-CD1 3.33Å; L67-I84 HydrophobicContact CG-CD1 4.41Å; H80-I84 VanDerWaalsContact O-CG1 3.29Å; H80-I84 WeakPolarHBondContact O-CG1 3.33Å; H80-I84 PolarHBondContact O-N 3.38Å; R81-I84 PolarHBondContact O-N 3.13Å; I84-R86 PolarHBondContact O-N 2.81Å; I84-I87 PolarHBondContact O-N 2.98Å; I84-R88 VanDerWaalsContact O-CB 3.23Å; I84-R88 WeakPolarHBondContact O-CB 3.35Å; I84-R88 PolarHBondContact O-N 3.48Å
85	D	95.8	Very high	94	Very high	80 Å²	80	68.3 Å²	68.3	43%	0.428	34%	0.336	S	S	.	.	H	α-helix	trans	-66	-37.8	-180	-68.7	-20.3	0	0	0	111.9	R81 M82 E83 R88 F89	R81-D85 VanDerWaalsContact O-CG 3.3Å; R81-D85 PolarHBondContact O-N 2.95Å; M82-D85 PolarHBondContact O-N 3.42Å; E83-D85 VanDerWaalsContact C-N 3.26Å; E83-D85 PolarHBondContact O-N 2.87Å; D85-R88 IonicContact OD1-CZ 3.62Å; D85-R88 IonicContact OD1-NH1 3.61Å; D85-R88 PolarHBondContact OD1-NH1 3.4Å; D85-F89 WeakPolarHBondContact O-CB 3.44Å; D85-F89 PolarHBondContact O-N 2.94Å
86	R	96.9	Very high	94.5	Very high	145 Å²	145	71.5 Å²	71.5	55%	0.547	33%	0.334	S	S	.	.	H	α-helix	trans	-63.1	-50.8	173.8	-72.4	177.5	68.2	-137.8	-1.8	111.9	M82 E83 I84 R88 F89 V90	M82-R86 WeakPolarHBondContact O-CG 3.29Å; M82-R86 PolarHBondContact O-N 3.44Å; E83-R86 WeakPolarHBondContact O-CB 3.4Å; E83-R86 PolarHBondContact O-N 2.83Å; E83-R86 VanDerWaalsContact O-N 3.17Å; E83-R86 IonicContact OE1-NH1 2.63Å; E83-R86 PolarHBondContact OE1-NH1 2.93Å; E83-R86 IonicContact OE2-CZ 3.94Å; E83-R86 IonicContact OE2-NE 2.74Å; E83-R86 IonicContact OE2-NH1 3.21Å; E83-R86 PolarHBondContact OE2-NH1 2.88Å; I84-R86 PolarHBondContact O-N 2.81Å; R86-R88 PolarHBondContact O-N 2.73Å; R86-F89 WeakPolarHBondContact O-CB 3.29Å; R86-F89 PolarHBondContact O-N 3.36Å; R86-V90 PolarHBondContact O-N 3.06Å; R86-V90 VanDerWaalsContact O-N 3.11Å
87	I	96	Very high	95	Very high	16 Å²	16	66 Å²	66	8%	0.082	31%	0.312	C	S	.	.	H	α-helix	trans	-64.1	-43.4	-179.2	-63.9	164.8	0	0	0	110.2	I29 L32 V56 L60 E83 I84 F89 V90 L91	I29-I87 HydrophobicContact CD1-CB 4.45Å; I29-I87 HydrophobicContact CD1-CD1 3.79Å; I29-I87 HydrophobicContact CD1-CG1 3.9Å; I29-I87 HydrophobicContact CD1-CG2 3.68Å; I29-I87 HydrophobicContact CG1-CD1 4.19Å; I29-I87 HydrophobicContact CG1-CG1 4.45Å; L32-I87 HydrophobicContact CD2-CG2 4.38Å; V56-I87 HydrophobicContact CG1-CG2 3.66Å; L60-I87 HydrophobicContact CD1-CG2 4.15Å; L60-I87 HydrophobicContact CD2-CB 4Å; L60-I87 HydrophobicContact CD2-CG2 3.86Å; L60-I87 HydrophobicContact CG-CG2 4.2Å; E83-I87 HydrophobicContact CG-CD1 3.94Å; E83-I87 HydrophobicContact CG-CG1 4.5Å; E83-I87 WeakPolarHBondContact O-CG1 3.39Å; E83-I87 PolarHBondContact O-N 3.2Å; I84-I87 PolarHBondContact O-N 2.98Å; I87-F89 VanDerWaalsContact C-N 3.28Å; I87-F89 PolarHBondContact O-N 2.93Å; I87-V90 PolarHBondContact O-N 3.35Å; I87-L91 PolarHBondContact O-N 3.47Å
88	R	96.6	Very high	95.4	Very high	82 Å²	82	64.9 Å²	64.9	31%	0.309	30%	0.303	S	S	.	.	H	α-helix	trans	-60.7	-38.5	176.6	-166.7	-174.4	-58.3	103.1	-8.8	111.7	L60 E64 I84 D85 R86 S92	L60-R88 HydrophobicContact CD1-CB 4.48Å; E64-R88 IonicContact OE1-CZ 2.72Å; E64-R88 IonicContact OE1-NE 3.88Å; E64-R88 IonicContact OE1-NH2 4Å; E64-R88 PolarHBondContact OE1-NH2 3.48Å; I84-R88 VanDerWaalsContact O-CB 3.23Å; I84-R88 WeakPolarHBondContact O-CB 3.35Å; I84-R88 PolarHBondContact O-N 3.48Å; D85-R88 IonicContact OD1-CZ 3.62Å; D85-R88 IonicContact OD1-NH1 3.61Å; D85-R88 PolarHBondContact OD1-NH1 3.4Å; R86-R88 PolarHBondContact O-N 2.73Å; R88-S92 WeakPolarHBondContact O-CB 3.29Å; R88-S92 PolarHBondContact O-N 2.99Å; R88-S92 PolarHBondContact O-OG 3.15Å
89	F	97.8	Very high	95.8	Very high	116 Å²	116	66.2 Å²	66.2	51%	0.509	30%	0.301	S	S	.	.	H	α-helix	trans	-61.2	-48.9	174.9	170	-94	0	0	0	111.7	W36 D85 R86 I87 S92 S93	W36-F89 HydrophobicContact CH2-CE1 4.48Å; W36-F89 HydrophobicContact CZ2-CE1 4.31Å; D85-F89 WeakPolarHBondContact O-CB 3.44Å; D85-F89 PolarHBondContact O-N 2.94Å; R86-F89 WeakPolarHBondContact O-CB 3.29Å; R86-F89 PolarHBondContact O-N 3.36Å; I87-F89 VanDerWaalsContact C-N 3.28Å; I87-F89 PolarHBondContact O-N 2.93Å; F89-S92 PolarHBondContact O-N 2.99Å; F89-S93 VanDerWaalsContact O-CB 3.32Å; F89-S93 WeakPolarHBondContact O-CB 3.49Å; F89-S93 PolarHBondContact O-N 2.75Å
90	V	97.6	Very high	96.1	Very high	14 Å²	14	65.4 Å²	65.4	9%	0.085	30%	0.299	C	S	.	.	H	α-helix	trans	-59.3	-51.7	178.8	175	0	0	0	0	110.2	L32 E33 W36 R86 I87 S92 S93 Y94	L32-V90 HydrophobicContact CD2-CB 4.38Å; L32-V90 HydrophobicContact CD2-CG1 3.93Å; L32-V90 HydrophobicContact CG-CG1 3.91Å; E33-V90 HydrophobicContact CG-CG1 4.33Å; W36-V90 HydrophobicContact CB-CG1 4.01Å; W36-V90 HydrophobicContact CD2-CG1 3.92Å; W36-V90 HydrophobicContact CE3-CG1 3.86Å; W36-V90 HydrophobicContact CE3-CG2 4.39Å; W36-V90 HydrophobicContact CG-CG1 4Å; W36-V90 HydrophobicContact CZ3-CG2 4.36Å; R86-V90 PolarHBondContact O-N 3.06Å; R86-V90 VanDerWaalsContact O-N 3.11Å; I87-V90 PolarHBondContact O-N 3.35Å; V90-S92 PolarHBondContact O-N 2.81Å; V90-S93 PolarHBondContact O-N 2.89Å; V90-S93 VanDerWaalsContact O-N 3.12Å; V90-Y94 PolarHBondContact O-N 2.97Å
91	L	96.9	Very high	96.4	Very high	4 Å²	4	63 Å²	63	2%	0.021	29%	0.287	C	S	.	.	H	α-helix	trans	-57.9	-48.7	178.5	179.4	62.1	0	0	0	111.9	L32 V53 V56 M57 L60 I87 S93 Y94 L95	L32-L91 HydrophobicContact CD1-CD1 3.99Å; L32-L91 HydrophobicContact CD2-CB 4.24Å; V53-L91 HydrophobicContact CB-CD1 4.5Å; V53-L91 HydrophobicContact CG1-CD1 4.19Å; V53-L91 HydrophobicContact CG2-CD1 4.14Å; V56-L91 HydrophobicContact CG1-CD2 4.09Å; M57-L91 HydrophobicContact CG-CD2 3.81Å; M57-L91 HydrophobicContact SD-CD2 3.49Å; M57-L91 WeakPolarHBondContact SD-CD2 3.22Å; L60-L91 HydrophobicContact CD1-CD2 4.17Å; I87-L91 PolarHBondContact O-N 3.47Å; L91-S93 VanDerWaalsContact C-N 3.26Å; L91-S93 PolarHBondContact O-N 2.8Å; L91-Y94 WeakPolarHBondContact O-CB 3.17Å; L91-Y94 PolarHBondContact O-N 3.14Å; L91-L95 HydrophobicContact CD1-CD1 4.21Å; L91-L95 HydrophobicContact CD1-CG 4.3Å; L91-L95 HydrophobicContact CG-CD1 4.2Å; L91-L95 WeakPolarHBondContact O-CG 3.36Å; L91-L95 PolarHBondContact O-N 3.1Å
92	S	97.3	Very high	96.6	Very high	45 Å²	45	54.9 Å²	54.9	32%	0.315	26%	0.257	S	S	.	.	H	α-helix	trans	-64.4	-33.2	178.9	-58.4	0	0	0	0	112	R88 F89 V90 R96	R88-S92 WeakPolarHBondContact O-CB 3.29Å; R88-S92 PolarHBondContact O-N 2.99Å; R88-S92 PolarHBondContact O-OG 3.15Å; F89-S92 PolarHBondContact O-N 2.99Å; V90-S92 PolarHBondContact O-N 2.81Å; S92-R96 VanDerWaalsContact O-CB 3.28Å; S92-R96 WeakPolarHBondContact O-CB 3.25Å; S92-R96 VanDerWaalsContact O-CG 3.23Å; S92-R96 WeakPolarHBondContact O-CG 3.49Å; S92-R96 PolarHBondContact O-N 2.83Å; S92-R96 VanDerWaalsContact O-N 3.11Å; S92-R96 PolarHBondContact O-NE 2.73Å
93	S	97.7	Very high	96.8	Very high	20 Å²	20	52.9 Å²	52.9	14%	0.14	25%	0.246	C	C	.	.	H	α-helix	trans	-71.6	-38.7	176.1	-170.7	0	0	0	0	111.7	W36 F89 V90 L91 S97	W36-S93 VanDerWaalsContact NE1-CB 3.33Å; W36-S93 PolarHBondContact NE1-OG 3.39Å; F89-S93 VanDerWaalsContact O-CB 3.32Å; F89-S93 WeakPolarHBondContact O-CB 3.49Å; F89-S93 PolarHBondContact O-N 2.75Å; V90-S93 PolarHBondContact O-N 2.89Å; V90-S93 VanDerWaalsContact O-N 3.12Å; L91-S93 VanDerWaalsContact C-N 3.26Å; L91-S93 PolarHBondContact O-N 2.8Å; S93-S97 WeakPolarHBondContact O-CB 3.41Å; S93-S97 PolarHBondContact O-N 3.36Å; S93-S97 PolarHBondContact O-OG 3.48Å
94	Y	97.7	Very high	96.9	Very high	3 Å²	3	55.4 Å²	55.4	1%	0.012	26%	0.256	C	S	.	.	H	α-helix	trans	-61.1	-55.5	174.4	168.7	-110	0	0	0	111	L32 A35 E39 V53 V90 L91 R96 S97 R98	L32-Y94 HydrophobicContact CD1-CD1 4.5Å; A35-Y94 HydrophobicContact CB-CE2 4.08Å; E39-Y94 HydrophobicContact CB-CD2 3.9Å; E39-Y94 HydrophobicContact CB-CE2 3.91Å; E39-Y94 HydrophobicContact CG-CD2 4.14Å; E39-Y94 HydrophobicContact CG-CE2 4.07Å; V53-Y94 HydrophobicContact CG2-CD1 4.18Å; V53-Y94 HydrophobicContact CG2-CE1 3.68Å; V90-Y94 PolarHBondContact O-N 2.97Å; L91-Y94 WeakPolarHBondContact O-CB 3.17Å; L91-Y94 PolarHBondContact O-N 3.14Å; Y94-R96 VanDerWaalsContact C-N 3.33Å; Y94-R96 PolarHBondContact O-N 2.98Å; Y94-S97 WeakPolarHBondContact O-CB 3.47Å; Y94-S97 PolarHBondContact O-N 2.68Å; Y94-R98 HydrophobicContact CD2-CG 4.47Å; Y94-R98 HydrophobicContact CE2-CG 4.17Å; Y94-R98 PolarHBondContact O-N 2.81Å; Y94-R98 WeakPolarHBondContact OH-CD 3.18Å
95	L	97.1	Very high	97	Very high	61 Å²	61	56.1 Å²	56.1	32%	0.319	26%	0.258	S	S	.	.	H	α-helix	trans	-59.8	-41	-180	-64.5	175.7	0	0	0	112.3	V53 L91 S97 R98 L99	V53-L95 HydrophobicContact CG1-CD2 4.42Å; V53-L95 HydrophobicContact CG2-CD2 4.34Å; L91-L95 HydrophobicContact CD1-CD1 4.21Å; L91-L95 HydrophobicContact CD1-CG 4.3Å; L91-L95 HydrophobicContact CG-CD1 4.2Å; L91-L95 WeakPolarHBondContact O-CG 3.36Å; L91-L95 PolarHBondContact O-N 3.1Å; L95-S97 PolarHBondContact O-N 3.02Å; L95-R98 PolarHBondContact O-N 3.05Å; L95-L99 WeakPolarHBondContact O-CG 3.33Å; L95-L99 PolarHBondContact O-N 3.12Å
96	R	97.8	Very high	96.9	Very high	136 Å²	136	52.8 Å²	52.8	51%	0.513	24%	0.24	S	C	.	.	H	α-helix	trans	-63.8	-38.9	174.7	-78.8	-179.6	-70.4	165.6	-2	112.9	S92 Y94 R98 L99 Q100	S92-R96 VanDerWaalsContact O-CB 3.28Å; S92-R96 WeakPolarHBondContact O-CB 3.25Å; S92-R96 VanDerWaalsContact O-CG 3.23Å; S92-R96 WeakPolarHBondContact O-CG 3.49Å; S92-R96 PolarHBondContact O-N 2.83Å; S92-R96 VanDerWaalsContact O-N 3.11Å; S92-R96 PolarHBondContact O-NE 2.73Å; Y94-R96 VanDerWaalsContact C-N 3.33Å; Y94-R96 PolarHBondContact O-N 2.98Å; R96-R98 VanDerWaalsContact C-N 3.33Å; R96-L99 PolarHBondContact O-N 3.17Å; R96-Q100 WeakPolarHBondContact O-CB 3.33Å; R96-Q100 VanDerWaalsContact O-CG 3.28Å; R96-Q100 WeakPolarHBondContact O-CG 3.48Å; R96-Q100 PolarHBondContact O-N 3.4Å
97	S	97	Very high	96.9	Very high	17 Å²	17	46.1 Å²	46.1	12%	0.119	22%	0.216	C	C	.	.	H	α-helix	trans	-65.3	-40.3	178.7	-55.7	0	0	0	0	110.8	S93 Y94 L95 Q100 K101	S93-S97 WeakPolarHBondContact O-CB 3.41Å; S93-S97 PolarHBondContact O-N 3.36Å; S93-S97 PolarHBondContact O-OG 3.48Å; Y94-S97 WeakPolarHBondContact O-CB 3.47Å; Y94-S97 PolarHBondContact O-N 2.68Å; L95-S97 PolarHBondContact O-N 3.02Å; S97-Q100 PolarHBondContact O-N 3.41Å; S97-K101 PolarHBondContact O-N 2.72Å
98	R	97.4	Very high	96.8	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-61.9	-51.4	173.8	-68.2	-174.7	56.5	81.5	-0.7	112.3	E39 L45 L46 Y94 L95 R96 Q100 K101 I102 L123 E128	E39-R98 HydrophobicContact CG-CG 3.6Å; E39-R98 IonicContact OE2-CZ 2.83Å; E39-R98 IonicContact OE2-NH1 3.64Å; E39-R98 PolarHBondContact OE2-NH1 3.08Å; L45-R98 HydrophobicContact CD1-CB 4.08Å; L45-R98 HydrophobicContact CD1-CG 4.14Å; L46-R98 PolarHBondContact O-NH1 3.11Å; Y94-R98 HydrophobicContact CD2-CG 4.47Å; Y94-R98 HydrophobicContact CE2-CG 4.17Å; Y94-R98 PolarHBondContact O-N 2.81Å; Y94-R98 WeakPolarHBondContact OH-CD 3.18Å; L95-R98 PolarHBondContact O-N 3.05Å; R96-R98 VanDerWaalsContact C-N 3.33Å; R98-Q100 VanDerWaalsContact C-N 3.29Å; R98-Q100 PolarHBondContact O-N 2.88Å; R98-K101 PolarHBondContact O-N 2.88Å; R98-I102 WeakPolarHBondContact O-CG1 3.38Å; R98-I102 PolarHBondContact O-N 3.2Å; R98-L123 PolarHBondContact NH2-O 3.43Å; R98-E128 IonicContact CZ-OE1 3.85Å; R98-E128 IonicContact CZ-OE2 3.91Å; R98-E128 IonicContact NE-OE1 3Å; R98-E128 PolarHBondContact NE-OE1 2.98Å; R98-E128 IonicContact NE-OE2 2.8Å; R98-E128 IonicContact NH2-OE1 3.59Å; R98-E128 PolarHBondContact NH2-OE1 2.84Å; R98-E128 IonicContact NH2-OE2 2.73Å; R98-E128 PolarHBondContact NH2-OE2 3.34Å
99	L	97.2	Very high	96.8	Very high	64 Å²	64	43 Å²	43	34%	0.335	21%	0.205	S	C	.	.	H	α-helix	trans	-57	-42.3	177.6	-73.1	177.2	0	0	0	112.3	L95 R96 K101 I102 E103 F131	L95-L99 WeakPolarHBondContact O-CG 3.33Å; L95-L99 PolarHBondContact O-N 3.12Å; R96-L99 PolarHBondContact O-N 3.17Å; L99-K101 VanDerWaalsContact C-N 3.31Å; L99-K101 PolarHBondContact O-N 2.61Å; L99-I102 HydrophobicContact CD2-CD1 4.47Å; L99-I102 PolarHBondContact O-N 3.11Å; L99-E103 WeakPolarHBondContact O-CG 3.28Å; L99-E103 PolarHBondContact O-N 3.18Å; L99-F131 HydrophobicContact CD2-CD1 3.89Å; L99-F131 HydrophobicContact CD2-CE1 3.94Å; L99-F131 HydrophobicContact CD2-CG 4.45Å
100	Q	97.3	Very high	96.6	Very high	129 Å²	129	38.2 Å²	38.2	60%	0.603	18%	0.184	S	C	*	.	H	α-helix	trans	-59.8	-40.2	175.9	-76.4	175.2	-6.5	0	0	112.6	R96 S97 R98 K104	R96-Q100 WeakPolarHBondContact O-CB 3.33Å; R96-Q100 VanDerWaalsContact O-CG 3.28Å; R96-Q100 WeakPolarHBondContact O-CG 3.48Å; R96-Q100 PolarHBondContact O-N 3.4Å; S97-Q100 PolarHBondContact O-N 3.41Å; R98-Q100 VanDerWaalsContact C-N 3.29Å; R98-Q100 PolarHBondContact O-N 2.88Å; Q100-K104 VanDerWaalsContact O-CB 3.26Å; Q100-K104 WeakPolarHBondContact O-CB 3.19Å; Q100-K104 PolarHBondContact O-N 3.35Å
101	K	97	Very high	96.3	Very high	23 Å²	23	41.7 Å²	41.7	10%	0.1	20%	0.199	C	C	.	.	H	α-helix	trans	-71.3	-39	176.4	-71.5	-179.1	-178.5	180	0	112.4	E39 S42 E44 L45 S97 R98 L99 K104 Y105	E39-K101 WeakPolarHBondContact O-CE 3.32Å; E39-K101 PolarHBondContact O-NZ 3.09Å; E39-K101 WeakPolarHBondContact OE1-CD 3.42Å; E39-K101 IonicContact OE1-NZ 3.12Å; E39-K101 PolarHBondContact OE1-NZ 3.36Å; S42-K101 VanDerWaalsContact O-CE 3.22Å; S42-K101 WeakPolarHBondContact O-CE 3.11Å; S42-K101 PolarHBondContact O-NZ 3.39Å; S42-K101 PolarHBondContact OG-NZ 2.81Å; E44-K101 PolarHBondContact O-NZ 3.24Å; L45-K101 HydrophobicContact CD1-CB 4.2Å; L45-K101 HydrophobicContact CD1-CD 4.44Å; S97-K101 PolarHBondContact O-N 2.72Å; R98-K101 PolarHBondContact O-N 2.88Å; L99-K101 VanDerWaalsContact C-N 3.31Å; L99-K101 PolarHBondContact O-N 2.61Å; K101-K104 PolarHBondContact O-N 3.35Å; K101-Y105 HydrophobicContact CB-CD2 4.31Å; K101-Y105 WeakPolarHBondContact O-CB 3.23Å; K101-Y105 VanDerWaalsContact O-CD2 3.27Å; K101-Y105 WeakPolarHBondContact O-CD2 3.14Å; K101-Y105 PolarHBondContact O-N 3.49Å
102	I	96.8	Very high	96	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-59.6	-50.6	174.1	-67.5	164.2	0	0	0	109.4	L45 R98 L99 K104 Y105 F106 L124 E128 F131 A132	L45-I102 HydrophobicContact CD1-CG1 4.28Å; L45-I102 HydrophobicContact CD2-CD1 4.3Å; L45-I102 HydrophobicContact CD2-CG1 3.68Å; R98-I102 WeakPolarHBondContact O-CG1 3.38Å; R98-I102 PolarHBondContact O-N 3.2Å; L99-I102 HydrophobicContact CD2-CD1 4.47Å; L99-I102 PolarHBondContact O-N 3.11Å; I102-K104 VanDerWaalsContact C-N 3.29Å; I102-K104 PolarHBondContact O-N 2.74Å; I102-Y105 CarbonylContact O-C 3.58Å; I102-Y105 PolarHBondContact O-N 2.76Å; I102-F106 WeakPolarHBondContact O-CA 3.33Å; I102-F106 WeakPolarHBondContact O-CB 3.18Å; I102-F106 PolarHBondContact O-N 3.04Å; I102-L124 HydrophobicContact CD1-CD2 3.72Å; I102-L124 HydrophobicContact CG1-CD2 3.95Å; I102-E128 HydrophobicContact CD1-CB 3.89Å; I102-E128 HydrophobicContact CD1-CG 3.89Å; I102-F131 HydrophobicContact CG2-CD1 4.1Å; I102-F131 HydrophobicContact CG2-CE1 4.23Å; I102-A132 HydrophobicContact CG2-CB 3.81Å
103	E	96.4	Very high	95.7	Very high	83 Å²	83	45 Å²	45	39%	0.388	21%	0.206	S	C	.	.	H	α-helix	trans	-61.1	-36.9	177.5	-72.8	179.3	-170.8	0	0	112.7	L99 F106 F131 Y135	L99-E103 WeakPolarHBondContact O-CG 3.28Å; L99-E103 PolarHBondContact O-N 3.18Å; E103-F106 WeakPolarHBondContact O-CD1 3.23Å; E103-F131 HydrophobicContact CG-CE1 3.91Å; E103-F131 HydrophobicContact CG-CZ 3.93Å; E103-Y135 HydrophobicContact CG-CD2 4.47Å; E103-Y135 HydrophobicContact CG-CE2 4.16Å
104	K	96.1	Very high	95.2	Very high	123 Å²	123	50.8 Å²	50.8	54%	0.535	23%	0.229	S	C	.	.	H	α-helix	trans	-72.9	-35.8	-179.2	-170.6	178.7	177.1	-163.3	0	113	Q100 K101 I102 V164	Q100-K104 VanDerWaalsContact O-CB 3.26Å; Q100-K104 WeakPolarHBondContact O-CB 3.19Å; Q100-K104 PolarHBondContact O-N 3.35Å; K101-K104 PolarHBondContact O-N 3.35Å; I102-K104 VanDerWaalsContact C-N 3.29Å; I102-K104 PolarHBondContact O-N 2.74Å; K104-V164 VanDerWaalsContact O-CG1 3.24Å; K104-V164 WeakPolarHBondContact O-CG1 3.37Å
105	Y	96.2	Very high	94.7	Very high	17 Å²	17	54.6 Å²	54.6	7%	0.067	26%	0.256	C	S	.	.	H	α-helix	trans	-122.2	25	-170.7	-51	-60.3	0	0	0	112.9	P43 K101 I102 P107 H108 V109 P165 P167	P43-Y105 WeakPolarHBondContact O-CE2 3.29Å; P43-Y105 PolarHBondContact O-OH 2.99Å; K101-Y105 HydrophobicContact CB-CD2 4.31Å; K101-Y105 WeakPolarHBondContact O-CB 3.23Å; K101-Y105 VanDerWaalsContact O-CD2 3.27Å; K101-Y105 WeakPolarHBondContact O-CD2 3.14Å; K101-Y105 PolarHBondContact O-N 3.49Å; I102-Y105 CarbonylContact O-C 3.58Å; I102-Y105 PolarHBondContact O-N 2.76Å; Y105-P107 VanDerWaalsContact C-CD 3.42Å; Y105-H108 WeakPolarHBondContact O-CB 3.37Å; Y105-H108 PolarHBondContact O-N 2.63Å; Y105-V109 WeakPolarHBondContact O-CG2 3.41Å; Y105-V109 PolarHBondContact O-N 3.43Å; Y105-P165 VanDerWaalsContact CD1-O 3.31Å; Y105-P165 WeakPolarHBondContact CD1-O 3.47Å; Y105-P167 HydrophobicContact CD1-CG 3.96Å; Y105-P167 HydrophobicContact CD2-CG 3.91Å; Y105-P167 HydrophobicContact CE1-CB 4.49Å; Y105-P167 HydrophobicContact CE1-CG 4.21Å; Y105-P167 HydrophobicContact CE2-CB 4.35Å; Y105-P167 HydrophobicContact CE2-CG 4.14Å; Y105-P167 HydrophobicContact CG-CG 3.8Å
106	F	95.1	Very high	94.1	Very high	11 Å²	11	53.7 Å²	53.7	5%	0.048	25%	0.252	C	S	.	.	H	α-helix	trans	-51.7	-41	-167.6	67.1	-81.7	0	0	0	115.9	I102 E103 L110 Y135 Y136 T139 V164	I102-F106 WeakPolarHBondContact O-CA 3.33Å; I102-F106 WeakPolarHBondContact O-CB 3.18Å; I102-F106 PolarHBondContact O-N 3.04Å; E103-F106 WeakPolarHBondContact O-CD1 3.23Å; F106-L110 WeakPolarHBondContact O-CB 3.49Å; F106-L110 WeakPolarHBondContact O-CG 3.43Å; F106-L110 PolarHBondContact O-N 3.22Å; F106-L110 VanDerWaalsContact O-N 3.14Å; F106-Y135 HydrophobicContact CB-CD1 4.02Å; F106-Y135 HydrophobicContact CB-CE1 4.44Å; F106-Y135 AromaticContact CD1-CD1 3.87Å; F106-Y135 HydrophobicContact CD1-CD1 3.87Å; F106-Y135 AromaticContact CD1-CE1 3.52Å; F106-Y135 HydrophobicContact CD1-CE1 3.52Å; F106-Y135 HydrophobicContact CD2-CD1 4.06Å; F106-Y135 HydrophobicContact CD2-CE1 4.44Å; F106-Y135 HydrophobicContact CE1-CD1 4.4Å; F106-Y135 AromaticContact CE1-CE1 3.84Å; F106-Y135 HydrophobicContact CE1-CE1 3.84Å; F106-Y135 AromaticContact CG-CD1 3.7Å; F106-Y135 HydrophobicContact CG-CD1 3.7Å; F106-Y135 AromaticContact CG-CE1 3.88Å; F106-Y135 HydrophobicContact CG-CE1 3.88Å; F106-Y135 HydrophobicContact CZ-CE1 4.44Å; F106-Y136 AromaticContact CD2-CD2 3.64Å; F106-Y136 HydrophobicContact CD2-CD2 3.64Å; F106-Y136 HydrophobicContact CD2-CG 4.24Å; F106-Y136 AromaticContact CE2-CD2 3.6Å; F106-Y136 HydrophobicContact CE2-CD2 3.6Å; F106-Y136 HydrophobicContact CE2-CE2 4.21Å; F106-Y136 HydrophobicContact CE2-CG 4.21Å; F106-T139 HydrophobicContact CZ-CG2 4.28Å; F106-V164 HydrophobicContact CE1-CG1 4.44Å; F106-V164 HydrophobicContact CE1-CG2 3.64Å; F106-V164 HydrophobicContact CZ-CG2 3.78Å
107	P	95.4	Very high	93.2	Very high	5 Å²	5	52.2 Å²	52.2	3%	0.032	26%	0.257	C	S	.	.	H	α-helix	trans	-69.4	-40.9	179.6	-15.6	33.1	0	0	0	111.1	Y105 L110 E111 Y136 M160 L161 V164	Y105-P107 VanDerWaalsContact C-CD 3.42Å; P107-L110 PolarHBondContact O-N 2.89Å; P107-E111 WeakPolarHBondContact O-CB 3.49Å; P107-E111 PolarHBondContact O-N 2.96Å; P107-Y136 HydrophobicContact CB-CE2 4.32Å; P107-M160 HydrophobicContact CB-CB 4.14Å; P107-M160 HydrophobicContact CG-CB 3.83Å; P107-L161 HydrophobicContact CB-CD2 3.84Å; P107-L161 HydrophobicContact CB-CG 4.29Å; P107-V164 HydrophobicContact CG-CB 3.9Å; P107-V164 HydrophobicContact CG-CG1 4.31Å; P107-V164 HydrophobicContact CG-CG2 3.68Å
108	H	95.4	Very high	91.9	Very high	26 Å²	26	61 Å²	61	12%	0.12	30%	0.296	C	S	.	.	H	α-helix	trans	-67.8	-40.7	-178.8	-60.8	-59.1	0	0	0	111.8	Y105 E111 R112 L161 V164 P165 E166	Y105-H108 WeakPolarHBondContact O-CB 3.37Å; Y105-H108 PolarHBondContact O-N 2.63Å; H108-E111 PolarHBondContact O-N 3.34Å; H108-R112 VanDerWaalsContact O-CB 3.27Å; H108-R112 WeakPolarHBondContact O-CB 3.26Å; H108-R112 PolarHBondContact O-N 2.93Å; H108-L161 PolarHBondContact CE1-O 2.99Å; H108-L161 PolarHBondContact NE2-O 3.46Å; H108-V164 PolarHBondContact NE2-O 3.06Å; H108-P165 PolarHBondContact CD2-O 3.24Å; H108-E166 WeakPolarHBondContact CE1-CG 3.42Å; H108-E166 IonicContact CE1-OE1 2.61Å; H108-E166 WeakPolarHBondContact NE2-CG 3.33Å
109	V	94.6	Very high	90.5	Very high	7 Å²	7	65.1 Å²	65.1	4%	0.042	34%	0.339	C	S	.	.	H	α-helix	trans	-63.6	-46.6	175.9	168.5	0	0	0	0	110.8	L45 Y105 E111 R112 E113 L124	L45-V109 HydrophobicContact CB-CG2 4.45Å; L45-V109 HydrophobicContact CD2-CG1 3.87Å; L45-V109 HydrophobicContact CD2-CG2 4.2Å; Y105-V109 WeakPolarHBondContact O-CG2 3.41Å; Y105-V109 PolarHBondContact O-N 3.43Å; V109-E111 VanDerWaalsContact C-N 3.35Å; V109-E111 PolarHBondContact O-N 3.33Å; V109-R112 PolarHBondContact O-N 2.91Å; V109-E113 WeakPolarHBondContact O-CB 3.42Å; V109-E113 PolarHBondContact O-N 3.43Å; V109-L124 HydrophobicContact CG1-CD1 3.82Å; V109-L124 HydrophobicContact CG1-CD2 3.76Å; V109-L124 HydrophobicContact CG1-CG 4.09Å
110	L	94	Very high	89.4	Confident	14 Å²	14	67.3 Å²	67.3	7%	0.073	35%	0.347	C	S	.	.	H	α-helix	trans	-65.2	-37	177.4	-74	173.6	0	0	0	112.7	F106 P107 K114 F129 A132 K133 Y136	F106-L110 WeakPolarHBondContact O-CB 3.49Å; F106-L110 WeakPolarHBondContact O-CG 3.43Å; F106-L110 PolarHBondContact O-N 3.22Å; F106-L110 VanDerWaalsContact O-N 3.14Å; P107-L110 PolarHBondContact O-N 2.89Å; L110-K114 WeakPolarHBondContact O-CG 3.45Å; L110-K114 PolarHBondContact O-N 3.06Å; L110-F129 HydrophobicContact CD2-CD2 3.91Å; L110-F129 HydrophobicContact CD2-CE2 3.89Å; L110-A132 HydrophobicContact CD1-CB 4.46Å; L110-A132 HydrophobicContact CD2-CB 3.81Å; L110-A132 HydrophobicContact CG-CB 4.12Å; L110-K133 HydrophobicContact CD2-CG 4.1Å; L110-Y136 HydrophobicContact CD1-CD2 4.11Å; L110-Y136 HydrophobicContact CD1-CG 4.32Å
111	E	92.7	Very high	88.5	Confident	87 Å²	87	64.7 Å²	64.7	41%	0.407	34%	0.342	S	S	.	.	H	α-helix	trans	-71	-42	178.7	-166	58.9	-160.2	0	0	111.6	P107 H108 V109 E113 K114 S115 L161	P107-E111 WeakPolarHBondContact O-CB 3.49Å; P107-E111 PolarHBondContact O-N 2.96Å; H108-E111 PolarHBondContact O-N 3.34Å; V109-E111 VanDerWaalsContact C-N 3.35Å; V109-E111 PolarHBondContact O-N 3.33Å; E111-E113 PolarHBondContact O-N 2.91Å; E111-K114 PolarHBondContact O-N 3.46Å; E111-K114 IonicContact OE2-NZ 2.68Å; E111-K114 PolarHBondContact OE2-NZ 3.1Å; E111-S115 PolarHBondContact O-N 3.19Å; E111-S115 PolarHBondContact O-OG 3.37Å; E111-L161 HydrophobicContact CB-CD2 4.15Å
112	R	90.8	Very high	88	Confident	82 Å²	82	66 Å²	66	31%	0.309	35%	0.354	S	S	.	.	H	α-helix	trans	-58.7	-47.8	173.5	179	170.9	154.4	179.4	-4.4	111.6	E44 H108 V109 K114 S115 L116 L123	E44-R112 IonicContact OE2-CZ 3.49Å; E44-R112 IonicContact OE2-NH1 2.77Å; E44-R112 PolarHBondContact OE2-NH1 2.95Å; E44-R112 IonicContact OE2-NH2 3.56Å; H108-R112 VanDerWaalsContact O-CB 3.27Å; H108-R112 WeakPolarHBondContact O-CB 3.26Å; H108-R112 PolarHBondContact O-N 2.93Å; V109-R112 PolarHBondContact O-N 2.91Å; R112-K114 VanDerWaalsContact C-N 3.29Å; R112-K114 PolarHBondContact O-N 3.03Å; R112-S115 WeakPolarHBondContact CA-OG 3.3Å; R112-S115 PolarHBondContact O-N 2.68Å; R112-S115 PolarHBondContact O-OG 2.82Å; R112-L116 WeakPolarHBondContact O-CG 3.42Å; R112-L116 PolarHBondContact O-N 2.94Å; R112-L123 HydrophobicContact CG-CD2 4.42Å; R112-L123 VanDerWaalsContact CZ-CD2 3.46Å; R112-L123 VanDerWaalsContact NE-CD2 3.31Å
113	E	89.6	Confident	87.6	Confident	36 Å²	36	66.2 Å²	66.2	17%	0.168	36%	0.355	C	S	.	.	H	α-helix	trans	-57.7	-39.8	178.1	-173	66	-156.9	0	0	112.2	V109 E111 S115 L116 S122 L123 L124 F129	V109-E113 WeakPolarHBondContact O-CB 3.42Å; V109-E113 PolarHBondContact O-N 3.43Å; E111-E113 PolarHBondContact O-N 2.91Å; E113-S115 VanDerWaalsContact C-N 3.34Å; E113-L116 PolarHBondContact O-N 3.33Å; E113-L116 WeakPolarHBondContact OE2-CD1 3.47Å; E113-S122 PolarHBondContact OE1-OG 2.98Å; E113-L123 WeakPolarHBondContact OE2-CB 3.43Å; E113-L123 PolarHBondContact OE2-N 3.47Å; E113-L124 HydrophobicContact CB-CD1 4.32Å; E113-L124 HydrophobicContact CG-CD1 4.25Å; E113-F129 HydrophobicContact CG-CD2 4.24Å; E113-F129 HydrophobicContact CG-CE2 4.11Å
114	K	88.6	Confident	87.4	Confident	142 Å²	142	62.6 Å²	62.6	62%	0.617	34%	0.338	S	S	*	.	H	α-helix	trans	-69.3	-31.7	176	-67.9	171.7	-156.7	158.3	0	113.4	L110 E111 R112 L116	L110-K114 WeakPolarHBondContact O-CG 3.45Å; L110-K114 PolarHBondContact O-N 3.06Å; E111-K114 PolarHBondContact O-N 3.46Å; E111-K114 IonicContact OE2-NZ 2.68Å; E111-K114 PolarHBondContact OE2-NZ 3.1Å; R112-K114 VanDerWaalsContact C-N 3.29Å; R112-K114 PolarHBondContact O-N 3.03Å; K114-L116 VanDerWaalsContact C-N 3.26Å
115	S	86.8	Confident	87.2	Confident	83 Å²	83	57.3 Å²	57.3	58%	0.58	32%	0.317	S	S	*	.	H	α-helix	trans	-80.3	-7.6	-178.2	71.2	0	0	0	0	113.5	E111 R112 E113 V117	E111-S115 PolarHBondContact O-N 3.19Å; E111-S115 PolarHBondContact O-OG 3.37Å; R112-S115 WeakPolarHBondContact CA-OG 3.3Å; R112-S115 PolarHBondContact O-N 2.68Å; R112-S115 PolarHBondContact O-OG 2.82Å; E113-S115 VanDerWaalsContact C-N 3.34Å; S115-V117 PolarHBondContact O-N 3Å
116	L	83.2	Confident	87	Confident	43 Å²	43	61.1 Å²	61.1	23%	0.225	34%	0.343	C	S	.	.	P	Polyproline II helix	trans	-62.6	134.6	176.9	-66	176.8	0	0	0	110.4	R112 E113 K114 Q120	R112-L116 WeakPolarHBondContact O-CG 3.42Å; R112-L116 PolarHBondContact O-N 2.94Å; E113-L116 PolarHBondContact O-N 3.33Å; E113-L116 WeakPolarHBondContact OE2-CD1 3.47Å; K114-L116 VanDerWaalsContact C-N 3.26Å; L116-Q120 HydrophobicContact CD2-CB 4.44Å
117	V	79.7	Confident	87	Confident	104 Å²	104	66.9 Å²	66.9	63%	0.63	37%	0.371	S	S	*	.	P	Polyproline II helix	trans	-76.1	143.4	174.4	-177.6	0	0	0	0	108.9	S115 G119 Q120	S115-V117 PolarHBondContact O-N 3Å; V117-G119 PolarHBondContact O-N 3.4Å; V117-G119 VanDerWaalsContact O-N 3.08Å; V117-Q120 PolarHBondContact O-N 2.89Å
118	E	69.2	Low	87	Confident	202 Å²	202	67.3 Å²	67.3	94%	0.944	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.6	117.2	173.2	-73	-177.8	173	0	0	110.4
119	G	68.4	Low	87	Confident	86 Å²	86	69.1 Å²	69.1	89%	0.887	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	109.1	-7.6	-178.9	0	0	0	0	0	115.7	V117	V117-G119 PolarHBondContact O-N 3.4Å; V117-G119 VanDerWaalsContact O-N 3.08Å
120	Q	73.7	Confident	87	Confident	111 Å²	111	71.5 Å²	71.5	52%	0.519	40%	0.4	S	S	.	.	S	Bend	trans	-79.7	147.3	169	-71.7	-170.8	-19.9	0	0	111.7	L116 V117 S122	L116-Q120 HydrophobicContact CD2-CB 4.44Å; V117-Q120 PolarHBondContact O-N 2.89Å; Q120-S122 PolarHBondContact O-N 3.45Å
121	P	77.9	Confident	87.2	Confident	74 Å²	74	74 Å²	74	48%	0.481	41%	0.41	S	S	.	.	P	Polyproline II helix	trans	-61.5	130.7	176	25	-32.7	0	0	0	110.1	E47	E47-P121 HydrophobicContact CG-CB 4.45Å; E47-P121 HydrophobicContact CG-CG 4.12Å
122	S	86.6	Confident	87.3	Confident	51 Å²	51	69.8 Å²	69.8	36%	0.357	39%	0.391	S	S	.	.	P	Polyproline II helix	trans	-64.9	142.5	178.9	178.2	0	0	0	0	110.7	N48 E113 Q120 L124	N48-S122 PolarHBondContact N-O 3.34Å; E113-S122 PolarHBondContact OE1-OG 2.98Å; Q120-S122 PolarHBondContact O-N 3.45Å; S122-L124 VanDerWaalsContact C-N 3.34Å; S122-L124 PolarHBondContact OG-N 3.47Å; S122-L124 PolarHBondContact OG-O 3.18Å
123	L	88.3	Confident	87.6	Confident	4 Å²	4	71.1 Å²	71.1	2%	0.021	40%	0.398	C	S	.	.	S	Bend	trans	-79.8	-23.6	-179.9	-139	76.8	0	0	0	112.4	L45 E47 R98 R112 E113	L45-L123 HydrophobicContact CB-CD2 4.34Å; L45-L123 HydrophobicContact CD2-CD2 4.2Å; L45-L123 HydrophobicContact CG-CD2 4.42Å; E47-L123 HydrophobicContact CG-CD1 4.39Å; R98-L123 PolarHBondContact NH2-O 3.43Å; R112-L123 HydrophobicContact CG-CD2 4.42Å; R112-L123 VanDerWaalsContact CZ-CD2 3.46Å; R112-L123 VanDerWaalsContact NE-CD2 3.31Å; E113-L123 WeakPolarHBondContact OE2-CB 3.43Å; E113-L123 PolarHBondContact OE2-N 3.47Å
124	L	92.5	Very high	88	Confident	6 Å²	6	76.1 Å²	76.1	3%	0.031	42%	0.422	C	S	.	.	S	Bend	trans	-123.2	146.8	-171	-64	169.2	0	0	0	110.9	L45 I102 V109 E113 S122 E128 F129	L45-L124 HydrophobicContact CD2-CD2 3.61Å; I102-L124 HydrophobicContact CD1-CD2 3.72Å; I102-L124 HydrophobicContact CG1-CD2 3.95Å; V109-L124 HydrophobicContact CG1-CD1 3.82Å; V109-L124 HydrophobicContact CG1-CD2 3.76Å; V109-L124 HydrophobicContact CG1-CG 4.09Å; E113-L124 HydrophobicContact CB-CD1 4.32Å; E113-L124 HydrophobicContact CG-CD1 4.25Å; S122-L124 VanDerWaalsContact C-N 3.34Å; S122-L124 PolarHBondContact OG-N 3.47Å; S122-L124 PolarHBondContact OG-O 3.18Å; L124-E128 WeakPolarHBondContact CA-OE2 3.36Å; L124-E128 HydrophobicContact CB-CB 4.17Å; L124-E128 HydrophobicContact CD2-CB 3.96Å; L124-F129 HydrophobicContact CB-CB 4.2Å; L124-F129 HydrophobicContact CD1-CB 4.19Å; L124-F129 HydrophobicContact CD1-CD2 3.85Å
125	S	93.3	Very high	88.4	Confident	13 Å²	13	72.8 Å²	72.8	9%	0.091	41%	0.406	C	S	.	.			trans	-69.5	159.2	161.6	94.7	0	0	0	0	110.4	N48 E127 E128 F129	N48-S125 WeakPolarHBondContact ND2-CA 3.5Å; N48-S125 WeakPolarHBondContact ND2-CB 3.16Å; N48-S125 PolarHBondContact ND2-N 3.4Å; S125-E127 VanDerWaalsContact CB-OE2 3.26Å; S125-E127 WeakPolarHBondContact CB-OE2 3.39Å; S125-E127 PolarHBondContact O-N 3.19Å; S125-E127 PolarHBondContact OG-N 3.17Å; S125-E127 PolarHBondContact OG-OE2 3.29Å; S125-E128 PolarHBondContact N-OE2 2.92Å; S125-E128 PolarHBondContact O-N 3.32Å; S125-E128 VanDerWaalsContact O-N 3.15Å; S125-E128 WeakPolarHBondContact OG-CG 3.44Å; S125-E128 PolarHBondContact OG-N 3.24Å; S125-F129 WeakPolarHBondContact O-CB 3.28Å; S125-F129 PolarHBondContact O-N 3.09Å
126	P	92.1	Very high	88.8	Confident	96 Å²	96	72.5 Å²	72.5	62%	0.623	39%	0.393	S	S	*	.	H	α-helix	trans	-53.9	-37.8	172.9	-26.1	35.2	0	0	0	112.8	A130	P126-A130 WeakPolarHBondContact O-CB 3.28Å; P126-A130 PolarHBondContact O-N 3.05Å
127	E	93.9	Very high	89.4	Confident	133 Å²	133	72.8 Å²	72.8	62%	0.621	40%	0.401	S	S	*	.	H	α-helix	trans	-69.9	-44.1	177.1	-54	74	-159.8	0	0	111.5	S125 F129 A130 F131	S125-E127 VanDerWaalsContact CB-OE2 3.26Å; S125-E127 WeakPolarHBondContact CB-OE2 3.39Å; S125-E127 PolarHBondContact O-N 3.19Å; S125-E127 PolarHBondContact OG-N 3.17Å; S125-E127 PolarHBondContact OG-OE2 3.29Å; E127-F129 VanDerWaalsContact C-N 3.31Å; E127-F129 PolarHBondContact O-N 3.38Å; E127-A130 PolarHBondContact O-N 3.17Å; E127-F131 WeakPolarHBondContact O-CB 3.5Å; E127-F131 PolarHBondContact O-N 3.46Å
128	E	95.4	Very high	90.2	Very high	14 Å²	14	72.8 Å²	72.8	7%	0.065	40%	0.398	C	S	.	.	H	α-helix	trans	-63	-38.6	175.9	-72.7	179.7	148.6	0	0	111.6	R98 I102 L124 S125 F131 A132	R98-E128 IonicContact CZ-OE1 3.85Å; R98-E128 IonicContact CZ-OE2 3.91Å; R98-E128 IonicContact NE-OE1 3Å; R98-E128 PolarHBondContact NE-OE1 2.98Å; R98-E128 IonicContact NE-OE2 2.8Å; R98-E128 IonicContact NH2-OE1 3.59Å; R98-E128 PolarHBondContact NH2-OE1 2.84Å; R98-E128 IonicContact NH2-OE2 2.73Å; R98-E128 PolarHBondContact NH2-OE2 3.34Å; I102-E128 HydrophobicContact CD1-CB 3.89Å; I102-E128 HydrophobicContact CD1-CG 3.89Å; L124-E128 WeakPolarHBondContact CA-OE2 3.36Å; L124-E128 HydrophobicContact CB-CB 4.17Å; L124-E128 HydrophobicContact CD2-CB 3.96Å; S125-E128 PolarHBondContact N-OE2 2.92Å; S125-E128 PolarHBondContact O-N 3.32Å; S125-E128 VanDerWaalsContact O-N 3.15Å; S125-E128 WeakPolarHBondContact OG-CG 3.44Å; S125-E128 PolarHBondContact OG-N 3.24Å; E128-F131 PolarHBondContact O-N 3Å; E128-A132 WeakPolarHBondContact O-CB 3.35Å; E128-A132 PolarHBondContact O-N 3.05Å
129	F	94.8	Very high	91.5	Very high	64 Å²	64	64.7 Å²	64.7	28%	0.281	36%	0.362	S	S	.	.	H	α-helix	trans	-67.3	-42	176.3	-178	-116.8	0	0	0	112.3	L110 E113 L124 S125 E127 A132 K133	L110-F129 HydrophobicContact CD2-CD2 3.91Å; L110-F129 HydrophobicContact CD2-CE2 3.89Å; E113-F129 HydrophobicContact CG-CD2 4.24Å; E113-F129 HydrophobicContact CG-CE2 4.11Å; L124-F129 HydrophobicContact CB-CB 4.2Å; L124-F129 HydrophobicContact CD1-CB 4.19Å; L124-F129 HydrophobicContact CD1-CD2 3.85Å; S125-F129 WeakPolarHBondContact O-CB 3.28Å; S125-F129 PolarHBondContact O-N 3.09Å; E127-F129 VanDerWaalsContact C-N 3.31Å; E127-F129 PolarHBondContact O-N 3.38Å; F129-A132 PolarHBondContact O-N 3.34Å; F129-K133 HydrophobicContact CD1-CD 4.29Å; F129-K133 HydrophobicContact CE1-CD 4.02Å; F129-K133 HydrophobicContact CZ-CD 4.19Å; F129-K133 WeakPolarHBondContact O-CG 3.26Å; F129-K133 PolarHBondContact O-N 2.93Å; F129-K133 VanDerWaalsContact O-N 3.08Å
130	A	95.9	Very high	92.7	Very high	56 Å²	56	64.9 Å²	64.9	46%	0.463	34%	0.34	S	S	.	.	H	α-helix	trans	-60.9	-46	172.8	0	0	0	0	0	111.1	P126 E127 K133 E134	P126-A130 WeakPolarHBondContact O-CB 3.28Å; P126-A130 PolarHBondContact O-N 3.05Å; E127-A130 PolarHBondContact O-N 3.17Å; A130-K133 PolarHBondContact O-N 3.01Å; A130-E134 PolarHBondContact O-N 3Å
131	F	97	Very high	93.7	Very high	66 Å²	66	64 Å²	64	29%	0.289	34%	0.342	S	S	.	.	H	α-helix	trans	-59.2	-48.3	176.2	173.1	-99.7	0	0	0	112.2	L99 I102 E103 E127 E128 K133 E134 Y135	L99-F131 HydrophobicContact CD2-CD1 3.89Å; L99-F131 HydrophobicContact CD2-CE1 3.94Å; L99-F131 HydrophobicContact CD2-CG 4.45Å; I102-F131 HydrophobicContact CG2-CD1 4.1Å; I102-F131 HydrophobicContact CG2-CE1 4.23Å; E103-F131 HydrophobicContact CG-CE1 3.91Å; E103-F131 HydrophobicContact CG-CZ 3.93Å; E127-F131 WeakPolarHBondContact O-CB 3.5Å; E127-F131 PolarHBondContact O-N 3.46Å; E128-F131 PolarHBondContact O-N 3Å; F131-K133 VanDerWaalsContact C-N 3.32Å; F131-K133 PolarHBondContact O-N 3.31Å; F131-E134 PolarHBondContact O-N 3.46Å; F131-Y135 HydrophobicContact CZ-CD2 4.45Å; F131-Y135 VanDerWaalsContact O-CB 3.31Å; F131-Y135 WeakPolarHBondContact O-CB 3.38Å; F131-Y135 PolarHBondContact O-N 3.32Å
132	A	96.4	Very high	94.6	Very high	0 Å²	0	67.5 Å²	67.5	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-61.2	-40	179.8	0	0	0	0	0	112.1	I102 L110 E128 F129 Y136	I102-A132 HydrophobicContact CG2-CB 3.81Å; L110-A132 HydrophobicContact CD1-CB 4.46Å; L110-A132 HydrophobicContact CD2-CB 3.81Å; L110-A132 HydrophobicContact CG-CB 4.12Å; E128-A132 WeakPolarHBondContact O-CB 3.35Å; E128-A132 PolarHBondContact O-N 3.05Å; F129-A132 PolarHBondContact O-N 3.34Å; A132-Y136 WeakPolarHBondContact O-CB 3.45Å; A132-Y136 PolarHBondContact O-N 2.88Å
133	K	96.1	Very high	95	Very high	109 Å²	109	68 Å²	68	47%	0.474	35%	0.345	S	S	.	.	H	α-helix	trans	-64.9	-45.4	175	-79	179.8	169.3	175.9	0	112.6	L110 F129 A130 F131 Y135 Y136 A137	L110-K133 HydrophobicContact CD2-CG 4.1Å; F129-K133 HydrophobicContact CD1-CD 4.29Å; F129-K133 HydrophobicContact CE1-CD 4.02Å; F129-K133 HydrophobicContact CZ-CD 4.19Å; F129-K133 WeakPolarHBondContact O-CG 3.26Å; F129-K133 PolarHBondContact O-N 2.93Å; F129-K133 VanDerWaalsContact O-N 3.08Å; A130-K133 PolarHBondContact O-N 3.01Å; F131-K133 VanDerWaalsContact C-N 3.32Å; F131-K133 PolarHBondContact O-N 3.31Å; K133-Y135 VanDerWaalsContact C-N 3.34Å; K133-Y136 PolarHBondContact O-N 3.38Å; K133-A137 PolarHBondContact O-N 3.23Å
134	E	97.2	Very high	95.3	Very high	142 Å²	142	73.8 Å²	73.8	66%	0.664	37%	0.37	S	S	*	.	H	α-helix	trans	-63.2	-44	177.4	-173	177.8	171.5	0	0	110.9	A130 F131 Y136 A137 N138	A130-E134 PolarHBondContact O-N 3Å; F131-E134 PolarHBondContact O-N 3.46Å; E134-Y136 PolarHBondContact O-N 2.78Å; E134-A137 PolarHBondContact O-N 2.99Å; E134-N138 VanDerWaalsContact O-CB 3.26Å; E134-N138 WeakPolarHBondContact O-CB 3.18Å; E134-N138 PolarHBondContact O-N 3.01Å
135	Y	96.9	Very high	95.4	Very high	72 Å²	72	76.8 Å²	76.8	28%	0.282	40%	0.395	S	S	.	.	H	α-helix	trans	-59.8	-44.3	176.7	-171.9	-93.2	0	0	0	112.1	E103 F106 F131 K133 T139	E103-Y135 HydrophobicContact CG-CD2 4.47Å; E103-Y135 HydrophobicContact CG-CE2 4.16Å; F106-Y135 HydrophobicContact CB-CD1 4.02Å; F106-Y135 HydrophobicContact CB-CE1 4.44Å; F106-Y135 AromaticContact CD1-CD1 3.87Å; F106-Y135 HydrophobicContact CD1-CD1 3.87Å; F106-Y135 AromaticContact CD1-CE1 3.52Å; F106-Y135 HydrophobicContact CD1-CE1 3.52Å; F106-Y135 HydrophobicContact CD2-CD1 4.06Å; F106-Y135 HydrophobicContact CD2-CE1 4.44Å; F106-Y135 HydrophobicContact CE1-CD1 4.4Å; F106-Y135 AromaticContact CE1-CE1 3.84Å; F106-Y135 HydrophobicContact CE1-CE1 3.84Å; F106-Y135 AromaticContact CG-CD1 3.7Å; F106-Y135 HydrophobicContact CG-CD1 3.7Å; F106-Y135 AromaticContact CG-CE1 3.88Å; F106-Y135 HydrophobicContact CG-CE1 3.88Å; F106-Y135 HydrophobicContact CZ-CE1 4.44Å; F131-Y135 HydrophobicContact CZ-CD2 4.45Å; F131-Y135 VanDerWaalsContact O-CB 3.31Å; F131-Y135 WeakPolarHBondContact O-CB 3.38Å; F131-Y135 PolarHBondContact O-N 3.32Å; K133-Y135 VanDerWaalsContact C-N 3.34Å; Y135-T139 WeakPolarHBondContact O-CB 3.31Å; Y135-T139 PolarHBondContact O-N 2.77Å; Y135-T139 PolarHBondContact O-OG1 2.94Å
136	Y	95.7	Very high	95.6	Very high	77 Å²	77	79.6 Å²	79.6	30%	0.302	41%	0.412	S	S	.	.	H	α-helix	trans	-58.8	-53.2	175	-174	-75	0	0	0	111.2	F106 P107 L110 A132 K133 E134 N138 T139 E140 M160	F106-Y136 AromaticContact CD2-CD2 3.64Å; F106-Y136 HydrophobicContact CD2-CD2 3.64Å; F106-Y136 HydrophobicContact CD2-CG 4.24Å; F106-Y136 AromaticContact CE2-CD2 3.6Å; F106-Y136 HydrophobicContact CE2-CD2 3.6Å; F106-Y136 HydrophobicContact CE2-CE2 4.21Å; F106-Y136 HydrophobicContact CE2-CG 4.21Å; P107-Y136 HydrophobicContact CB-CE2 4.32Å; L110-Y136 HydrophobicContact CD1-CD2 4.11Å; L110-Y136 HydrophobicContact CD1-CG 4.32Å; A132-Y136 WeakPolarHBondContact O-CB 3.45Å; A132-Y136 PolarHBondContact O-N 2.88Å; K133-Y136 PolarHBondContact O-N 3.38Å; E134-Y136 PolarHBondContact O-N 2.78Å; Y136-N138 VanDerWaalsContact C-N 3.33Å; Y136-N138 PolarHBondContact O-N 3.4Å; Y136-T139 PolarHBondContact O-N 3.49Å; Y136-E140 PolarHBondContact O-N 2.83Å; Y136-M160 HydrophobicContact CE2-CB 3.98Å; Y136-M160 HydrophobicContact CE2-CG 4.05Å
137	A	96.3	Very high	95.7	Very high	48 Å²	48	76.8 Å²	76.8	40%	0.397	40%	0.397	S	S	.	.	H	α-helix	trans	-63.5	-38.7	-177.4	0	0	0	0	0	112.4	K133 E134 T141	K133-A137 PolarHBondContact O-N 3.23Å; E134-A137 PolarHBondContact O-N 2.99Å; A137-T141 VanDerWaalsContact O-CB 3.3Å; A137-T141 WeakPolarHBondContact O-CB 3.27Å; A137-T141 PolarHBondContact O-N 3.16Å; A137-T141 PolarHBondContact O-OG1 2.92Å
138	N	97.3	Very high	95.6	Very high	105 Å²	105	71.5 Å²	71.5	56%	0.561	37%	0.373	S	S	*	.	H	α-helix	trans	-64.8	-45.4	176.5	-173.6	33.4	0	0	0	111.2	E134 Y136 E140 T141 Y142	E134-N138 VanDerWaalsContact O-CB 3.26Å; E134-N138 WeakPolarHBondContact O-CB 3.18Å; E134-N138 PolarHBondContact O-N 3.01Å; Y136-N138 VanDerWaalsContact C-N 3.33Å; Y136-N138 PolarHBondContact O-N 3.4Å; N138-E140 PolarHBondContact O-N 3.31Å; N138-T141 PolarHBondContact O-N 2.78Å; N138-Y142 VanDerWaalsContact O-CB 3.3Å; N138-Y142 WeakPolarHBondContact O-CB 3.37Å; N138-Y142 PolarHBondContact O-N 2.93Å
139	T	95.6	Very high	95.5	Very high	31 Å²	31	78.3 Å²	78.3	19%	0.19	40%	0.402	C	S	.	.	H	α-helix	trans	-61.6	-45.6	178	-59.2	0	0	0	0	111.5	F106 Y135 Y136 Y142 L143	F106-T139 HydrophobicContact CZ-CG2 4.28Å; Y135-T139 WeakPolarHBondContact O-CB 3.31Å; Y135-T139 PolarHBondContact O-N 2.77Å; Y135-T139 PolarHBondContact O-OG1 2.94Å; Y136-T139 PolarHBondContact O-N 3.49Å; T139-Y142 PolarHBondContact O-N 2.81Å; T139-L143 HydrophobicContact CG2-CD1 3.92Å; T139-L143 HydrophobicContact CG2-CG 4.46Å; T139-L143 WeakPolarHBondContact O-CB 3.45Å; T139-L143 VanDerWaalsContact O-CG 3.3Å; T139-L143 WeakPolarHBondContact O-CG 3.47Å; T139-L143 PolarHBondContact O-N 2.99Å
140	E	93.8	Very high	95.5	Very high	91 Å²	91	85.3 Å²	85.3	43%	0.425	43%	0.427	S	S	.	.	H	α-helix	trans	-62	-46.3	176.9	-171	-176.5	177.8	0	0	111.7	Y136 N138 Y142 L143 K144	Y136-E140 PolarHBondContact O-N 2.83Å; N138-E140 PolarHBondContact O-N 3.31Å; E140-Y142 VanDerWaalsContact C-N 3.35Å; E140-Y142 PolarHBondContact O-N 2.88Å; E140-L143 PolarHBondContact O-N 3.42Å; E140-K144 VanDerWaalsContact O-CB 3.23Å; E140-K144 WeakPolarHBondContact O-CB 3.49Å; E140-K144 PolarHBondContact O-N 2.75Å
141	T	95.6	Very high	95.4	Very high	92 Å²	92	86.8 Å²	86.8	56%	0.564	43%	0.425	S	S	*	.	H	α-helix	trans	-60.9	-45	178.8	-60.7	0	0	0	0	111.3	A137 N138 K144 A145	A137-T141 VanDerWaalsContact O-CB 3.3Å; A137-T141 WeakPolarHBondContact O-CB 3.27Å; A137-T141 PolarHBondContact O-N 3.16Å; A137-T141 PolarHBondContact O-OG1 2.92Å; N138-T141 PolarHBondContact O-N 2.78Å; T141-K144 PolarHBondContact O-N 3.37Å; T141-A145 WeakPolarHBondContact O-CB 3.49Å; T141-A145 PolarHBondContact O-N 3.35Å
142	Y	96.6	Very high	95.3	Very high	148 Å²	148	87.1 Å²	87.1	58%	0.58	43%	0.434	S	S	*	.	H	α-helix	trans	-62.5	-52.1	178.5	175.8	-102.6	0	0	0	111.9	N138 T139 E140 K144 A145 V146	N138-Y142 VanDerWaalsContact O-CB 3.3Å; N138-Y142 WeakPolarHBondContact O-CB 3.37Å; N138-Y142 PolarHBondContact O-N 2.93Å; T139-Y142 PolarHBondContact O-N 2.81Å; E140-Y142 VanDerWaalsContact C-N 3.35Å; E140-Y142 PolarHBondContact O-N 2.88Å; Y142-K144 VanDerWaalsContact C-N 3.26Å; Y142-K144 PolarHBondContact O-N 3.06Å; Y142-A145 PolarHBondContact O-N 3.3Å; Y142-V146 HydrophobicContact CD2-CG2 3.95Å; Y142-V146 HydrophobicContact CE1-CG2 4.23Å; Y142-V146 HydrophobicContact CE2-CG2 3.57Å; Y142-V146 HydrophobicContact CG-CG2 4.43Å; Y142-V146 WeakPolarHBondContact O-CB 3.24Å; Y142-V146 WeakPolarHBondContact O-CG2 3.38Å; Y142-V146 PolarHBondContact O-N 2.85Å
143	L	95.2	Very high	95	Very high	61 Å²	61	92.3 Å²	92.3	32%	0.319	47%	0.467	S	S	.	.	H	α-helix	trans	-60	-39.8	179.5	-70.6	172.4	0	0	0	111.5	T139 E140 A147 L148 M160	T139-L143 HydrophobicContact CG2-CD1 3.92Å; T139-L143 HydrophobicContact CG2-CG 4.46Å; T139-L143 WeakPolarHBondContact O-CB 3.45Å; T139-L143 VanDerWaalsContact O-CG 3.3Å; T139-L143 WeakPolarHBondContact O-CG 3.47Å; T139-L143 PolarHBondContact O-N 2.99Å; E140-L143 PolarHBondContact O-N 3.42Å; L143-A147 PolarHBondContact O-N 3.24Å; L143-L148 HydrophobicContact CB-CD1 4.01Å; L143-L148 HydrophobicContact CB-CG 4.39Å; L143-L148 PolarHBondContact O-N 2.87Å; L143-M160 HydrophobicContact CD1-CE 3.62Å; L143-M160 HydrophobicContact CD1-SD 4.38Å
144	K	94.2	Very high	94.8	Very high	126 Å²	126	94.2 Å²	94.2	55%	0.548	48%	0.483	S	S	.	.	H	α-helix	trans	-63.7	-44.5	176.2	-171.1	174.3	-175.2	172.1	0	112.9	E140 T141 Y142 K149	E140-K144 VanDerWaalsContact O-CB 3.23Å; E140-K144 WeakPolarHBondContact O-CB 3.49Å; E140-K144 PolarHBondContact O-N 2.75Å; T141-K144 PolarHBondContact O-N 3.37Å; Y142-K144 VanDerWaalsContact C-N 3.26Å; Y142-K144 PolarHBondContact O-N 3.06Å; K144-K149 VanDerWaalsContact O-CB 3.3Å; K144-K149 WeakPolarHBondContact O-CB 3.49Å; K144-K149 PolarHBondContact O-N 2.96Å; K144-K149 VanDerWaalsContact O-N 3.13Å
145	A	95	Very high	94.4	Very high	68 Å²	68	92.8 Å²	92.8	56%	0.562	48%	0.479	S	S	*	.	H	α-helix	trans	-67.8	-41.1	-179.8	0	0	0	0	0	112.5	T141 Y142	T141-A145 WeakPolarHBondContact O-CB 3.49Å; T141-A145 PolarHBondContact O-N 3.35Å; Y142-A145 PolarHBondContact O-N 3.3Å
146	V	95.8	Very high	94.1	Very high	72 Å²	72	93.3 Å²	93.3	44%	0.436	48%	0.484	S	S	.	.	H	α-helix	trans	-77.5	-48.8	-175.3	173.5	0	0	0	0	112	Y142	Y142-V146 HydrophobicContact CD2-CG2 3.95Å; Y142-V146 HydrophobicContact CE1-CG2 4.23Å; Y142-V146 HydrophobicContact CE2-CG2 3.57Å; Y142-V146 HydrophobicContact CG-CG2 4.43Å; Y142-V146 WeakPolarHBondContact O-CB 3.24Å; Y142-V146 WeakPolarHBondContact O-CG2 3.38Å; Y142-V146 PolarHBondContact O-N 2.85Å
147	A	94.4	Very high	93.8	Very high	37 Å²	37	94 Å²	94	31%	0.306	51%	0.506	S	S	.	.	T	Hydrogen-bonded Turn	trans	-129.9	-50.7	-167.6	0	0	0	0	0	114	L143 K149 R150 M151	L143-A147 PolarHBondContact O-N 3.24Å; A147-K149 VanDerWaalsContact C-N 3.3Å; A147-K149 PolarHBondContact O-N 2.82Å; A147-R150 WeakPolarHBondContact O-CB 3.41Å; A147-R150 PolarHBondContact O-N 3.34Å; A147-M151 PolarHBondContact O-N 3.04Å
148	L	93.2	Very high	93.5	Very high	22 Å²	22	94.7 Å²	94.7	12%	0.115	51%	0.505	C	S	.	.	G	3₁₀ helix	trans	-65.1	-32.4	-163.8	-51.8	172.3	0	0	0	113.2	L143 R150 M151 Q156 V158	L143-L148 HydrophobicContact CB-CD1 4.01Å; L143-L148 HydrophobicContact CB-CG 4.39Å; L143-L148 PolarHBondContact O-N 2.87Å; L148-R150 PolarHBondContact O-N 2.94Å; L148-R150 VanDerWaalsContact O-N 3.17Å; L148-M151 WeakPolarHBondContact O-CB 3.2Å; L148-M151 PolarHBondContact O-N 3.06Å; L148-M151 VanDerWaalsContact O-N 3.13Å; L148-Q156 WeakPolarHBondContact CB-O 3.36Å; L148-Q156 VanDerWaalsContact O-CG 3.27Å; L148-Q156 WeakPolarHBondContact O-CG 3.42Å; L148-V158 HydrophobicContact CD1-CB 4.5Å; L148-V158 HydrophobicContact CD1-CG2 3.81Å; L148-V158 HydrophobicContact CD2-CG2 3.52Å; L148-V158 HydrophobicContact CG-CG2 4.31Å
149	K	93.5	Very high	93.2	Very high	157 Å²	157	93.1 Å²	93.1	68%	0.683	50%	0.497	S	S	*	.	G	3₁₀ helix	trans	-62.4	-22.5	175.3	-173.1	177.2	179.4	-177.6	0	113.4	K144 A147	K144-K149 VanDerWaalsContact O-CB 3.3Å; K144-K149 WeakPolarHBondContact O-CB 3.49Å; K144-K149 PolarHBondContact O-N 2.96Å; K144-K149 VanDerWaalsContact O-N 3.13Å; A147-K149 VanDerWaalsContact C-N 3.3Å; A147-K149 PolarHBondContact O-N 2.82Å
150	R	94.1	Very high	93	Very high	211 Å²	211	92.1 Å²	92.1	80%	0.796	49%	0.49	S	S	*	.	G	3₁₀ helix	trans	-94.5	-8.8	-179.7	-54.9	179.4	-173	-174.3	2.2	112.7	A147 L148	A147-R150 WeakPolarHBondContact O-CB 3.41Å; A147-R150 PolarHBondContact O-N 3.34Å; L148-R150 PolarHBondContact O-N 2.94Å; L148-R150 VanDerWaalsContact O-N 3.17Å
151	M	93.4	Very high	93	Very high	88 Å²	88	91 Å²	91	43%	0.433	49%	0.486	S	S	.	.	S	Bend	trans	-75	159.2	177.6	-69	-67.4	-170.1	0	0	111.2	A147 L148 L155 Q156	A147-M151 PolarHBondContact O-N 3.04Å; L148-M151 WeakPolarHBondContact O-CB 3.2Å; L148-M151 PolarHBondContact O-N 3.06Å; L148-M151 VanDerWaalsContact O-N 3.13Å; M151-L155 HydrophobicContact CB-CB 4.26Å; M151-Q156 HydrophobicContact CB-CG 4.33Å; M151-Q156 PolarHBondContact O-NE2 3.36Å
152	P	94.4	Very high	92.9	Very high	73 Å²	73	94.9 Å²	94.9	47%	0.474	50%	0.495	S	S	.	.			trans	-52.4	149.4	169.3	-25.3	34.7	0	0	0	111.5	N154 L155 Q156	P152-N154 PolarHBondContact O-N 3.14Å; P152-L155 PolarHBondContact O-N 3.43Å; P152-Q156 VanDerWaalsContact O-CG 3.31Å; P152-Q156 WeakPolarHBondContact O-CG 3.19Å
153	P	89.9	Confident	92.7	Very high	108 Å²	108	90.8 Å²	90.8	70%	0.701	49%	0.493	S	S	*	.	G	3₁₀ helix	trans	-50.2	-33.6	-173.4	-28.3	34.5	0	0	0	114.4	L155	P153-L155 VanDerWaalsContact C-N 3.27Å; P153-L155 PolarHBondContact O-N 2.96Å
154	N	91.8	Very high	92.7	Very high	150 Å²	150	88.9 Å²	88.9	80%	0.802	48%	0.483	S	S	*	.	G	3₁₀ helix	trans	-77.9	-11	-175.4	-38.4	-6.6	0	0	0	113	P152	P152-N154 PolarHBondContact O-N 3.14Å
155	L	89.8	Confident	92.7	Very high	111 Å²	111	87.3 Å²	87.3	58%	0.581	49%	0.486	S	S	*	.	G	3₁₀ helix	trans	-124.1	15	-173.1	-63.4	177.2	0	0	0	112.6	M151 P152 P153 A157	M151-L155 HydrophobicContact CB-CB 4.26Å; P152-L155 PolarHBondContact O-N 3.43Å; P153-L155 VanDerWaalsContact C-N 3.27Å; P153-L155 PolarHBondContact O-N 2.96Å; L155-A157 VanDerWaalsContact C-N 3.32Å
156	Q	90.6	Very high	92.7	Very high	84 Å²	84	90.7 Å²	90.7	39%	0.393	49%	0.49	S	S	.	.	S	Bend	trans	-84	-7.5	-179.6	-54.5	-164.8	-11.4	0	0	113.6	L148 M151 P152	L148-Q156 WeakPolarHBondContact CB-O 3.36Å; L148-Q156 VanDerWaalsContact O-CG 3.27Å; L148-Q156 WeakPolarHBondContact O-CG 3.42Å; M151-Q156 HydrophobicContact CB-CG 4.33Å; M151-Q156 PolarHBondContact O-NE2 3.36Å; P152-Q156 VanDerWaalsContact O-CG 3.31Å; P152-Q156 WeakPolarHBondContact O-CG 3.19Å
157	A	89.3	Confident	92.6	Very high	92 Å²	92	88.7 Å²	88.7	76%	0.76	48%	0.479	S	S	*	.			trans	-109.8	138.1	177.1	0	0	0	0	0	110.1	L155	L155-A157 VanDerWaalsContact C-N 3.32Å
158	V	89.8	Confident	92.5	Very high	61 Å²	61	90.2 Å²	90.2	37%	0.37	49%	0.486	S	S	.	.			trans	-118.9	126.1	175.8	177.1	0	0	0	0	108.4	L148 M160 A163	L148-V158 HydrophobicContact CD1-CB 4.5Å; L148-V158 HydrophobicContact CD1-CG2 3.81Å; L148-V158 HydrophobicContact CD2-CG2 3.52Å; L148-V158 HydrophobicContact CG-CG2 4.31Å; V158-M160 HydrophobicContact CB-CE 4.22Å; V158-M160 HydrophobicContact CG1-CE 4.3Å; V158-M160 HydrophobicContact CG1-SD 4.07Å; V158-M160 PolarHBondContact O-N 3.45Å; V158-A163 HydrophobicContact CG1-CB 3.87Å
159	D	91.9	Very high	92.5	Very high	73 Å²	73	91.8 Å²	91.8	39%	0.39	50%	0.495	S	S	.	.			trans	-77.9	100.3	171.3	-175.5	-10.5	0	0	0	108.9	L161 K162 A163	D159-L161 PolarHBondContact O-N 3.48Å; D159-L161 PolarHBondContact OD1-N 2.91Å; D159-K162 HydrophobicContact CB-CB 4.41Å; D159-K162 HydrophobicContact CB-CD 4.41Å; D159-K162 PolarHBondContact O-N 3.01Å; D159-K162 VanDerWaalsContact O-N 3.16Å; D159-K162 VanDerWaalsContact OD2-CD 3.31Å; D159-K162 WeakPolarHBondContact OD2-CD 3.43Å; D159-K162 VanDerWaalsContact OD2-CE 3.25Å; D159-K162 WeakPolarHBondContact OD2-CE 3.37Å; D159-K162 IonicContact OD2-NZ 2.76Å; D159-K162 PolarHBondContact OD2-NZ 3.25Å; D159-A163 WeakPolarHBondContact O-CB 3.4Å; D159-A163 PolarHBondContact O-N 2.61Å
160	M	91.6	Very high	92.4	Very high	9 Å²	9	87.2 Å²	87.2	4%	0.044	48%	0.478	C	S	.	.	H	α-helix	trans	-64.1	-29	-175.1	-64.5	-59.2	173.9	0	0	112.7	P107 Y136 L143 V158 K162 A163 V164	P107-M160 HydrophobicContact CB-CB 4.14Å; P107-M160 HydrophobicContact CG-CB 3.83Å; Y136-M160 HydrophobicContact CE2-CB 3.98Å; Y136-M160 HydrophobicContact CE2-CG 4.05Å; L143-M160 HydrophobicContact CD1-CE 3.62Å; L143-M160 HydrophobicContact CD1-SD 4.38Å; V158-M160 HydrophobicContact CB-CE 4.22Å; V158-M160 HydrophobicContact CG1-CE 4.3Å; V158-M160 HydrophobicContact CG1-SD 4.07Å; V158-M160 PolarHBondContact O-N 3.45Å; M160-K162 VanDerWaalsContact C-N 3.28Å; M160-K162 PolarHBondContact O-N 3.15Å; M160-A163 PolarHBondContact O-N 3.23Å; M160-V164 WeakPolarHBondContact O-CB 3.24Å; M160-V164 WeakPolarHBondContact O-CG2 3.4Å; M160-V164 PolarHBondContact O-N 2.85Å
161	L	92.4	Very high	92.4	Very high	68 Å²	68	79.3 Å²	79.3	36%	0.356	45%	0.454	S	S	.	.	H	α-helix	trans	-65	-34.8	176.6	-71.2	166.4	0	0	0	111.3	P107 H108 E111 D159	P107-L161 HydrophobicContact CB-CD2 3.84Å; P107-L161 HydrophobicContact CB-CG 4.29Å; H108-L161 PolarHBondContact CE1-O 2.99Å; H108-L161 PolarHBondContact NE2-O 3.46Å; E111-L161 HydrophobicContact CB-CD2 4.15Å; D159-L161 PolarHBondContact O-N 3.48Å; D159-L161 PolarHBondContact OD1-N 2.91Å
162	K	93.2	Very high	92.4	Very high	173 Å²	173	80.2 Å²	80.2	75%	0.752	46%	0.456	S	S	*	.	H	α-helix	trans	-84.2	-29.9	175.6	-67.3	179.1	-172.8	131.8	0	113.3	D159 M160	D159-K162 HydrophobicContact CB-CB 4.41Å; D159-K162 HydrophobicContact CB-CD 4.41Å; D159-K162 PolarHBondContact O-N 3.01Å; D159-K162 VanDerWaalsContact O-N 3.16Å; D159-K162 VanDerWaalsContact OD2-CD 3.31Å; D159-K162 WeakPolarHBondContact OD2-CD 3.43Å; D159-K162 VanDerWaalsContact OD2-CE 3.25Å; D159-K162 WeakPolarHBondContact OD2-CE 3.37Å; D159-K162 IonicContact OD2-NZ 2.76Å; D159-K162 PolarHBondContact OD2-NZ 3.25Å; M160-K162 VanDerWaalsContact C-N 3.28Å; M160-K162 PolarHBondContact O-N 3.15Å
163	A	93.2	Very high	92.5	Very high	63 Å²	63	77.1 Å²	77.1	52%	0.521	44%	0.436	S	S	.	.	H	α-helix	trans	-77.3	-32.8	-177.4	0	0	0	0	0	112.6	V158 D159 M160	V158-A163 HydrophobicContact CG1-CB 3.87Å; D159-A163 WeakPolarHBondContact O-CB 3.4Å; D159-A163 PolarHBondContact O-N 2.61Å; M160-A163 PolarHBondContact O-N 3.23Å
164	V	95.3	Very high	92.8	Very high	21 Å²	21	77.9 Å²	77.9	13%	0.127	43%	0.429	C	S	.	.	S	Bend	trans	-94.1	130.6	-180	179.7	0	0	0	0	109.5	K104 F106 P107 H108 M160	K104-V164 VanDerWaalsContact O-CG1 3.24Å; K104-V164 WeakPolarHBondContact O-CG1 3.37Å; F106-V164 HydrophobicContact CE1-CG1 4.44Å; F106-V164 HydrophobicContact CE1-CG2 3.64Å; F106-V164 HydrophobicContact CZ-CG2 3.78Å; P107-V164 HydrophobicContact CG-CB 3.9Å; P107-V164 HydrophobicContact CG-CG1 4.31Å; P107-V164 HydrophobicContact CG-CG2 3.68Å; H108-V164 PolarHBondContact NE2-O 3.06Å; M160-V164 WeakPolarHBondContact O-CB 3.24Å; M160-V164 WeakPolarHBondContact O-CG2 3.4Å; M160-V164 PolarHBondContact O-N 2.85Å
165	P	94.1	Very high	93	Very high	93 Å²	93	70.8 Å²	70.8	60%	0.604	39%	0.39	S	S	*	.	P	Polyproline II helix	trans	-61.1	145.8	176.8	-22.5	33.2	0	0	0	112.6	Y105 H108	Y105-P165 VanDerWaalsContact CD1-O 3.31Å; Y105-P165 WeakPolarHBondContact CD1-O 3.47Å; H108-P165 PolarHBondContact CD2-O 3.24Å
166	E	94	Very high	93.4	Very high	138 Å²	138	70.9 Å²	70.9	65%	0.645	38%	0.383	S	S	*	.	P	Polyproline II helix	trans	-81.2	155.6	172	-73.3	175.5	-164.1	0	0	111.9	H108 C168	H108-E166 WeakPolarHBondContact CE1-CG 3.42Å; H108-E166 IonicContact CE1-OE1 2.61Å; H108-E166 WeakPolarHBondContact NE2-CG 3.33Å; E166-C168 PolarHBondContact O-N 2.72Å
167	P	94	Very high	93.7	Very high	31 Å²	31	67 Å²	67	20%	0.201	37%	0.365	C	S	.	.	P	Polyproline II helix	trans	-58.2	126	167.8	-22	32.9	0	0	0	111.9	E44 Y105 L169	E44-P167 HydrophobicContact CB-CB 3.73Å; E44-P167 HydrophobicContact CB-CG 4.21Å; Y105-P167 HydrophobicContact CD1-CG 3.96Å; Y105-P167 HydrophobicContact CD2-CG 3.91Å; Y105-P167 HydrophobicContact CE1-CB 4.49Å; Y105-P167 HydrophobicContact CE1-CG 4.21Å; Y105-P167 HydrophobicContact CE2-CB 4.35Å; Y105-P167 HydrophobicContact CE2-CG 4.14Å; Y105-P167 HydrophobicContact CG-CG 3.8Å; P167-L169 PolarHBondContact O-N 3.05Å
168	C	93.4	Very high	93.9	Very high	69 Å²	69	65.6 Å²	65.6	47%	0.466	34%	0.342	S	S	.	.			trans	-82.5	96.3	179.9	-176.6	0	0	0	0	111	P43 E166 D170 S171	P43-C168 VanDerWaalsContact CB-O 3.29Å; P43-C168 WeakPolarHBondContact CB-O 3.49Å; P43-C168 WeakPolarHBondContact CG-O 3.19Å; E166-C168 PolarHBondContact O-N 2.72Å; C168-D170 PolarHBondContact O-N 3.47Å; C168-S171 WeakPolarHBondContact O-CB 3.27Å; C168-S171 PolarHBondContact O-N 3.26Å; C168-S171 PolarHBondContact O-OG 3.01Å
169	L	92.9	Very high	94.1	Very high	55 Å²	55	68 Å²	68	29%	0.288	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-19.8	-179.7	-56.6	-176.8	0	0	0	113.5	E44 P167 S171 Y210 R211	E44-L169 HydrophobicContact CB-CD2 4.14Å; E44-L169 HydrophobicContact CG-CD2 4.12Å; P167-L169 PolarHBondContact O-N 3.05Å; L169-S171 PolarHBondContact O-N 3.49Å; L169-Y210 HydrophobicContact CD2-CD1 3.99Å; L169-Y210 HydrophobicContact CD2-CE1 3.94Å; L169-Y210 CarbonylContact O-C 3.51Å; L169-Y210 WeakPolarHBondContact O-CB 3.09Å; L169-Y210 PolarHBondContact O-N 3.44Å; L169-R211 HydrophobicContact CB-CB 4.08Å; L169-R211 HydrophobicContact CB-CG 4.46Å; L169-R211 WeakPolarHBondContact O-CB 3.48Å; L169-R211 PolarHBondContact O-N 3.33Å
170	D	91.9	Very high	94.1	Very high	61 Å²	61	69.9 Å²	69.9	33%	0.326	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.9	2	175.2	-70.9	-64.8	0	0	0	113.5	C168 F172 R209 R211	C168-D170 PolarHBondContact O-N 3.47Å; D170-F172 PolarHBondContact O-N 3.07Å; D170-R209 WeakPolarHBondContact OD1-CD 3.37Å; D170-R209 IonicContact OD1-NH1 2.84Å; D170-R209 PolarHBondContact OD1-NH1 3.3Å; D170-R209 VanDerWaalsContact OD1-NH1 3.12Å; D170-R211 IonicContact OD2-NH1 3.69Å
171	S	93.1	Very high	94.1	Very high	44 Å²	44	72 Å²	72	31%	0.308	36%	0.36	S	S	.	.			trans	-61	136.1	173.8	-57.7	0	0	0	0	111	C168 L169 Y210	C168-S171 WeakPolarHBondContact O-CB 3.27Å; C168-S171 PolarHBondContact O-N 3.26Å; C168-S171 PolarHBondContact O-OG 3.01Å; L169-S171 PolarHBondContact O-N 3.49Å; S171-Y210 WeakPolarHBondContact O-CB 3.39Å; S171-Y210 PolarHBondContact O-N 3.25Å
172	F	93.9	Very high	94	Very high	108 Å²	108	73.7 Å²	73.7	47%	0.474	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	136	175.5	-78.3	-94.2	0	0	0	111.5	D170 L207 M208 R209	D170-F172 PolarHBondContact O-N 3.07Å; F172-L207 HydrophobicContact CB-CD1 3.91Å; F172-L207 HydrophobicContact CD1-CD1 4.25Å; F172-L207 HydrophobicContact CD1-CG 4.07Å; F172-M208 WeakPolarHBondContact CA-O 3.3Å; F172-R209 HydrophobicContact CD1-CG 4.42Å; F172-R209 HydrophobicContact CD2-CG 4.39Å; F172-R209 HydrophobicContact CE1-CG 4.06Å; F172-R209 HydrophobicContact CE2-CG 4.01Å; F172-R209 HydrophobicContact CZ-CG 3.85Å
173	V	96.1	Very high	93.7	Very high	8 Å²	8	70.6 Å²	70.6	5%	0.048	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	143.9	178	-64.3	0	0	0	0	110.4	F41 M208 Y210 V213 L224	F41-V173 WeakPolarHBondContact O-CG1 3.47Å; V173-M208 PolarHBondContact N-O 3.33Å; V173-M208 PolarHBondContact O-N 3.27Å; V173-Y210 HydrophobicContact CG1-CD2 4.28Å; V173-Y210 HydrophobicContact CG2-CD2 4.27Å; V173-V213 HydrophobicContact CG2-CG2 4.03Å; V173-L224 HydrophobicContact CB-CD2 4.15Å; V173-L224 HydrophobicContact CG2-CD2 3.79Å
174	F	97.3	Very high	93.4	Very high	124 Å²	124	68.6 Å²	68.6	54%	0.544	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	136.8	166.6	-70.3	-83.2	0	0	0	109	H206 L207 L224 I225	F174-H206 WeakPolarHBondContact CA-O 3.45Å; F174-L207 HydrophobicContact CD1-CB 4.11Å; F174-L207 HydrophobicContact CD1-CD1 4.07Å; F174-L207 HydrophobicContact CD2-CD1 4.12Å; F174-L207 HydrophobicContact CE1-CB 3.94Å; F174-L207 HydrophobicContact CE1-CD1 3.94Å; F174-L207 HydrophobicContact CE1-CD2 4.14Å; F174-L207 HydrophobicContact CE1-CG 4.22Å; F174-L207 HydrophobicContact CE2-CD1 3.98Å; F174-L207 HydrophobicContact CG-CD1 4.16Å; F174-L207 HydrophobicContact CZ-CD1 3.88Å; F174-L207 HydrophobicContact CZ-CD2 4.05Å; F174-L207 HydrophobicContact CZ-CG 4.4Å; F174-L224 WeakPolarHBondContact O-CA 3.47Å; F174-I225 HydrophobicContact CB-CG1 3.83Å; F174-I225 PolarHBondContact O-N 3.41Å
175	L	96.2	Very high	92.9	Very high	0 Å²	0	71.6 Å²	71.6	0%	0	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	152	178.9	66.6	92.4	0	0	0	111.2	V177 Q205 H206 V213 V222 Q223 L224	L175-V177 HydrophobicContact CD1-CG2 3.91Å; L175-Q205 VanDerWaalsContact O-CA 3.25Å; L175-Q205 WeakPolarHBondContact O-CA 3.3Å; L175-H206 HydrophobicContact CD1-CB 4.12Å; L175-H206 HydrophobicContact CG-CB 4.23Å; L175-H206 PolarHBondContact N-O 2.99Å; L175-H206 PolarHBondContact O-N 3Å; L175-V213 HydrophobicContact CD2-CB 4.04Å; L175-V213 HydrophobicContact CD2-CG1 3.63Å; L175-V213 HydrophobicContact CD2-CG2 3.97Å; L175-V222 HydrophobicContact CD1-CB 4.3Å; L175-V222 HydrophobicContact CD1-CG1 4.18Å; L175-Q223 CarbonylContact C-O 3.59Å; L175-Q223 VanDerWaalsContact CA-O 3.29Å; L175-Q223 WeakPolarHBondContact CA-O 3.42Å; L175-L224 HydrophobicContact CB-CD2 4.04Å
176	R	96.9	Very high	92.5	Very high	113 Å²	113	68.4 Å²	68.4	43%	0.426	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	130.5	167.9	179.9	170	63.2	127	-2.6	108.9	S204 Q205 Q223 I225	R176-S204 WeakPolarHBondContact CA-O 3.32Å; R176-Q205 HydrophobicContact CB-CG 4.3Å; R176-Q205 HydrophobicContact CG-CG 4.44Å; R176-Q223 PolarHBondContact N-O 2.97Å; R176-Q223 PolarHBondContact O-N 2.88Å; R176-I225 HydrophobicContact CB-CD1 4.38Å; R176-I225 HydrophobicContact CB-CG2 4.28Å
177	V	96.3	Very high	91.7	Very high	2 Å²	2	66.8 Å²	66.8	1%	0.012	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	127	-179.9	-175.2	0	0	0	0	109.3	L175 E179 L200 E201 G203 S204	L175-V177 HydrophobicContact CD1-CG2 3.91Å; V177-E179 WeakPolarHBondContact CG1-O 3.18Å; V177-L200 HydrophobicContact CG1-CB 4.13Å; V177-L200 HydrophobicContact CG2-CB 3.78Å; V177-L200 HydrophobicContact CG2-CD1 4.37Å; V177-L200 HydrophobicContact CG2-CD2 4.42Å; V177-L200 HydrophobicContact CG2-CG 4.42Å; V177-E201 WeakPolarHBondContact CB-O 3.38Å; V177-E201 WeakPolarHBondContact CG1-O 3.25Å; V177-G203 WeakPolarHBondContact O-CA 3.44Å; V177-G203 PolarHBondContact O-N 2.89Å; V177-S204 PolarHBondContact N-O 3.33Å
178	K	94.1	Very high	90.7	Very high	64 Å²	64	66.5 Å²	66.5	28%	0.278	32%	0.322	S	S	.	.	S	Bend	trans	-99.4	-31.3	174.7	-73.9	-179.3	165.4	166.8	0	112.1	E202 A221 Q223	K178-E202 WeakPolarHBondContact O-CG 3.35Å; K178-A221 WeakPolarHBondContact CA-O 3.23Å; K178-A221 WeakPolarHBondContact CB-O 3.3Å; K178-A221 PolarHBondContact N-O 3.45Å; K178-Q223 HydrophobicContact CD-CB 4.25Å; K178-Q223 HydrophobicContact CG-CB 4.46Å
179	E	93.9	Very high	89.5	Confident	110 Å²	110	70.1 Å²	70.1	51%	0.514	33%	0.332	S	S	.	.	S	Bend	trans	-131	138.4	178.7	-64.4	176.5	-176.9	0	0	108.7	V177 Q181 A221	V177-E179 WeakPolarHBondContact CG1-O 3.18Å; E179-Q181 PolarHBondContact O-N 3.49Å; E179-A221 HydrophobicContact CB-CB 4.18Å; E179-A221 PolarHBondContact N-O 3.41Å; E179-A221 VanDerWaalsContact N-O 3.09Å
180	R	93.5	Very high	88.4	Confident	114 Å²	114	71 Å²	71	43%	0.43	34%	0.34	S	S	.	.			trans	-57.7	129	177.9	179.7	-176.5	171.5	92.2	8.6	110	E182 L200 E201	R180-E182 IonicContact CZ-OE1 3.8Å; R180-E182 IonicContact NE-OE1 3.62Å; R180-E182 PolarHBondContact NE-OE1 2.62Å; R180-E182 IonicContact NH2-OE1 2.68Å; R180-E182 PolarHBondContact NH2-OE1 3.49Å; R180-L200 WeakPolarHBondContact CA-O 3.41Å; R180-E201 IonicContact CZ-OE1 3.99Å; R180-E201 IonicContact CZ-OE2 3.71Å; R180-E201 IonicContact NH1-OE1 3.81Å; R180-E201 PolarHBondContact NH1-OE1 3.38Å; R180-E201 IonicContact NH1-OE2 3.92Å; R180-E201 PolarHBondContact NH1-OE2 3.39Å; R180-E201 IonicContact NH2-OE1 2.94Å
181	Q	91.4	Very high	87.2	Confident	53 Å²	53	76.7 Å²	76.7	25%	0.248	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	133.3	175	-63.1	-64	-8	0	0	110	E179 I184 L200 L216 A221	E179-Q181 PolarHBondContact O-N 3.49Å; Q181-I184 HydrophobicContact CB-CD1 4.21Å; Q181-I184 HydrophobicContact CB-CG1 4.44Å; Q181-L200 HydrophobicContact CB-CB 4.24Å; Q181-L200 PolarHBondContact N-O 2.84Å; Q181-L200 PolarHBondContact O-N 2.84Å; Q181-L216 HydrophobicContact CG-CD1 4.47Å; Q181-L216 HydrophobicContact CG-CD2 4.08Å; Q181-A221 HydrophobicContact CG-CB 4.13Å
182	E	90.4	Very high	85.8	Confident	103 Å²	103	83.4 Å²	83.4	48%	0.481	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	154.7	-175.4	-61.5	-174.1	166	0	0	111.3	R180 I184 D199	R180-E182 IonicContact CZ-OE1 3.8Å; R180-E182 IonicContact NE-OE1 3.62Å; R180-E182 PolarHBondContact NE-OE1 2.62Å; R180-E182 IonicContact NH2-OE1 2.68Å; R180-E182 PolarHBondContact NH2-OE1 3.49Å; E182-I184 PolarHBondContact O-N 3.08Å; E182-D199 WeakPolarHBondContact CA-OD1 3.31Å
183	N	86.7	Confident	84.6	Confident	109 Å²	109	83.9 Å²	83.9	58%	0.583	40%	0.4	S	S	*	.	E	Extended strand (participates in β ladder)	trans	59.7	39.9	172.6	-52.7	-68.9	0	0	0	114.4	L185 D199	N183-L185 PolarHBondContact O-N 2.81Å; N183-D199 PolarHBondContact N-OD1 3.47Å
184	I	86.9	Confident	83.3	Confident	21 Å²	21	94.2 Å²	94.2	11%	0.108	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	114.7	174.4	-56.9	-54.6	0	0	0	109.2	Q181 E182 V197 V198 L200 M208 I212 L216	Q181-I184 HydrophobicContact CB-CD1 4.21Å; Q181-I184 HydrophobicContact CB-CG1 4.44Å; E182-I184 PolarHBondContact O-N 3.08Å; I184-V197 VanDerWaalsContact O-CA 3.31Å; I184-V197 WeakPolarHBondContact O-CA 3.46Å; I184-V198 WeakPolarHBondContact CB-O 3.31Å; I184-V198 PolarHBondContact N-O 2.96Å; I184-V198 PolarHBondContact O-N 3.25Å; I184-L200 HydrophobicContact CG1-CD1 3.88Å; I184-L200 HydrophobicContact CG1-CG 4Å; I184-M208 HydrophobicContact CG2-CE 3.94Å; I184-I212 HydrophobicContact CG2-CG2 3.35Å; I184-L216 HydrophobicContact CD1-CD1 3.87Å; I184-L216 HydrophobicContact CG1-CD1 4.44Å
185	L	84.8	Confident	82.4	Confident	83 Å²	83	93 Å²	93	44%	0.435	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	123.9	179.5	-172.4	68.1	0	0	0	110.7	N183 D195 V197 I212	N183-L185 PolarHBondContact O-N 2.81Å; L185-D195 HydrophobicContact CD1-CB 3.88Å; L185-V197 HydrophobicContact CD1-CG1 4.13Å; L185-I212 WeakPolarHBondContact O-CG2 3.26Å
186	I	84.8	Confident	81.7	Confident	27 Å²	27	98.1 Å²	98.1	14%	0.138	46%	0.46	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	112.6	176	-53.8	-173.9	0	0	0	109.4	D195 F196 V198 M208 I212	I186-D195 WeakPolarHBondContact O-CA 3.5Å; I186-F196 HydrophobicContact CB-CD1 4.36Å; I186-F196 HydrophobicContact CB-CE1 4.03Å; I186-F196 HydrophobicContact CB-CE2 4.23Å; I186-F196 HydrophobicContact CB-CZ 3.96Å; I186-F196 HydrophobicContact CD1-CD2 4.36Å; I186-F196 HydrophobicContact CD1-CE2 3.64Å; I186-F196 HydrophobicContact CD1-CZ 3.84Å; I186-F196 HydrophobicContact CG1-CE2 4.35Å; I186-F196 HydrophobicContact CG1-CZ 4.45Å; I186-F196 HydrophobicContact CG2-CE1 3.88Å; I186-F196 HydrophobicContact CG2-CZ 3.82Å; I186-F196 PolarHBondContact N-O 3.32Å; I186-F196 PolarHBondContact O-N 3.28Å; I186-V198 HydrophobicContact CD1-CB 4Å; I186-V198 HydrophobicContact CD1-CG2 3.42Å; I186-V198 VanDerWaalsContact CD1-CG2 3.42Å; I186-V198 HydrophobicContact CG1-CG2 4.26Å; I186-M208 HydrophobicContact CD1-CE 3.3Å; I186-M208 HydrophobicContact CD1-SD 4.26Å; I186-M208 HydrophobicContact CG1-CE 3.47Å; I186-M208 VanDerWaalsContact CG1-CE 3.47Å; I186-I212 HydrophobicContact CB-CD1 4.48Å; I186-I212 HydrophobicContact CG2-CD1 4.22Å
187	E	78.1	Confident	81.2	Confident	104 Å²	104	96.9 Å²	96.9	49%	0.486	47%	0.465	S	S	.	.			trans	-82.6	121.1	171.4	-64.2	176.6	178.9	0	0	109.3	R209	E187-R209 PolarHBondContact O-NH2 2.99Å
188	P	73.1	Confident	80.8	Confident	25 Å²	25	98.5 Å²	98.5	16%	0.162	48%	0.475	C	S	.	.			trans	-69.3	169.6	179.6	22.6	-25.5	0	0	0	113	T190 Q193 D195 R209	P188-T190 VanDerWaalsContact C-N 3.29Å; P188-Q193 HydrophobicContact CB-CB 3.4Å; P188-Q193 VanDerWaalsContact CB-CB 3.4Å; P188-Q193 HydrophobicContact CB-CG 4.39Å; P188-Q193 HydrophobicContact CG-CB 3.57Å; P188-Q193 WeakPolarHBondContact CG-O 3.43Å; P188-D195 VanDerWaalsContact CD-OD1 3.26Å; P188-D195 WeakPolarHBondContact CD-OD1 3.47Å; P188-R209 PolarHBondContact O-NH2 3.03Å; P188-R209 VanDerWaalsContact O-NH2 3.09Å
189	E	67.4	Low	80.7	Confident	145 Å²	145	99 Å²	99	68%	0.678	48%	0.48	S	S	*	.	S	Bend	trans	-74.2	-20	176.7	-80.9	-173.2	163.1	0	0	113.5	R209	E189-R209 VanDerWaalsContact N-NH2 3.12Å
190	T	69.3	Low	80.7	Confident	74 Å²	74	93.8 Å²	93.8	45%	0.454	46%	0.456	S	S	.	.	S	Bend	trans	-136.7	142	-174.1	48.5	0	0	0	0	110.1	P188 E192 Q193	P188-T190 VanDerWaalsContact C-N 3.29Å; T190-E192 PolarHBondContact O-N 3.36Å; T190-Q193 PolarHBondContact O-N 3.16Å; T190-Q193 VanDerWaalsContact O-N 3.1Å
191	D	66.1	Low	80.7	Confident	180 Å²	180	92.7 Å²	92.7	96%	0.963	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-8	177.7	-71.2	-23.4	0	0	0	113.8
192	E	64.1	Low	80.9	Confident	184 Å²	184	97.1 Å²	97.1	86%	0.86	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.1	-20.6	177.7	-61.1	-169.5	168.7	0	0	113	T190	T190-E192 PolarHBondContact O-N 3.36Å
193	Q	68.6	Low	81.1	Confident	118 Å²	118	94.6 Å²	94.6	55%	0.551	48%	0.478	S	S	*	.	S	Bend	trans	-98.9	141.4	175.8	-70.1	175.5	-6.2	0	0	109.2	P188 T190	P188-Q193 HydrophobicContact CB-CB 3.4Å; P188-Q193 VanDerWaalsContact CB-CB 3.4Å; P188-Q193 HydrophobicContact CB-CG 4.39Å; P188-Q193 HydrophobicContact CG-CB 3.57Å; P188-Q193 WeakPolarHBondContact CG-O 3.43Å; T190-Q193 PolarHBondContact O-N 3.16Å; T190-Q193 VanDerWaalsContact O-N 3.1Å
194	R	70.3	Confident	81.6	Confident	226 Å²	226	91 Å²	91	85%	0.853	46%	0.461	S	S	*	.	P	Polyproline II helix	trans	-83	146	175	-67.4	-175.3	-178.6	-177.2	0	109.7	F196	R194-F196 PolarHBondContact O-N 3.43Å
195	D	77.9	Confident	82	Confident	99 Å²	99	96.4 Å²	96.4	53%	0.529	49%	0.486	S	S	.	.	P	Polyproline II helix	trans	-52.5	135.2	166.2	-54.2	-21.3	0	0	0	109.7	L185 I186 P188	L185-D195 HydrophobicContact CD1-CB 3.88Å; I186-D195 WeakPolarHBondContact O-CA 3.5Å; P188-D195 VanDerWaalsContact CD-OD1 3.26Å; P188-D195 WeakPolarHBondContact CD-OD1 3.47Å
196	F	81.3	Confident	82.5	Confident	107 Å²	107	94.8 Å²	94.8	47%	0.469	48%	0.476	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	150.5	175.4	65.7	-81.6	0	0	0	110.1	I186 R194 V198	I186-F196 HydrophobicContact CB-CD1 4.36Å; I186-F196 HydrophobicContact CB-CE1 4.03Å; I186-F196 HydrophobicContact CB-CE2 4.23Å; I186-F196 HydrophobicContact CB-CZ 3.96Å; I186-F196 HydrophobicContact CD1-CD2 4.36Å; I186-F196 HydrophobicContact CD1-CE2 3.64Å; I186-F196 HydrophobicContact CD1-CZ 3.84Å; I186-F196 HydrophobicContact CG1-CE2 4.35Å; I186-F196 HydrophobicContact CG1-CZ 4.45Å; I186-F196 HydrophobicContact CG2-CE1 3.88Å; I186-F196 HydrophobicContact CG2-CZ 3.82Å; I186-F196 PolarHBondContact N-O 3.32Å; I186-F196 PolarHBondContact O-N 3.28Å; R194-F196 PolarHBondContact O-N 3.43Å; F196-V198 HydrophobicContact CD2-CG2 3.6Å; F196-V198 HydrophobicContact CE2-CG2 3.46Å; F196-V198 VanDerWaalsContact CE2-CG2 3.46Å
197	V	86.7	Confident	82.9	Confident	87 Å²	87	97.9 Å²	97.9	53%	0.527	49%	0.493	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	141.4	177.1	-67.3	0	0	0	0	109.7	I184 L185	I184-V197 VanDerWaalsContact O-CA 3.31Å; I184-V197 WeakPolarHBondContact O-CA 3.46Å; L185-V197 HydrophobicContact CD1-CG1 4.13Å
198	V	88.1	Confident	83.5	Confident	36 Å²	36	93.5 Å²	93.5	22%	0.218	47%	0.472	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	136.3	175.2	178.7	0	0	0	0	109.1	I184 I186 F196 L200	I184-V198 WeakPolarHBondContact CB-O 3.31Å; I184-V198 PolarHBondContact N-O 2.96Å; I184-V198 PolarHBondContact O-N 3.25Å; I186-V198 HydrophobicContact CD1-CB 4Å; I186-V198 HydrophobicContact CD1-CG2 3.42Å; I186-V198 VanDerWaalsContact CD1-CG2 3.42Å; I186-V198 HydrophobicContact CG1-CG2 4.26Å; F196-V198 HydrophobicContact CD2-CG2 3.6Å; F196-V198 HydrophobicContact CE2-CG2 3.46Å; F196-V198 VanDerWaalsContact CE2-CG2 3.46Å; V198-L200 HydrophobicContact CG1-CD2 4.3Å
199	D	91.5	Very high	84.5	Confident	74 Å²	74	94 Å²	94	40%	0.396	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	130.8	169.8	-61.5	-34.7	0	0	0	109.5	E182 N183	E182-D199 WeakPolarHBondContact CA-OD1 3.31Å; N183-D199 PolarHBondContact N-OD1 3.47Å
200	L	93.1	Very high	85.8	Confident	0 Å²	0	87.2 Å²	87.2	0%	0	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	105.9	-179.5	-63.4	-174.5	0	0	0	109.1	V177 R180 Q181 I184 V198 M208 L216	V177-L200 HydrophobicContact CG1-CB 4.13Å; V177-L200 HydrophobicContact CG2-CB 3.78Å; V177-L200 HydrophobicContact CG2-CD1 4.37Å; V177-L200 HydrophobicContact CG2-CD2 4.42Å; V177-L200 HydrophobicContact CG2-CG 4.42Å; R180-L200 WeakPolarHBondContact CA-O 3.41Å; Q181-L200 HydrophobicContact CB-CB 4.24Å; Q181-L200 PolarHBondContact N-O 2.84Å; Q181-L200 PolarHBondContact O-N 2.84Å; I184-L200 HydrophobicContact CG1-CD1 3.88Å; I184-L200 HydrophobicContact CG1-CG 4Å; V198-L200 HydrophobicContact CG1-CD2 4.3Å; L200-M208 HydrophobicContact CD2-SD 4.31Å; L200-L216 HydrophobicContact CD1-CD1 4.06Å
201	E	94.6	Very high	86.9	Confident	91 Å²	91	90.4 Å²	90.4	43%	0.425	44%	0.443	S	S	.	.			trans	-78.3	144.1	177.4	-63.9	-63.3	169.8	0	0	112	V177 R180 G203 S204	V177-E201 WeakPolarHBondContact CB-O 3.38Å; V177-E201 WeakPolarHBondContact CG1-O 3.25Å; R180-E201 IonicContact CZ-OE1 3.99Å; R180-E201 IonicContact CZ-OE2 3.71Å; R180-E201 IonicContact NH1-OE1 3.81Å; R180-E201 PolarHBondContact NH1-OE1 3.38Å; R180-E201 IonicContact NH1-OE2 3.92Å; R180-E201 PolarHBondContact NH1-OE2 3.39Å; R180-E201 IonicContact NH2-OE1 2.94Å; E201-G203 PolarHBondContact O-N 3.25Å; E201-S204 PolarHBondContact N-OG 3.03Å; E201-S204 VanDerWaalsContact O-CB 3.3Å; E201-S204 WeakPolarHBondContact O-CB 3.47Å; E201-S204 PolarHBondContact O-N 2.8Å; E201-S204 VanDerWaalsContact O-N 3.09Å; E201-S204 PolarHBondContact O-OG 3.46Å
202	E	96.1	Very high	88.1	Confident	146 Å²	146	83.6 Å²	83.6	68%	0.682	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	132.5	175.9	-175.5	178.6	167.8	0	0	111.5	K178 S204	K178-E202 WeakPolarHBondContact O-CG 3.35Å; E202-S204 PolarHBondContact O-N 3.08Å
203	G	94.3	Very high	89.5	Confident	50 Å²	50	74.9 Å²	74.9	52%	0.515	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.5	-10.2	-179	0	0	0	0	0	115.3	V177 E201	V177-G203 WeakPolarHBondContact O-CA 3.44Å; V177-G203 PolarHBondContact O-N 2.89Å; E201-G203 PolarHBondContact O-N 3.25Å
204	S	95.6	Very high	90.7	Very high	34 Å²	34	70 Å²	70	24%	0.238	35%	0.345	C	S	.	.			trans	-71.8	155.9	176.2	69.2	0	0	0	0	112.3	R176 V177 E201 E202 H206	R176-S204 WeakPolarHBondContact CA-O 3.32Å; V177-S204 PolarHBondContact N-O 3.33Å; E201-S204 PolarHBondContact N-OG 3.03Å; E201-S204 VanDerWaalsContact O-CB 3.3Å; E201-S204 WeakPolarHBondContact O-CB 3.47Å; E201-S204 PolarHBondContact O-N 2.8Å; E201-S204 VanDerWaalsContact O-N 3.09Å; E201-S204 PolarHBondContact O-OG 3.46Å; E202-S204 PolarHBondContact O-N 3.08Å; S204-H206 PolarHBondContact OG-CD2 3.49Å; S204-H206 PolarHBondContact OG-NE2 2.98Å
205	Q	96.6	Very high	91.7	Very high	134 Å²	134	63.3 Å²	63.3	63%	0.626	33%	0.331	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119	137	178.7	-69.4	-177.9	-12	0	0	110.5	L175 R176 I225	L175-Q205 VanDerWaalsContact O-CA 3.25Å; L175-Q205 WeakPolarHBondContact O-CA 3.3Å; R176-Q205 HydrophobicContact CB-CG 4.3Å; R176-Q205 HydrophobicContact CG-CG 4.44Å; Q205-I225 HydrophobicContact CG-CD1 4.11Å
206	H	94.3	Very high	92.4	Very high	50 Å²	50	59.6 Å²	59.6	23%	0.231	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	156.5	-175.7	-60.8	-92.1	0	0	0	111.3	F174 L175 S204 M208	F174-H206 WeakPolarHBondContact CA-O 3.45Å; L175-H206 HydrophobicContact CD1-CB 4.12Å; L175-H206 HydrophobicContact CG-CB 4.23Å; L175-H206 PolarHBondContact N-O 2.99Å; L175-H206 PolarHBondContact O-N 3Å; S204-H206 PolarHBondContact OG-CD2 3.49Å; S204-H206 PolarHBondContact OG-NE2 2.98Å; H206-M208 HydrophobicContact CB-CG 4.25Å; H206-M208 HydrophobicContact CB-SD 4.25Å
207	L	94.2	Very high	93.1	Very high	92 Å²	92	54.8 Å²	54.8	48%	0.482	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	111.9	171.4	176.1	62.8	0	0	0	107.9	F172 F174	F172-L207 HydrophobicContact CB-CD1 3.91Å; F172-L207 HydrophobicContact CD1-CD1 4.25Å; F172-L207 HydrophobicContact CD1-CG 4.07Å; F174-L207 HydrophobicContact CD1-CB 4.11Å; F174-L207 HydrophobicContact CD1-CD1 4.07Å; F174-L207 HydrophobicContact CD2-CD1 4.12Å; F174-L207 HydrophobicContact CE1-CB 3.94Å; F174-L207 HydrophobicContact CE1-CD1 3.94Å; F174-L207 HydrophobicContact CE1-CD2 4.14Å; F174-L207 HydrophobicContact CE1-CG 4.22Å; F174-L207 HydrophobicContact CE2-CD1 3.98Å; F174-L207 HydrophobicContact CG-CD1 4.16Å; F174-L207 HydrophobicContact CZ-CD1 3.88Å; F174-L207 HydrophobicContact CZ-CD2 4.05Å; F174-L207 HydrophobicContact CZ-CG 4.4Å
208	M	91.4	Very high	93.2	Very high	12 Å²	12	52.8 Å²	52.8	6%	0.059	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	163.3	-174.2	-62.3	-179.1	64.1	0	0	110.6	F172 V173 I184 I186 L200 H206 I212 V213	F172-M208 WeakPolarHBondContact CA-O 3.3Å; V173-M208 PolarHBondContact N-O 3.33Å; V173-M208 PolarHBondContact O-N 3.27Å; I184-M208 HydrophobicContact CG2-CE 3.94Å; I186-M208 HydrophobicContact CD1-CE 3.3Å; I186-M208 HydrophobicContact CD1-SD 4.26Å; I186-M208 HydrophobicContact CG1-CE 3.47Å; I186-M208 VanDerWaalsContact CG1-CE 3.47Å; L200-M208 HydrophobicContact CD2-SD 4.31Å; H206-M208 HydrophobicContact CB-CG 4.25Å; H206-M208 HydrophobicContact CB-SD 4.25Å; M208-I212 HydrophobicContact CE-CD1 4.43Å; M208-I212 HydrophobicContact CE-CG2 4.07Å; M208-V213 HydrophobicContact CB-CG1 4.46Å; M208-V213 HydrophobicContact SD-CG1 4.45Å
209	R	92.7	Very high	93.4	Very high	36 Å²	36	54.8 Å²	54.8	14%	0.136	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	135.8	171.9	-62.9	-163.3	-159.7	149.8	20.7	110.3	D170 F172 E187 P188 E189 R211 I212	D170-R209 WeakPolarHBondContact OD1-CD 3.37Å; D170-R209 IonicContact OD1-NH1 2.84Å; D170-R209 PolarHBondContact OD1-NH1 3.3Å; D170-R209 VanDerWaalsContact OD1-NH1 3.12Å; F172-R209 HydrophobicContact CD1-CG 4.42Å; F172-R209 HydrophobicContact CD2-CG 4.39Å; F172-R209 HydrophobicContact CE1-CG 4.06Å; F172-R209 HydrophobicContact CE2-CG 4.01Å; F172-R209 HydrophobicContact CZ-CG 3.85Å; E187-R209 PolarHBondContact O-NH2 2.99Å; P188-R209 PolarHBondContact O-NH2 3.03Å; P188-R209 VanDerWaalsContact O-NH2 3.09Å; E189-R209 VanDerWaalsContact N-NH2 3.12Å; R209-R211 PolarHBondContact O-N 3.41Å; R209-I212 HydrophobicContact CB-CD1 4.44Å; R209-I212 PolarHBondContact O-N 2.86Å
210	Y	94.9	Very high	93.4	Very high	1 Å²	1	52 Å²	52	0%	0.004	29%	0.285	C	S	.	.	H	α-helix	trans	-57.8	-37.4	-177.1	174.3	-95.1	0	0	0	112.6	P43 E44 L46 L169 S171 V173 I212 V213 A214 V217 L224	P43-Y210 HydrophobicContact CG-CD1 3.43Å; P43-Y210 VanDerWaalsContact CG-CD1 3.43Å; P43-Y210 HydrophobicContact CG-CD2 4.3Å; P43-Y210 HydrophobicContact CG-CE1 4.01Å; P43-Y210 HydrophobicContact CG-CG 3.59Å; E44-Y210 HydrophobicContact CG-CE1 3.67Å; E44-Y210 WeakPolarHBondContact OE1-CE1 3.26Å; E44-Y210 PolarHBondContact OE1-OH 3.13Å; L46-Y210 WeakPolarHBondContact CD2-OH 3.36Å; L169-Y210 HydrophobicContact CD2-CD1 3.99Å; L169-Y210 HydrophobicContact CD2-CE1 3.94Å; L169-Y210 CarbonylContact O-C 3.51Å; L169-Y210 WeakPolarHBondContact O-CB 3.09Å; L169-Y210 PolarHBondContact O-N 3.44Å; S171-Y210 WeakPolarHBondContact O-CB 3.39Å; S171-Y210 PolarHBondContact O-N 3.25Å; V173-Y210 HydrophobicContact CG1-CD2 4.28Å; V173-Y210 HydrophobicContact CG2-CD2 4.27Å; Y210-I212 PolarHBondContact O-N 3.41Å; Y210-I212 VanDerWaalsContact O-N 3.11Å; Y210-V213 CarbonylContact O-C 3.51Å; Y210-V213 WeakPolarHBondContact O-CG2 3.44Å; Y210-V213 PolarHBondContact O-N 2.99Å; Y210-A214 HydrophobicContact CD1-CB 4.14Å; Y210-A214 HydrophobicContact CE1-CB 3.56Å; Y210-A214 HydrophobicContact CE2-CB 4.34Å; Y210-A214 PolarHBondContact O-N 3.35Å; Y210-V217 HydrophobicContact CE2-CG2 4.37Å; Y210-L224 HydrophobicContact CD2-CD1 4.31Å; Y210-L224 HydrophobicContact CE2-CD1 4.2Å
211	R	93.7	Very high	93.4	Very high	141 Å²	141	52 Å²	52	53%	0.532	29%	0.285	S	S	.	.	H	α-helix	trans	-47.8	-42.4	178.8	-172.8	179.2	-162.9	140.5	3.8	113.8	L169 D170 R209	L169-R211 HydrophobicContact CB-CB 4.08Å; L169-R211 HydrophobicContact CB-CG 4.46Å; L169-R211 WeakPolarHBondContact O-CB 3.48Å; L169-R211 PolarHBondContact O-N 3.33Å; D170-R211 IonicContact OD2-NH1 3.69Å; R209-R211 PolarHBondContact O-N 3.41Å
212	I	91	Very high	93.4	Very high	38 Å²	38	47.7 Å²	47.7	20%	0.195	26%	0.264	C	S	.	.	H	α-helix	trans	-71.5	-36	-177.1	-61.5	164	0	0	0	110.5	I184 L185 I186 M208 R209 Y210	I184-I212 HydrophobicContact CG2-CG2 3.35Å; L185-I212 WeakPolarHBondContact O-CG2 3.26Å; I186-I212 HydrophobicContact CB-CD1 4.48Å; I186-I212 HydrophobicContact CG2-CD1 4.22Å; M208-I212 HydrophobicContact CE-CD1 4.43Å; M208-I212 HydrophobicContact CE-CG2 4.07Å; R209-I212 HydrophobicContact CB-CD1 4.44Å; R209-I212 PolarHBondContact O-N 2.86Å; Y210-I212 PolarHBondContact O-N 3.41Å; Y210-I212 VanDerWaalsContact O-N 3.11Å
213	V	92.8	Very high	93.4	Very high	0 Å²	0	41 Å²	41	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-101.3	-5.3	-171.1	-59	0	0	0	0	113.4	V173 L175 M208 Y210 L216 V217	V173-V213 HydrophobicContact CG2-CG2 4.03Å; L175-V213 HydrophobicContact CD2-CB 4.04Å; L175-V213 HydrophobicContact CD2-CG1 3.63Å; L175-V213 HydrophobicContact CD2-CG2 3.97Å; M208-V213 HydrophobicContact CB-CG1 4.46Å; M208-V213 HydrophobicContact SD-CG1 4.45Å; Y210-V213 CarbonylContact O-C 3.51Å; Y210-V213 WeakPolarHBondContact O-CG2 3.44Å; Y210-V213 PolarHBondContact O-N 2.99Å; V213-L216 HydrophobicContact CG1-CD1 4.41Å; V213-L216 CarbonylContact O-C 3.6Å; V213-L216 WeakPolarHBondContact O-CA 3.27Å; V213-L216 WeakPolarHBondContact O-CB 3.3Å; V213-L216 PolarHBondContact O-N 3.46Å; V213-V217 WeakPolarHBondContact O-CG2 3.33Å; V213-V217 PolarHBondContact O-N 3.13Å
214	A	93.1	Very high	93.6	Very high	16 Å²	16	38.6 Å²	38.6	13%	0.132	21%	0.209	C	C	.	.	H	α-helix	trans	-53	-45.4	179.8	0	0	0	0	0	113.1	Y210 L216 V217 S218	Y210-A214 HydrophobicContact CD1-CB 4.14Å; Y210-A214 HydrophobicContact CE1-CB 3.56Å; Y210-A214 HydrophobicContact CE2-CB 4.34Å; Y210-A214 PolarHBondContact O-N 3.35Å; A214-L216 VanDerWaalsContact C-N 3.3Å; A214-L216 PolarHBondContact O-N 2.92Å; A214-V217 PolarHBondContact O-N 2.94Å; A214-S218 PolarHBondContact O-N 3.18Å
215	P	92.3	Very high	93.5	Very high	86 Å²	86	40.6 Å²	40.6	56%	0.558	22%	0.216	S	C	*	.	H	α-helix	trans	-64.4	-34.5	176	-20.3	33.8	0	0	0	113	V217 S218 S219	P215-V217 VanDerWaalsContact C-N 3.33Å; P215-S218 PolarHBondContact O-N 2.95Å; P215-S219 PolarHBondContact O-N 3.17Å; P215-S219 PolarHBondContact O-OG 3.46Å
216	L	93.1	Very high	93.3	Very high	21 Å²	21	36 Å²	36	11%	0.11	20%	0.195	C	C	.	.	H	α-helix	trans	-71.1	-30.5	178.1	-53.2	179.9	0	0	0	111.8	Q181 I184 L200 V213 A214 S219 G220 A221 V222	Q181-L216 HydrophobicContact CG-CD1 4.47Å; Q181-L216 HydrophobicContact CG-CD2 4.08Å; I184-L216 HydrophobicContact CD1-CD1 3.87Å; I184-L216 HydrophobicContact CG1-CD1 4.44Å; L200-L216 HydrophobicContact CD1-CD1 4.06Å; V213-L216 HydrophobicContact CG1-CD1 4.41Å; V213-L216 CarbonylContact O-C 3.6Å; V213-L216 WeakPolarHBondContact O-CA 3.27Å; V213-L216 WeakPolarHBondContact O-CB 3.3Å; V213-L216 PolarHBondContact O-N 3.46Å; A214-L216 VanDerWaalsContact C-N 3.3Å; A214-L216 PolarHBondContact O-N 2.92Å; L216-S219 PolarHBondContact O-OG 3.19Å; L216-S219 VanDerWaalsContact O-OG 3.12Å; L216-G220 PolarHBondContact O-N 3.02Å; L216-A221 PolarHBondContact O-N 3Å; L216-A221 VanDerWaalsContact O-N 3.1Å; L216-V222 HydrophobicContact CB-CB 4.44Å; L216-V222 HydrophobicContact CB-CG1 4.01Å; L216-V222 HydrophobicContact CB-CG2 3.67Å; L216-V222 HydrophobicContact CD1-CG1 4.2Å; L216-V222 PolarHBondContact O-N 2.87Å
217	V	94.2	Very high	93.3	Very high	5 Å²	5	35.2 Å²	35.2	3%	0.03	19%	0.194	C	C	.	.	H	α-helix	trans	-69.9	-42.1	173.2	175.1	0	0	0	0	110	N38 L46 Y210 V213 A214 P215 G220 V222 L224	N38-V217 HydrophobicContact CB-CG1 4.2Å; L46-V217 HydrophobicContact CD1-CG1 4.24Å; Y210-V217 HydrophobicContact CE2-CG2 4.37Å; V213-V217 WeakPolarHBondContact O-CG2 3.33Å; V213-V217 PolarHBondContact O-N 3.13Å; A214-V217 PolarHBondContact O-N 2.94Å; P215-V217 VanDerWaalsContact C-N 3.33Å; V217-G220 PolarHBondContact O-N 2.95Å; V217-V222 HydrophobicContact CB-CG2 4.45Å; V217-V222 HydrophobicContact CG2-CG2 3.63Å; V217-L224 HydrophobicContact CG2-CD1 4.36Å; V217-L224 HydrophobicContact CG2-CD2 3.79Å; V217-L224 HydrophobicContact CG2-CG 4.01Å
218	S	90.7	Very high	93.2	Very high	46 Å²	46	32.1 Å²	32.1	32%	0.322	18%	0.178	S	C	.	.	H	α-helix	trans	-63.2	-42.5	175.4	-82.5	0	0	0	0	112.6	E47 R49 A214 P215 G220	E47-S218 PolarHBondContact OE1-OG 3.32Å; R49-S218 PolarHBondContact NH2-O 3.26Å; A214-S218 PolarHBondContact O-N 3.18Å; P215-S218 PolarHBondContact O-N 2.95Å; S218-G220 VanDerWaalsContact C-N 3.26Å; S218-G220 PolarHBondContact O-N 3.46Å
219	S	91	Very high	93.4	Very high	78 Å²	78	33.2 Å²	33.2	55%	0.545	19%	0.185	S	C	.	.	H	α-helix	trans	-71.4	-20.2	177.8	69.7	0	0	0	0	113.6	P215 L216 A221	P215-S219 PolarHBondContact O-N 3.17Å; P215-S219 PolarHBondContact O-OG 3.46Å; L216-S219 PolarHBondContact O-OG 3.19Å; L216-S219 VanDerWaalsContact O-OG 3.12Å; S219-A221 VanDerWaalsContact C-N 3.34Å; S219-A221 WeakPolarHBondContact OG-CB 3.4Å; S219-A221 PolarHBondContact OG-N 2.96Å
220	G	91.4	Very high	93.4	Very high	15 Å²	15	33.1 Å²	33.1	16%	0.155	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	86.8	1.2	-176.5	0	0	0	0	0	114.5	L216 V217 S218 V222	L216-G220 PolarHBondContact O-N 3.02Å; V217-G220 PolarHBondContact O-N 2.95Å; S218-G220 VanDerWaalsContact C-N 3.26Å; S218-G220 PolarHBondContact O-N 3.46Å; G220-V222 PolarHBondContact O-N 3.37Å
221	A	93.6	Very high	93.3	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	20%	0.2	C	C	.	.	S	Bend	trans	-63.3	-25.5	177	0	0	0	0	0	113.1	K178 E179 Q181 L216 S219	K178-A221 WeakPolarHBondContact CA-O 3.23Å; K178-A221 WeakPolarHBondContact CB-O 3.3Å; K178-A221 PolarHBondContact N-O 3.45Å; E179-A221 HydrophobicContact CB-CB 4.18Å; E179-A221 PolarHBondContact N-O 3.41Å; E179-A221 VanDerWaalsContact N-O 3.09Å; Q181-A221 HydrophobicContact CG-CB 4.13Å; L216-A221 PolarHBondContact O-N 3Å; L216-A221 VanDerWaalsContact O-N 3.1Å; S219-A221 VanDerWaalsContact C-N 3.34Å; S219-A221 WeakPolarHBondContact OG-CB 3.4Å; S219-A221 PolarHBondContact OG-N 2.96Å
222	V	95.2	Very high	93.3	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	153.6	173.5	-54.3	0	0	0	0	111.7	L175 L216 V217 G220	L175-V222 HydrophobicContact CD1-CB 4.3Å; L175-V222 HydrophobicContact CD1-CG1 4.18Å; L216-V222 HydrophobicContact CB-CB 4.44Å; L216-V222 HydrophobicContact CB-CG1 4.01Å; L216-V222 HydrophobicContact CB-CG2 3.67Å; L216-V222 HydrophobicContact CD1-CG1 4.2Å; L216-V222 PolarHBondContact O-N 2.87Å; V217-V222 HydrophobicContact CB-CG2 4.45Å; V217-V222 HydrophobicContact CG2-CG2 3.63Å; G220-V222 PolarHBondContact O-N 3.37Å
223	Q	96.3	Very high	93.4	Very high	5 Å²	5	26.8 Å²	26.8	2%	0.023	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	126.2	177.6	174.6	66.6	60.5	0	0	109.3	Q34 L37 N38 L175 R176 K178 I225	Q34-Q223 VanDerWaalsContact CB-OE1 3.25Å; Q34-Q223 PolarHBondContact O-NE2 2.77Å; L37-Q223 VanDerWaalsContact CB-NE2 3.32Å; N38-Q223 PolarHBondContact OD1-NE2 2.83Å; L175-Q223 CarbonylContact C-O 3.59Å; L175-Q223 VanDerWaalsContact CA-O 3.29Å; L175-Q223 WeakPolarHBondContact CA-O 3.42Å; R176-Q223 PolarHBondContact N-O 2.97Å; R176-Q223 PolarHBondContact O-N 2.88Å; K178-Q223 HydrophobicContact CD-CB 4.25Å; K178-Q223 HydrophobicContact CG-CB 4.46Å; Q223-I225 HydrophobicContact CG-CG2 4.27Å
224	L	96.8	Very high	93.5	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	143.4	171.5	-52.4	-176.3	0	0	0	110.6	N38 F41 V173 F174 L175 Y210 V217	N38-L224 PolarHBondContact OD1-N 2.95Å; F41-L224 HydrophobicContact CB-CB 3.78Å; F41-L224 HydrophobicContact CB-CD1 4.11Å; F41-L224 HydrophobicContact CD2-CB 4.4Å; V173-L224 HydrophobicContact CB-CD2 4.15Å; V173-L224 HydrophobicContact CG2-CD2 3.79Å; F174-L224 WeakPolarHBondContact O-CA 3.47Å; L175-L224 HydrophobicContact CB-CD2 4.04Å; Y210-L224 HydrophobicContact CD2-CD1 4.31Å; Y210-L224 HydrophobicContact CE2-CD1 4.2Å; V217-L224 HydrophobicContact CG2-CD1 4.36Å; V217-L224 HydrophobicContact CG2-CD2 3.79Å; V217-L224 HydrophobicContact CG2-CG 4.01Å
225	I	94.3	Very high	93.5	Very high	77 Å²	77	30.3 Å²	30.3	40%	0.395	19%	0.194	S	C	.	.			trans	-136.6	0	-175.1	60.1	171.1	0	0	0	113.5	F41 F174 R176 Q205 Q223	F41-I225 VanDerWaalsContact CE2-C 3.43Å; F41-I225 VanDerWaalsContact CE2-OXT 3.23Å; F41-I225 WeakPolarHBondContact CE2-OXT 3.46Å; F41-I225 VanDerWaalsContact CZ-OXT 3.23Å; F41-I225 WeakPolarHBondContact CZ-OXT 3.31Å; F174-I225 HydrophobicContact CB-CG1 3.83Å; F174-I225 PolarHBondContact O-N 3.41Å; R176-I225 HydrophobicContact CB-CD1 4.38Å; R176-I225 HydrophobicContact CB-CG2 4.28Å; Q205-I225 HydrophobicContact CG-CD1 4.11Å; Q223-I225 HydrophobicContact CG-CG2 4.27Å

Retrieved 225 of 225 residues in 620.4 ms (Link to these results)

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